A0A087XXA5_POEFO Loading...

Zinc finger RNA-binding protein

AlphaFold DB , UniProt , Accession A0A087XXA5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,027 aa.

						>A0A087XXA5_POEFO|A0A087XXA5
MAASNYFGFTHGASPQYSTQPPTAYSHPSTASYSVQQAPAVAHAVTASYSPAPVQAARPVASSPYPAYQSHQAPPDYTYRQPDPPQSTTTPQTYQVYSDMQQDNYSYVRPAAVTTYDNKQYYQTSVASTQRTPTDNYYQTVSVGVKSAYSPAPSTAYSQPPLPQRQVTALKPLVPSSAVSTSYNIYPVSTSVQQPPTPISSYTPGSSFSSTVSATSYSGISYSSYDSIGYTSASTPSYYQPALSQPQPPPQQPQQPQPSIQPPPKQLTSSSWSTSGSNMVTTPTVNSYKKPTFHQNKLQRPKGPPKQSQLHYCDICKISCAGPQTYREHNEGQKHKKKEAALKAGGQTGTTNGPRGVQTQLRCELCDVSCTGVDAYAAHIRGAKHQKVVKLHTKLGKPIPSTEPVLVNSAPVTTNSTSGKPAASTSVSPSVSTVSTPVVTPKQLTVTTTAKTAPPIKKPAPTKITLTSNKPASSPAAASVMTVVTKEEPVQLSVQKMEPQTEDERSDQAGGQGDIQPVGHDYVEEVRNEDGKVIRFHCKLCECSFNDPNAKDMHLKGRRHRLQYKKKVNPELPVEIKPSNRARKLQESKLKKQKQKAVLKRQREDEQRWHMEMRRYEEDMYWRRMEEEQMYWGEQRRRMPPPPPPPLMSRPGMPVPPLLNCVRRPDSADDRHIMAKHSTIYPVEEELQAVQRIVSHSERALKLVSDSLLDKEEPAVPSTAAEGEATSAENPARMLKGVMRVGILAKGLLLRGDRNVELILLTAKKPTVSLLKSIAKQLPKELSTFSEDQYEVQAHPDEANIVICSSQEPKMQVTISLTSPLMREDTAAEKDKQAEGKAAEKDLSEKDPPDVLNRKKCLDNLASLRHAKWFQARANGLQSCVIVIRVLRDLCQRVPTWGKLPSWAMELLVEKVISSASGPLSPGEAMRRVLECISTGILLPDGPGLMDPCEKEPTDVLESMKLQAREDITASTQHALRLLAFRQIHKVLGMESLPASKANARNRKRRRDVSDTGEGEGEGKKDKKDEA
					

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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	35.3	Very low	51.4	Low	166 Å²	166	77.2 Å²	77.2	82%	0.818	45%	0.448	S	S	*	.				0	-65.9	0	-58	-31	-157.7	0	0	112.9	A3	M1-A3 PolarHBondContact O-N 2.74Å
2	A	30.5	Very low	49.8	Very low	59 Å²	59	77.8 Å²	77.8	49%	0.488	48%	0.483	S	S	.	.			trans	-75.1	76.1	-176.3	0	0	0	0	0	114
3	A	29.1	Very low	48.2	Very low	100 Å²	100	79.8 Å²	79.8	83%	0.826	51%	0.512	S	S	*	.	S	Bend	trans	-131.1	6.3	-179.5	0	0	0	0	0	115.2	M1	M1-A3 PolarHBondContact O-N 2.74Å
4	S	45.6	Very low	46.3	Very low	69 Å²	69	82.4 Å²	82.4	48%	0.483	53%	0.533	S	S	.	.			trans	-161.6	133.5	146.4	-174.8	0	0	0	0	109	Y6	S4-Y6 PolarHBondContact OG-N 2.74Å; S4-Y6 VanDerWaalsContact OG-N 3.17Å; S4-Y6 PolarHBondContact OG-O 2.85Å
5	N	62.4	Low	45.5	Very low	35 Å²	35	85.1 Å²	85.1	19%	0.187	55%	0.551	C	S	.	*	S	Bend	trans	-103.7	7.4	170.7	-70.2	-10	0	0	0	111.9	M739 R740 A745	N5-M739 WeakPolarHBondContact O-CA 3.39Å; N5-M739 WeakPolarHBondContact O-CE 3.27Å; N5-R740 HydrophobicContact CB-CB 4.49Å; N5-R740 PolarHBondContact O-N 3.05Å; N5-R740 VanDerWaalsContact O-N 3.14Å; N5-A745 PolarHBondContact ND2-O 3.27Å
6	Y	69.3	Low	45	Very low	123 Å²	123	90.7 Å²	90.7	48%	0.482	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	127.3	178.9	-176.1	-111.1	0	0	0	110.6	S4 M739	S4-Y6 PolarHBondContact OG-N 2.74Å; S4-Y6 VanDerWaalsContact OG-N 3.17Å; S4-Y6 PolarHBondContact OG-O 2.85Å; Y6-M739 HydrophobicContact CD2-CE 3.85Å; Y6-M739 HydrophobicContact CD2-CG 3.83Å; Y6-M739 HydrophobicContact CD2-SD 3.74Å; Y6-M739 HydrophobicContact CE2-CG 4.35Å; Y6-M739 HydrophobicContact CE2-SD 4.27Å; Y6-M739 HydrophobicContact CG-CE 4.44Å
7	F	71.5	Confident	43.9	Very low	69 Å²	69	99.1 Å²	99.1	30%	0.303	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.8	84.2	173.7	-168.2	-98.7	0	0	0	108.4	F9 E698 K702 G737 V738	F7-F9 HydrophobicContact CD1-CD1 4.27Å; F7-F9 AromaticContact CD1-CE1 3.8Å; F7-F9 HydrophobicContact CD1-CE1 3.8Å; F7-F9 HydrophobicContact CE1-CD1 4.35Å; F7-F9 AromaticContact CE1-CE1 3.96Å; F7-F9 HydrophobicContact CE1-CE1 3.96Å; F7-E698 HydrophobicContact CD1-CB 4.04Å; F7-E698 HydrophobicContact CE1-CB 4.18Å; F7-E698 VanDerWaalsContact CE1-O 3.26Å; F7-E698 WeakPolarHBondContact CE1-O 3.41Å; F7-E698 HydrophobicContact CG-CB 4.31Å; F7-K702 HydrophobicContact CE1-CB 4.19Å; F7-G737 WeakPolarHBondContact O-CA 3.31Å; F7-V738 HydrophobicContact CB-CB 4.46Å; F7-V738 PolarHBondContact N-O 2.86Å; F7-V738 PolarHBondContact O-N 2.87Å
8	G	65	Low	42.9	Very low	25 Å²	25	100.2 Å²	100.2	26%	0.258	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.7	146	-178.3	0	0	0	0	0	112.8
9	F	73.1	Confident	42	Very low	12 Å²	12	101.8 Å²	101.8	5%	0.053	61%	0.612	C	S	.	*			trans	-95.1	100.8	177.2	-57.8	-31	0	0	0	110.2	F7 L701 K702 S705 R733 L735 K736 V738 L760	F7-F9 HydrophobicContact CD1-CD1 4.27Å; F7-F9 AromaticContact CD1-CE1 3.8Å; F7-F9 HydrophobicContact CD1-CE1 3.8Å; F7-F9 HydrophobicContact CE1-CD1 4.35Å; F7-F9 AromaticContact CE1-CE1 3.96Å; F7-F9 HydrophobicContact CE1-CE1 3.96Å; F9-L701 HydrophobicContact CZ-CB 3.99Å; F9-L701 WeakPolarHBondContact CZ-O 3.4Å; F9-K702 HydrophobicContact CD1-CB 3.84Å; F9-K702 HydrophobicContact CD1-CD 4.41Å; F9-K702 HydrophobicContact CD1-CG 3.82Å; F9-K702 VanDerWaalsContact CE1-CA 3.49Å; F9-K702 HydrophobicContact CE1-CB 3.58Å; F9-K702 HydrophobicContact CE1-CG 4.12Å; F9-K702 HydrophobicContact CZ-CB 4.34Å; F9-S705 VanDerWaalsContact CD2-CB 3.42Å; F9-S705 WeakPolarHBondContact CD2-OG 3.28Å; F9-R733 PolarHBondContact O-NE 3.38Å; F9-L735 HydrophobicContact CD2-CB 3.91Å; F9-L735 WeakPolarHBondContact CD2-O 3.5Å; F9-L735 HydrophobicContact CE2-CB 3.88Å; F9-K736 PolarHBondContact N-O 3.15Å; F9-V738 HydrophobicContact CE1-CG2 4.3Å; F9-V738 HydrophobicContact CE2-CG2 4.44Å; F9-V738 HydrophobicContact CZ-CG2 3.67Å; F9-L760 HydrophobicContact CE2-CD1 4.06Å; F9-L760 HydrophobicContact CZ-CD1 4.45Å
10	T	45.4	Very low	41.2	Very low	95 Å²	95	105.5 Å²	105.5	58%	0.583	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-73.3	150.5	-178.1	56.6	0	0	0	0	112.3	R733	T10-R733 PolarHBondContact O-NH2 3.42Å
11	H	38.3	Very low	40.6	Very low	96 Å²	96	105.8 Å²	105.8	44%	0.444	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-71.2	172.9	166.8	-68.6	-104.1	0	0	0	111.2
12	G	32.1	Very low	40.2	Very low	84 Å²	84	104.1 Å²	104.1	87%	0.866	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.6	164.7	-170.6	0	0	0	0	0	115.6
13	A	29.3	Very low	40.1	Very low	104 Å²	104	107.6 Å²	107.6	86%	0.86	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-98.5	140.4	-169.6	0	0	0	0	0	114
14	S	21.9	Very low	39.9	Very low	116 Å²	116	107.5 Å²	107.5	81%	0.811	64%	0.643	S	S	*	*				-170.9	-170.9	128.4	60.8	0	0	0	0	109.6
15	P	34.2	Very low	39	Very low	123 Å²	123	115.2 Å²	115.2	80%	0.799	66%	0.664	S	S	*	*				-76.7	173.7	-117.4	38.7	-37.1	0	0	0	117.1
16	Q	37.8	Very low	37.3	Very low	175 Å²	175	118.9 Å²	118.9	82%	0.818	69%	0.692	S	S	*	*			trans	-61.3	143	-172.9	-59.9	178.4	-12.7	0	0	115.2
17	Y	25.4	Very low	35.3	Very low	234 Å²	234	121.3 Å²	121.3	92%	0.918	71%	0.707	S	S	*	*				-171.8	108.7	119.4	-106.7	-69.8	0	0	0	111.8
18	S	25.8	Very low	33.3	Very low	118 Å²	118	123.9 Å²	123.9	83%	0.825	73%	0.731	S	S	*	*			trans	-162	160.6	155	-160.2	0	0	0	0	111.9
19	T	26	Very low	31.5	Very low	132 Å²	132	128.5 Å²	128.5	81%	0.81	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.7	-162.7	45.2	0	0	0	0	115.6
20	Q	26.9	Very low	29.4	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.5	140.6	169.1	-72.7	-170.6	-10.2	0	0	112.2
21	P	28.3	Very low	28.5	Very low	111 Å²	111	134.4 Å²	134.4	72%	0.721	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.3	155.7	155.1	33.1	-33.1	0	0	0	110.9
22	P	26.9	Very low	27.9	Very low	132 Å²	132	135.6 Å²	135.6	86%	0.857	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-69.8	149.7	-171	27.7	-35.7	0	0	0	114.2
23	T	28.4	Very low	27.6	Very low	131 Å²	131	142.3 Å²	142.3	80%	0.804	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.8	123.3	-177.6	38.1	0	0	0	0	113.3
24	A	25.2	Very low	27.5	Very low	98 Å²	98	142.6 Å²	142.6	81%	0.81	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.5	138.3	170.1	0	0	0	0	0	111.4
25	Y	26.7	Very low	27.7	Very low	232 Å²	232	143.8 Å²	143.8	91%	0.91	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.7	137.8	179.3	-102.8	-110	0	0	0	112.5
26	S	25.4	Very low	27.4	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-92.4	136.2	171.2	51.3	0	0	0	0	111.8
27	H	27.3	Very low	26.9	Very low	175 Å²	175	147.7 Å²	147.7	81%	0.81	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-87.8	138.8	171.8	-75.9	-87.4	0	0	0	110.9	S29	H27-S29 PolarHBondContact O-N 2.9Å
28	P	29.7	Very low	27	Very low	123 Å²	123	140.9 Å²	140.9	80%	0.799	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.7	122.5	179.1	29.4	-33.6	0	0	0	111.6
29	S	27.7	Very low	27.2	Very low	122 Å²	122	141.4 Å²	141.4	85%	0.853	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.9	148.5	169.5	-67.9	0	0	0	0	111.5	H27	H27-S29 PolarHBondContact O-N 2.9Å
30	T	28.3	Very low	27.2	Very low	139 Å²	139	140 Å²	140	85%	0.853	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-88.4	120.9	-173.2	46.6	0	0	0	0	113.7
31	A	27.6	Very low	27.3	Very low	92 Å²	92	138.3 Å²	138.3	76%	0.76	83%	0.826	S	S	*	*			trans	29.7	104.1	149.2	0	0	0	0	0	119
32	S	25.6	Very low	27.1	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-82.3	144.2	146.5	45.8	0	0	0	0	110.1
33	Y	26.1	Very low	27.1	Very low	224 Å²	224	139 Å²	139	88%	0.878	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-83	132.3	170.5	-92.2	-103.7	0	0	0	109.9
34	S	26.8	Very low	27	Very low	110 Å²	110	137 Å²	137	77%	0.769	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-100.5	139.4	159.9	51.1	0	0	0	0	109.8
35	V	26	Very low	27.1	Very low	141 Å²	141	137.9 Å²	137.9	86%	0.855	81%	0.812	S	S	*	*			trans	-106.2	131.8	168.9	176.9	0	0	0	0	107.3
36	Q	26.7	Very low	27.1	Very low	185 Å²	185	133.3 Å²	133.3	86%	0.864	81%	0.809	S	S	*	*			trans	-131.5	137.4	177.2	-162.8	167.4	3.6	0	0	108.5
37	Q	28.7	Very low	27.2	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	81%	0.809	S	S	*	*			trans	-77.6	163.7	-171	-71.9	175.3	-24.6	0	0	112.8
38	A	26.9	Very low	27.2	Very low	91 Å²	91	129.2 Å²	129.2	75%	0.752	81%	0.806	S	S	*	*			trans	-104.8	163.8	-169.3	0	0	0	0	0	113.7
39	P	29.7	Very low	27.2	Very low	130 Å²	130	134.7 Å²	134.7	84%	0.844	81%	0.812	S	S	*	*			trans	-89.7	157.8	152.5	36	-30.8	0	0	0	111.4
40	A	27.1	Very low	27.2	Very low	101 Å²	101	134 Å²	134	84%	0.835	81%	0.808	S	S	*	*			trans	-141	147.8	-170.5	0	0	0	0	0	115.2
41	V	27.3	Very low	27.6	Very low	140 Å²	140	133.6 Å²	133.6	85%	0.848	81%	0.807	S	S	*	*			trans	-154.3	108.9	165.4	-171.5	0	0	0	0	105.2
42	A	25	Very low	27.7	Very low	72 Å²	72	133.7 Å²	133.7	60%	0.595	81%	0.808	S	S	*	*				62	138.7	79.6	0	0	0	0	0	114.7
43	H	27.5	Very low	28.2	Very low	187 Å²	187	134.1 Å²	134.1	87%	0.866	81%	0.808	S	S	*	*			cis	-167.7	168.3	-12.5	-97.1	-37.7	0	0	0	108.2
44	A	26.5	Very low	28.4	Very low	88 Å²	88	130 Å²	130	73%	0.727	81%	0.806	S	S	*	*			cis	-123.5	-98.5	-8	0	0	0	0	0	112.2
45	V	27.5	Very low	28.5	Very low	117 Å²	117	133.9 Å²	133.9	71%	0.709	81%	0.812	S	S	*	*			cis	-152.5	123.9	-1.5	178.2	0	0	0	0	109.3
46	T	26.4	Very low	28.6	Very low	135 Å²	135	131.3 Å²	131.3	83%	0.828	81%	0.805	S	S	*	*			trans	42	151.5	163.7	61.3	0	0	0	0	122.4
47	A	27.6	Very low	28.6	Very low	96 Å²	96	127 Å²	127	79%	0.793	80%	0.802	S	S	*	*			cis	-166.6	165.6	-21.2	0	0	0	0	0	109.1
48	S	26.9	Very low	28.8	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	80%	0.802	S	S	*	*			trans	-77.8	155.9	-175.8	51.3	0	0	0	0	115.8
49	Y	29.2	Very low	29.1	Very low	237 Å²	237	130.5 Å²	130.5	93%	0.929	80%	0.802	S	S	*	*			trans	-154.8	158.2	142.3	-113	-74.4	0	0	0	113.3
50	S	27	Very low	28.9	Very low	109 Å²	109	131.2 Å²	131.2	76%	0.762	80%	0.804	S	S	*	*			trans	-103	165.3	-171.7	-57.3	0	0	0	0	113.6
51	P	37.7	Very low	28.9	Very low	130 Å²	130	130.9 Å²	130.9	84%	0.844	80%	0.801	S	S	*	*			trans	-93.8	150.1	-174	36.3	-35.3	0	0	0	115.5
52	A	29.1	Very low	28.8	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	80%	0.803	S	S	*	*			trans	-170.9	172.2	172.1	0	0	0	0	0	110.3
53	P	36	Very low	29	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	81%	0.808	S	S	*	*			cis	-130.6	-150.9	-48.2	39.4	-22.9	0	0	0	112.3
54	V	31.1	Very low	29.1	Very low	137 Å²	137	128.3 Å²	128.3	83%	0.83	80%	0.803	S	S	*	*			trans	-110.2	144.6	-164.8	174.9	0	0	0	0	115
55	Q	29.4	Very low	29.1	Very low	191 Å²	191	133.9 Å²	133.9	89%	0.893	81%	0.807	S	S	*	*			trans	-172.9	166.7	155.8	-113.9	179.6	89.7	0	0	109.5
56	A	27.6	Very low	29.6	Very low	88 Å²	88	134 Å²	134	73%	0.727	81%	0.809	S	S	*	*			cis	-150	-167.7	-5.6	0	0	0	0	0	109.1
57	A	27.7	Very low	29.5	Very low	95 Å²	95	131.3 Å²	131.3	79%	0.785	80%	0.802	S	S	*	*			trans	-143.3	138.5	-175.1	0	0	0	0	0	118.1
58	R	32.8	Very low	29.5	Very low	242 Å²	242	137.9 Å²	137.9	91%	0.913	81%	0.807	S	S	*	*			trans	57.2	144.3	154.7	-76.2	-172.7	169.9	-169.9	-2.8	120.6
59	P	32.6	Very low	29.4	Very low	117 Å²	117	141 Å²	141	76%	0.76	81%	0.81	S	S	*	*				-146.1	152.7	94.2	38.3	-22.8	0	0	0	117.6
60	V	26.1	Very low	29.6	Very low	144 Å²	144	134.3 Å²	134.3	87%	0.873	80%	0.798	S	S	*	*			trans	51.5	158.7	142.8	-172.6	0	0	0	0	121
61	A	25.1	Very low	29.6	Very low	95 Å²	95	137.4 Å²	137.4	79%	0.785	80%	0.8	S	S	*	*			trans	-145	167.7	-171.9	0	0	0	0	0	113.6
62	S	25.4	Very low	29	Very low	128 Å²	128	139.5 Å²	139.5	90%	0.895	80%	0.799	S	S	*	*			trans	-158.6	149.2	159.7	56.4	0	0	0	0	112.4
63	S	29.3	Very low	28.7	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	80%	0.797	S	S	*	*			trans	-113.6	174	178.9	-175.1	0	0	0	0	110.9	Y65	S63-Y65 PolarHBondContact OG-N 3.5Å
64	P	31.1	Very low	28.8	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	79%	0.793	S	S	*	*				-146.7	135.8	103.8	35.5	-19	0	0	0	117.4
65	Y	25.2	Very low	29.6	Very low	206 Å²	206	136.7 Å²	136.7	81%	0.808	78%	0.783	S	S	*	*				31.1	162.4	125.4	-76.7	-87.8	0	0	0	123.4	S63	S63-Y65 PolarHBondContact OG-N 3.5Å
66	P	38.5	Very low	29.4	Very low	118 Å²	118	134.5 Å²	134.5	77%	0.766	78%	0.777	S	S	*	*			cis	-133.8	164	2.1	26.9	-3.2	0	0	0	119.4
67	A	24.4	Very low	29.4	Very low	80 Å²	80	140.2 Å²	140.2	66%	0.661	78%	0.782	S	S	*	*			trans	-17.1	158.6	158.5	0	0	0	0	0	123.3
68	Y	26.8	Very low	29.3	Very low	233 Å²	233	141.4 Å²	141.4	91%	0.914	78%	0.779	S	S	*	*				-154.7	167.3	103.7	-124.5	-89.7	0	0	0	113.9
69	Q	25.9	Very low	28.8	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	77%	0.771	S	S	*	*			trans	-132.2	166.7	-170.9	-176	171.2	-9.8	0	0	112.8
70	S	32.3	Very low	28.6	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	77%	0.771	S	S	*	*			trans	-85.3	143.5	-170.1	55.1	0	0	0	0	118
71	H	27.2	Very low	28.7	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.806	77%	0.765	S	S	*	*			trans	-164.8	154.9	158.6	-83.2	-85.7	0	0	0	108.6
72	Q	24.4	Very low	29.2	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.813	76%	0.764	S	S	*	*			cis	-153.9	-114.4	-21.8	-165.6	157	-20.8	0	0	112.3
73	A	23.7	Very low	29.2	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	76%	0.756	S	S	*	*			trans	-155.7	-171.7	-178.1	0	0	0	0	0	110.4
74	P	37.2	Very low	30.2	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	76%	0.758	S	S	*	*			cis	-133.8	-137	-3	45.2	-24.1	0	0	0	111.2
75	P	49.2	Very low	30.4	Very low	97 Å²	97	145.9 Å²	145.9	63%	0.63	76%	0.759	S	S	*	*			cis	-129.2	177.5	-32.9	39.5	-22.5	0	0	0	115.4
76	D	25	Very low	30.5	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	76%	0.763	S	S	*	*			trans	155.8	107.1	134.7	-84.3	-12.8	0	0	0	110.9
77	Y	26.8	Very low	29.8	Very low	209 Å²	209	145.2 Å²	145.2	82%	0.82	77%	0.766	S	S	*	*				59.3	124	90.1	-85.4	-80.8	0	0	0	114.4
78	T	25.2	Very low	30	Very low	119 Å²	119	147.8 Å²	147.8	73%	0.73	77%	0.773	S	S	*	*			cis	-149.5	179.5	17.6	-27.6	0	0	0	0	108.1
79	Y	24.3	Very low	29.9	Very low	187 Å²	187	143.3 Å²	143.3	73%	0.733	77%	0.771	S	S	*	*			cis	-144.3	-100.3	14.9	178.1	-135.6	0	0	0	114.4
80	R	26.5	Very low	30	Very low	201 Å²	201	141.3 Å²	141.3	76%	0.758	77%	0.77	S	S	*	*			trans	-153.4	146.1	-163.5	-84.1	-170.1	170	-167.5	-2.6	117.2
81	Q	28.8	Very low	30.2	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.762	77%	0.773	S	S	*	*				-19.6	172.9	130	-102.1	-170.9	-23	0	0	118.9
82	P	36.1	Very low	30.2	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	77%	0.772	S	S	*	*			cis	-147.7	174.9	36.4	44.1	-23.9	0	0	0	120.3
83	D	25.6	Very low	30.1	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	77%	0.771	S	S	*	*			trans	-100.3	176.7	156.8	-80.2	-62.9	0	0	0	110
84	P	49.8	Very low	30.2	Very low	112 Å²	112	144.4 Å²	144.4	73%	0.727	77%	0.771	S	S	*	*			cis	-119.9	-160.6	-31.6	37.9	-19.7	0	0	0	109.8
85	P	35.3	Very low	29.7	Very low	120 Å²	120	146.2 Å²	146.2	78%	0.779	77%	0.77	S	S	*	*				-153.9	-175.3	78.5	40.9	-19.9	0	0	0	116.1
86	Q	27.3	Very low	28.5	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	77%	0.768	S	S	*	*			trans	-107.3	141.3	162.8	-72.9	-176	-27.8	0	0	111.3
87	S	24.9	Very low	28.6	Very low	119 Å²	119	148.8 Å²	148.8	83%	0.832	77%	0.768	S	S	*	*			trans	-168	149.9	145.5	54.1	0	0	0	0	112.6
88	T	27.2	Very low	28.6	Very low	133 Å²	133	143.8 Å²	143.8	82%	0.816	76%	0.763	S	S	*	*			trans	-73.2	151.7	179.2	48.4	0	0	0	0	114.6
89	T	25.9	Very low	28.7	Very low	139 Å²	139	144.2 Å²	144.2	85%	0.853	76%	0.762	S	S	*	*			trans	-172.8	146.1	139.5	-89	0	0	0	0	111.4
90	T	28	Very low	28.8	Very low	129 Å²	129	141.9 Å²	141.9	79%	0.791	76%	0.759	S	S	*	*			trans	-109.8	155.4	166.3	44.5	0	0	0	0	108.7
91	P	35.1	Very low	28.8	Very low	113 Å²	113	139.4 Å²	139.4	73%	0.734	76%	0.756	S	S	*	*			cis	-152.9	-178.1	46.2	43.5	-21.8	0	0	0	118.7
92	Q	27.4	Very low	28.7	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	76%	0.756	S	S	*	*			trans	19.1	131.1	144.8	-66.1	-77.6	-1.2	0	0	121.5
93	T	23.8	Very low	28.3	Very low	131 Å²	131	140.4 Å²	140.4	80%	0.804	76%	0.755	S	S	*	*				-175.9	156.8	119	-76	0	0	0	0	112.6
94	Y	24.8	Very low	28.3	Very low	188 Å²	188	138.4 Å²	138.4	74%	0.737	74%	0.744	S	S	*	*			trans	-42.7	148	-175.6	-79.1	-116.1	0	0	0	118.1
95	Q	25.8	Very low	27.1	Very low	156 Å²	156	142.6 Å²	142.6	73%	0.729	75%	0.747	S	S	*	*				74.5	146.2	65.4	-124.2	-171.4	27.8	0	0	112.9
96	V	25.3	Very low	26.6	Very low	98 Å²	98	142.7 Å²	142.7	59%	0.594	75%	0.75	S	S	*	*			cis	-151.6	146.3	16.8	-157.6	0	0	0	0	109.7
97	Y	27.4	Very low	26.5	Very low	197 Å²	197	143.6 Å²	143.6	77%	0.773	75%	0.747	S	S	*	*				166.4	159.2	104.2	-98.6	-82	0	0	0	107.6
98	S	26	Very low	26.5	Very low	103 Å²	103	144.3 Å²	144.3	72%	0.72	75%	0.746	S	S	*	*			cis	-150.6	158.1	41	-49.7	0	0	0	0	115.9
99	D	28.1	Very low	26.3	Very low	129 Å²	129	148.8 Å²	148.8	69%	0.69	75%	0.748	S	S	*	*			trans	19.4	149.5	142.2	-59.5	-22.1	0	0	0	122.9
100	M	25.5	Very low	27	Very low	138 Å²	138	147.3 Å²	147.3	68%	0.68	74%	0.741	S	S	*	*			cis	-165.4	161.4	-5.7	-107.8	-91.4	89.3	0	0	110.7
101	Q	27.1	Very low	26.8	Very low	149 Å²	149	145.7 Å²	145.7	70%	0.696	74%	0.741	S	S	*	*			trans	19.6	134.7	158.8	-76.5	161.7	-27.4	0	0	121.5
102	Q	27	Very low	26.3	Very low	164 Å²	164	144.7 Å²	144.7	77%	0.766	74%	0.742	S	S	*	*			cis	68.5	118.8	10.2	-167.3	177.7	2.9	0	0	118.9
103	D	26.6	Very low	26.2	Very low	135 Å²	135	143.5 Å²	143.5	72%	0.722	75%	0.745	S	S	*	*			trans	-177.4	167.7	150.1	-98.5	-23.1	0	0	0	112
104	N	26.6	Very low	26.2	Very low	97 Å²	97	143.1 Å²	143.1	52%	0.519	74%	0.743	S	S	.	*				-161.1	168.9	-61.3	-121.8	-37.8	0	0	0	115
105	Y	24.8	Very low	26.2	Very low	200 Å²	200	140.5 Å²	140.5	78%	0.784	75%	0.747	S	S	*	*			trans	20.9	138.8	159	-69.6	-66	0	0	0	124.7
106	S	23.5	Very low	26.2	Very low	121 Å²	121	143.6 Å²	143.6	85%	0.846	75%	0.753	S	S	*	*				-162.1	179.2	107.6	-159.3	0	0	0	0	112.3
107	Y	25.4	Very low	26.3	Very low	210 Å²	210	144.3 Å²	144.3	82%	0.824	75%	0.754	S	S	*	*			trans	-144	-178.4	-159.3	-139.8	-101.9	0	0	0	114.1
108	V	24.8	Very low	26.2	Very low	135 Å²	135	138.5 Å²	138.5	82%	0.818	74%	0.736	S	S	*	*			trans	99.1	157.5	164.9	-168.2	0	0	0	0	118.2
109	R	23.8	Very low	26.4	Very low	227 Å²	227	139.7 Å²	139.7	86%	0.857	73%	0.729	S	S	*	*			trans	-113.7	-169.6	-163.5	-129.3	-176.5	175.4	-167.8	1	109.5
110	P	41.1	Very low	26.6	Very low	108 Å²	108	138.6 Å²	138.6	70%	0.701	72%	0.719	S	S	*	*			cis	-138.7	-177.8	-18.6	41.8	-23.8	0	0	0	116.5
111	A	23.4	Very low	26.6	Very low	95 Å²	95	138.1 Å²	138.1	79%	0.785	71%	0.711	S	S	*	*			trans	84.4	133	139.4	0	0	0	0	0	125.6
112	A	25.2	Very low	26.7	Very low	92 Å²	92	137.2 Å²	137.2	76%	0.76	70%	0.702	S	S	*	*			trans	80.7	123	130.4	0	0	0	0	0	126.3
113	V	23.6	Very low	26.7	Very low	140 Å²	140	136 Å²	136	85%	0.848	70%	0.696	S	S	*	*			trans	83.3	175.3	134.6	177.2	0	0	0	0	119.8
114	T	25.4	Very low	26.7	Very low	123 Å²	123	135.2 Å²	135.2	76%	0.755	70%	0.696	S	S	*	*			trans	-136.7	146.1	-137.8	52.6	0	0	0	0	118.7
115	T	24.6	Very low	26.7	Very low	134 Å²	134	134.8 Å²	134.8	82%	0.822	70%	0.701	S	S	*	*			trans	-162.2	165.3	153	35.9	0	0	0	0	109.2
116	Y	24.2	Very low	26.8	Very low	220 Å²	220	131.6 Å²	131.6	86%	0.863	70%	0.702	S	S	*	*			cis	83.2	133.8	15.4	-83.7	-112.1	0	0	0	117.6
117	D	27.3	Very low	26.7	Very low	114 Å²	114	130.3 Å²	130.3	61%	0.61	70%	0.699	S	S	*	*			cis	-152.9	-162	-20.8	-165.7	31.1	0	0	0	105	K119	D117-K119 IonicContact OD1-NZ 3.84Å; D117-K119 IonicContact OD2-NZ 3.42Å; D117-K119 PolarHBondContact OD2-NZ 3.31Å
118	N	26.5	Very low	26.7	Very low	74 Å²	74	125.8 Å²	125.8	40%	0.396	70%	0.698	S	S	.	*			cis	-156.8	-124.5	12.3	-165.6	-18.4	0	0	0	111.7	T274	N118-T274 WeakPolarHBondContact CB-OG1 3.37Å; N118-T274 WeakPolarHBondContact ND2-CB 3.38Å; N118-T274 PolarHBondContact ND2-OG1 3.23Å; N118-T274 PolarHBondContact OD1-OG1 2.95Å
119	K	30.8	Very low	26.6	Very low	129 Å²	129	124.8 Å²	124.8	56%	0.561	69%	0.692	S	S	*	*			trans	-151.9	-169.6	-158.7	-58.8	163.9	-158.8	71.6	0	114.4	D117 T274 S275	D117-K119 IonicContact OD1-NZ 3.84Å; D117-K119 IonicContact OD2-NZ 3.42Å; D117-K119 PolarHBondContact OD2-NZ 3.31Å; K119-T274 HydrophobicContact CB-CG2 3.8Å; K119-T274 PolarHBondContact N-OG1 2.84Å; K119-T274 CarbonylContact O-C 3.56Å; K119-T274 VanDerWaalsContact O-CG2 3.3Å; K119-T274 WeakPolarHBondContact O-CG2 3.28Å; K119-T274 PolarHBondContact O-OG1 2.85Å; K119-S275 WeakPolarHBondContact O-CA 3.26Å; K119-S275 VanDerWaalsContact O-CB 3.29Å; K119-S275 WeakPolarHBondContact O-CB 3.17Å; K119-S275 PolarHBondContact O-N 3.08Å
120	Q	30.6	Very low	26.5	Very low	105 Å²	105	121.3 Å²	121.3	49%	0.491	69%	0.686	S	S	.	*			trans	-170.1	178.9	144.8	78.1	175.4	154.6	0	0	110.1	S275 S277	Q120-S275 WeakPolarHBondContact CB-O 3.33Å; Q120-S275 WeakPolarHBondContact CG-O 3.32Å; Q120-S275 PolarHBondContact NE2-O 3.11Å; Q120-S275 PolarHBondContact OE1-O 3.19Å; Q120-S277 PolarHBondContact OE1-OG 3.06Å
121	Y	26	Very low	25.8	Very low	129 Å²	129	126.9 Å²	126.9	51%	0.506	69%	0.693	S	S	.	*			cis	-172.3	164	-22.8	-115.2	13.4	0	0	0	109.5	T274	Y121-T274 VanDerWaalsContact CD1-O 3.28Å; Y121-T274 WeakPolarHBondContact CD1-O 3.42Å; Y121-T274 WeakPolarHBondContact CE1-O 3.38Å
122	Y	28.9	Very low	25.6	Very low	129 Å²	129	128.7 Å²	128.7	51%	0.506	69%	0.694	S	S	.	*			cis	-165.1	156.6	-18.5	-156.8	35.2	0	0	0	111.6
123	Q	26.8	Very low	26.2	Very low	139 Å²	139	129.2 Å²	129.2	65%	0.65	69%	0.69	S	S	*	*			trans	54.9	155.5	155.4	-84.9	-177.9	-16.6	0	0	121
124	T	28	Very low	26.3	Very low	118 Å²	118	128.6 Å²	128.6	72%	0.724	69%	0.686	S	S	*	*			cis	-150	-166.4	9.9	-8.9	0	0	0	0	109.1
125	S	26.7	Very low	26.2	Very low	88 Å²	88	129.1 Å²	129.1	62%	0.615	69%	0.685	S	S	*	*			cis	-170.3	152.7	-9.6	41.9	0	0	0	0	111
126	V	25.1	Very low	26.2	Very low	134 Å²	134	129.4 Å²	129.4	81%	0.812	68%	0.681	S	S	*	*			trans	52.7	141.2	157.3	-59.8	0	0	0	0	121.1
127	A	21.9	Very low	26.2	Very low	94 Å²	94	127.3 Å²	127.3	78%	0.777	67%	0.673	S	S	*	*			cis	87.3	141	22.4	0	0	0	0	0	115.6
128	S	25	Very low	26	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	68%	0.678	S	S	*	*			cis	-162.4	-160.6	-4.4	52.3	0	0	0	0	109.2
129	T	22.6	Very low	25.9	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.693	69%	0.692	S	S	*	*			cis	-170	168.4	8.6	-165.6	0	0	0	0	113.3
130	Q	23.3	Very low	25.6	Very low	155 Å²	155	133.7 Å²	133.7	72%	0.724	70%	0.701	S	S	*	*			trans	59.3	163.2	165.4	-58.3	-170.9	10.4	0	0	120.7
131	R	24.7	Very low	25.2	Very low	225 Å²	225	135 Å²	135	85%	0.849	72%	0.716	S	S	*	*			cis	-136.8	-179.5	7.8	-86.5	-163.6	174.7	-176.2	-0.6	113.3
132	T	20.7	Very low	25.1	Very low	133 Å²	133	133.6 Å²	133.6	82%	0.816	73%	0.725	S	S	*	*			trans	-119.6	-166.8	-178.2	59.5	0	0	0	0	112.1
133	P	37.9	Very low	24.9	Very low	103 Å²	103	134.1 Å²	134.1	67%	0.669	74%	0.741	S	S	*	*			cis	-138.2	-162.7	-11.6	32	-6.5	0	0	0	116.1
134	T	26	Very low	24.7	Very low	126 Å²	126	130.4 Å²	130.4	77%	0.773	74%	0.74	S	S	*	*			trans	75.9	155.1	158.8	61.1	0	0	0	0	121.9
135	D	23.2	Very low	24.5	Very low	135 Å²	135	131.2 Å²	131.2	72%	0.722	74%	0.744	S	S	*	*			cis	-163.6	179.9	-43.9	-137.1	-56.9	0	0	0	112.3
136	N	23.7	Very low	24.4	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	76%	0.755	S	S	*	*			trans	-43.4	169.4	175.9	-78.7	-65	0	0	0	118.7
137	Y	23.3	Very low	24.3	Very low	176 Å²	176	135.1 Å²	135.1	69%	0.69	75%	0.753	S	S	*	*			cis	-177.5	-176.4	-15.2	177.6	-111	0	0	0	108.5
138	Y	24.2	Very low	24.3	Very low	179 Å²	179	134.7 Å²	134.7	70%	0.702	75%	0.75	S	S	*	*			trans	68.5	159.5	171.2	-87.7	-44.7	0	0	0	118.2
139	Q	23.8	Very low	24.2	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	76%	0.755	S	S	*	*			cis	-151.9	177	-13.7	-170	153.1	-8.8	0	0	111.4
140	T	24.4	Very low	24.3	Very low	121 Å²	121	139.6 Å²	139.6	74%	0.742	76%	0.755	S	S	*	*			trans	-96.3	-173.8	179.7	47.6	0	0	0	0	114.8
141	V	22.5	Very low	24.8	Very low	133 Å²	133	138.1 Å²	138.1	81%	0.806	76%	0.759	S	S	*	*			trans	108.1	166.9	163.1	-172.5	0	0	0	0	115.5
142	S	24.5	Very low	24.8	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	75%	0.751	S	S	*	*			trans	-145.4	-156.9	-137.9	59.4	0	0	0	0	114.6
143	V	24.4	Very low	25.5	Very low	140 Å²	140	130.9 Å²	130.9	85%	0.848	75%	0.75	S	S	*	*			trans	81.9	139.9	176.7	-168.9	0	0	0	0	114.3
144	G	23.3	Very low	24.9	Very low	61 Å²	61	131.2 Å²	131.2	63%	0.629	76%	0.755	S	S	*	*			cis	166.1	-162	-4.5	0	0	0	0	0	112.1
145	V	23.9	Very low	24.8	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	76%	0.759	S	S	*	*			trans	74.4	142.9	168.9	178.6	0	0	0	0	116.3
146	K	23.8	Very low	24.8	Very low	195 Å²	195	129.4 Å²	129.4	85%	0.848	76%	0.757	S	S	*	*			cis	-170.3	172.3	-23.6	-96.9	-174.1	-176	179.6	0	105.6
147	S	22.9	Very low	24.7	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	76%	0.764	S	S	*	*			cis	-175.4	-174.2	-30	-168.9	0	0	0	0	108.4
148	A	22.5	Very low	24.6	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	77%	0.766	S	S	*	*			trans	72.9	151	168.5	0	0	0	0	0	118.1
149	Y	23.3	Very low	24.7	Very low	230 Å²	230	130.4 Å²	130.4	90%	0.902	77%	0.774	S	S	*	*			cis	-148	178.8	-1.8	-148.9	-114.4	0	0	0	112
150	S	23.7	Very low	25.4	Very low	100 Å²	100	128.7 Å²	128.7	70%	0.699	78%	0.776	S	S	*	*			trans	-109.3	-173.9	-179.2	-129.6	0	0	0	0	111.9
151	P	34.5	Very low	25.8	Very low	124 Å²	124	128.5 Å²	128.5	81%	0.805	78%	0.777	S	S	*	*			cis	-141.6	-172.6	31.8	43.2	-22.1	0	0	0	117.7
152	A	24	Very low	26.5	Very low	84 Å²	84	130 Å²	130	69%	0.694	78%	0.78	S	S	*	*			trans	-93.2	173.9	175.2	0	0	0	0	0	113.5
153	P	34.8	Very low	27.1	Very low	122 Å²	122	130.5 Å²	130.5	79%	0.792	78%	0.78	S	S	*	*				-130.4	-160.9	89.8	23.6	-0.7	0	0	0	111.6
154	S	25.5	Very low	27.1	Very low	111 Å²	111	132.4 Å²	132.4	78%	0.776	78%	0.78	S	S	*	*			cis	-158.4	170.8	25.8	-54.9	0	0	0	0	115
155	T	24.8	Very low	27.2	Very low	140 Å²	140	139.6 Å²	139.6	86%	0.859	79%	0.788	S	S	*	*			trans	-85.1	177.6	171.3	44.9	0	0	0	0	113.2
156	A	23	Very low	27.4	Very low	82 Å²	82	141.4 Å²	141.4	68%	0.678	79%	0.788	S	S	*	*			cis	-174.9	159.1	-33.8	0	0	0	0	0	110.9
157	Y	20.8	Very low	27.6	Very low	227 Å²	227	136.5 Å²	136.5	89%	0.89	77%	0.774	S	S	*	*			trans	63.1	150.2	152.9	-99.9	-90.7	0	0	0	124.3
158	S	22.6	Very low	28	Very low	106 Å²	106	138 Å²	138	74%	0.741	78%	0.779	S	S	*	*			trans	84.9	119.8	150.3	-65.3	0	0	0	0	124.2
159	Q	25	Very low	28.4	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	78%	0.777	S	S	*	*			trans	-23.2	170.2	141.2	-67.6	-177.1	-0.1	0	0	118
160	P	39.7	Very low	28.6	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	77%	0.773	S	S	*	*			cis	-125.6	-135.4	15.8	31.1	-5.2	0	0	0	110.5
161	P	32.9	Very low	28.9	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	78%	0.777	S	S	*	*			cis	-137.6	-169.3	-14	42.7	-22.7	0	0	0	116.5
162	L	37.6	Very low	29.5	Very low	166 Å²	166	136.9 Å²	136.9	87%	0.869	77%	0.769	S	S	*	*			trans	-142	152.7	165.1	-88.6	164.3	0	0	0	109.2
163	P	35.8	Very low	29.5	Very low	109 Å²	109	140.6 Å²	140.6	71%	0.708	78%	0.776	S	S	*	*			trans	-135.3	135	136.5	10.8	12.1	0	0	0	112.8
164	Q	24.3	Very low	29.2	Very low	180 Å²	180	141 Å²	141	84%	0.841	78%	0.776	S	S	*	*				63.9	127.2	89.5	-64.8	-175.7	-15.7	0	0	115
165	R	26.9	Very low	30.4	Very low	211 Å²	211	141 Å²	141	80%	0.796	77%	0.773	S	S	*	*			cis	85.7	135.9	38.5	-166.9	-152.3	-173.2	-155.4	6.5	114
166	Q	27.4	Very low	30.5	Very low	172 Å²	172	139.4 Å²	139.4	80%	0.804	77%	0.768	S	S	*	*			trans	-151.4	174.4	149.9	-116.9	-67.9	52.8	0	0	111.1
167	V	28.8	Very low	30.7	Very low	92 Å²	92	140.5 Å²	140.5	56%	0.558	77%	0.771	S	S	*	*			trans	-143.3	135	-172.6	173.8	0	0	0	0	113.4
168	T	29.5	Very low	31	Very low	141 Å²	141	133.9 Å²	133.9	87%	0.865	76%	0.763	S	S	*	*			trans	-177.4	148.7	171.4	-85.1	0	0	0	0	107.7
169	A	30.6	Very low	31.1	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	76%	0.763	S	S	*	*			cis	-164.6	179.2	-26.7	0	0	0	0	0	105.7
170	L	28	Very low	31.3	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	76%	0.76	S	S	*	*			cis	-130.2	164.8	8.7	-75.4	165.1	0	0	0	107.8
171	K	31.3	Very low	30.6	Very low	182 Å²	182	131 Å²	131	79%	0.791	76%	0.756	S	S	*	*			cis	88.1	145.9	32.6	-90.4	-154	166.8	-175.3	0	115.5
172	P	46.6	Very low	30.4	Very low	98 Å²	98	130 Å²	130	64%	0.636	75%	0.752	S	S	*	*			cis	-144	165.4	-31.2	35.4	-16.9	0	0	0	116.3
173	L	23.3	Very low	30	Very low	162 Å²	162	131.4 Å²	131.4	85%	0.848	75%	0.747	S	S	*	*				167.5	161.7	119.5	-89.6	166.5	0	0	0	115.4
174	V	28.3	Very low	29.7	Very low	131 Å²	131	132.2 Å²	132.2	79%	0.794	75%	0.745	S	S	*	*			trans	-165.1	178.4	-176.6	-117.4	0	0	0	0	106.8
175	P	51.9	Low	29.8	Very low	109 Å²	109	131.5 Å²	131.5	71%	0.708	75%	0.746	S	S	*	*			cis	-137.8	-157.6	3.4	36.4	-12.2	0	0	0	115.1
176	S	27.4	Very low	30.1	Very low	108 Å²	108	131 Å²	131	76%	0.755	75%	0.745	S	S	*	*			trans	78.2	158.3	153.6	-63.2	0	0	0	0	119.5
177	S	26.3	Very low	31	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	74%	0.743	S	S	*	*			cis	-175.2	147.3	-25.7	55.7	0	0	0	0	113.2
178	A	26.5	Very low	31.1	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	75%	0.749	S	S	*	*			trans	68.3	165	150.8	0	0	0	0	0	122.2
179	V	24.7	Very low	31.4	Very low	123 Å²	123	127.3 Å²	127.3	75%	0.745	74%	0.741	S	S	*	*			trans	66.9	133.6	170.9	-142.6	0	0	0	0	114.6
180	S	28.6	Very low	31.6	Very low	112 Å²	112	129.4 Å²	129.4	78%	0.783	75%	0.745	S	S	*	*			cis	79.1	161.1	32.9	-71.7	0	0	0	0	116.2
181	T	26.4	Very low	32	Very low	110 Å²	110	127.1 Å²	127.1	68%	0.675	74%	0.742	S	S	*	*			trans	80.4	117.7	-170.2	-31.3	0	0	0	0	112.5	Y183	T181-Y183 HydrophobicContact CG2-CD2 4.22Å
182	S	29.3	Very low	32	Very low	95 Å²	95	123.9 Å²	123.9	66%	0.664	74%	0.737	S	S	*	*			cis	94.8	167.4	17.9	95.8	0	0	0	0	116.6
183	Y	28.3	Very low	31.2	Very low	195 Å²	195	128 Å²	128	77%	0.765	75%	0.748	S	S	*	*			trans	76.3	120.4	-165.2	-63.7	-93.5	0	0	0	114.8	T181	T181-Y183 HydrophobicContact CG2-CD2 4.22Å
184	N	30.3	Very low	31.4	Very low	125 Å²	125	128.8 Å²	128.8	67%	0.668	75%	0.747	S	S	*	*			cis	89.9	132.4	38.4	-75.8	-41.4	0	0	0	113.9
185	I	26	Very low	32.7	Very low	166 Å²	166	128 Å²	128	85%	0.851	75%	0.745	S	S	*	*				-170.7	138.1	123.5	-95.9	152.3	0	0	0	110.1
186	Y	33	Very low	32.3	Very low	199 Å²	199	128.4 Å²	128.4	78%	0.78	75%	0.748	S	S	*	*			trans	-106.8	152.1	171.4	-93.7	-88.3	0	0	0	108.9	V188	Y186-V188 HydrophobicContact CD1-CG2 4.13Å
187	P	46.7	Very low	32.4	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	75%	0.751	S	S	*	*				-136.5	159.8	88.3	16.5	7.3	0	0	0	113.1
188	V	30.7	Very low	33.8	Very low	114 Å²	114	129.5 Å²	129.5	69%	0.691	75%	0.747	S	S	*	*			cis	78.7	118.6	33.8	174	0	0	0	0	112.9	Y186	Y186-V188 HydrophobicContact CD1-CG2 4.13Å
189	S	35.1	Very low	34	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	75%	0.753	S	S	*	*			cis	-154.4	-148.7	-8.1	-89.4	0	0	0	0	107.3
190	T	34.9	Very low	34.6	Very low	125 Å²	125	132.5 Å²	132.5	77%	0.767	75%	0.754	S	S	*	*			cis	-167.6	158.4	12.7	-31.7	0	0	0	0	111.4
191	S	36	Very low	34.7	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	75%	0.751	S	S	*	*			trans	63.1	153.8	158.8	72.2	0	0	0	0	119.1
192	V	31.3	Very low	34.7	Very low	114 Å²	114	136.9 Å²	136.9	69%	0.691	76%	0.758	S	S	*	*			cis	-140.9	139.9	21	179.5	0	0	0	0	113.5
193	Q	29.9	Very low	34.6	Very low	184 Å²	184	138 Å²	138	86%	0.86	76%	0.762	S	S	*	*			trans	66.6	161.9	158.3	-76.6	169.4	-34	0	0	124.1
194	Q	28	Very low	35.2	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	76%	0.764	S	S	*	*			trans	-145.8	-156	-170.1	-48.6	173.4	-32.4	0	0	107.2
195	P	54.7	Low	35	Very low	113 Å²	113	132 Å²	132	73%	0.734	77%	0.765	S	S	*	*			cis	-124.6	-158.5	-24.3	26.7	-1	0	0	0	110
196	P	44.5	Very low	35.1	Very low	119 Å²	119	129.4 Å²	129.4	77%	0.773	76%	0.761	S	S	*	*			cis	-127.8	-165.5	0.3	43.5	-24.8	0	0	0	115.6
197	T	29.3	Very low	34.9	Very low	135 Å²	135	124.6 Å²	124.6	83%	0.828	76%	0.757	S	S	*	*			trans	-140.4	-142.2	-150	48.2	0	0	0	0	114.5
198	P	56.2	Low	34.1	Very low	100 Å²	100	128.9 Å²	128.9	65%	0.649	76%	0.764	S	S	*	*				-143.7	-160.4	-104.7	48.2	-28.5	0	0	0	117.7
199	I	30.4	Very low	34	Very low	165 Å²	165	128.2 Å²	128.2	85%	0.846	76%	0.764	S	S	*	*			trans	82.6	163.9	151	-75.7	170.3	0	0	0	119.1
200	S	36.7	Very low	33.6	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	76%	0.764	S	S	*	*			trans	-143.3	142.5	-167.9	164.4	0	0	0	0	112.1
201	S	30.1	Very low	33.3	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	77%	0.766	S	S	*	*			trans	-178.2	144.9	153.8	43.4	0	0	0	0	116.5
202	Y	26.9	Very low	32.9	Very low	209 Å²	209	130.1 Å²	130.1	82%	0.82	77%	0.771	S	S	*	*			trans	53.1	113.2	144.9	-86.5	-102.6	0	0	0	125.1
203	T	28	Very low	32.6	Very low	120 Å²	120	129.9 Å²	129.9	74%	0.736	78%	0.775	S	S	*	*			trans	53	165.2	130.4	57.3	0	0	0	0	123.1
204	P	40.9	Very low	32.5	Very low	126 Å²	126	125.5 Å²	125.5	82%	0.818	77%	0.77	S	S	*	*			cis	-131.5	-173.5	-23.4	38.4	-20.5	0	0	0	114.4
205	G	24.5	Very low	32.6	Very low	66 Å²	66	123.1 Å²	123.1	68%	0.68	77%	0.768	S	S	*	*			trans	112.5	108.6	138.9	0	0	0	0	0	122.2
206	S	28.8	Very low	31.5	Very low	112 Å²	112	122.4 Å²	122.4	78%	0.783	77%	0.765	S	S	*	*			trans	46.7	133.5	140.6	57.1	0	0	0	0	125.2
207	S	29.2	Very low	30.7	Very low	99 Å²	99	127.7 Å²	127.7	69%	0.692	77%	0.772	S	S	*	*			trans	59.6	124.5	147.6	61.2	0	0	0	0	119.4
208	F	30.3	Very low	30.9	Very low	207 Å²	207	125.3 Å²	125.3	91%	0.908	76%	0.76	S	S	*	*				-157.2	-176.4	69.1	-121	-94.5	0	0	0	113.8
209	S	27.6	Very low	29.6	Very low	99 Å²	99	123.8 Å²	123.8	69%	0.692	76%	0.763	S	S	*	*			trans	-98.1	163.8	177.1	177.1	0	0	0	0	113.3
210	S	28.2	Very low	29.6	Very low	98 Å²	98	123.4 Å²	123.4	69%	0.685	76%	0.761	S	S	*	*			trans	108	109	146.9	-54.2	0	0	0	0	118.9
211	T	28.5	Very low	29.3	Very low	130 Å²	130	123.3 Å²	123.3	80%	0.798	76%	0.761	S	S	*	*			trans	15.6	136.7	134.5	56.1	0	0	0	0	120.9
212	V	26.4	Very low	29.1	Very low	143 Å²	143	127.5 Å²	127.5	87%	0.867	76%	0.762	S	S	*	*				-164.2	164.8	108.1	149.9	0	0	0	0	108.6
213	S	26.3	Very low	29.4	Very low	110 Å²	110	121 Å²	121	77%	0.769	75%	0.747	S	S	*	*			trans	-113.8	173.5	-167.3	-52.4	0	0	0	0	114.6
214	A	27.4	Very low	29.5	Very low	92 Å²	92	120 Å²	120	76%	0.76	75%	0.745	S	S	*	*			trans	75.4	165.1	161.2	0	0	0	0	0	116.4
215	T	29.8	Very low	29.1	Very low	128 Å²	128	123 Å²	123	79%	0.785	74%	0.741	S	S	*	*			cis	-145.8	148.7	11.9	-36.9	0	0	0	0	114.3
216	S	32.3	Very low	29.4	Very low	98 Å²	98	124.8 Å²	124.8	69%	0.685	74%	0.735	S	S	*	*			trans	-22.6	165.1	166.6	-40.1	0	0	0	0	123.5
217	Y	27.1	Very low	29.1	Very low	231 Å²	231	125 Å²	125	91%	0.906	74%	0.737	S	S	*	*			trans	-135.4	162.5	130.4	-158	-99.7	0	0	0	111.4
218	S	33.2	Very low	29.2	Very low	84 Å²	84	128.1 Å²	128.1	59%	0.587	74%	0.744	S	S	*	*			trans	-145.1	164.8	-154.9	-53.8	0	0	0	0	115.3
219	G	28.1	Very low	29.1	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	73%	0.731	S	S	*	*			trans	176	88	168.9	0	0	0	0	0	111.7
220	I	31.9	Very low	29.2	Very low	156 Å²	156	127.3 Å²	127.3	80%	0.8	74%	0.74	S	S	*	*				72.9	119.4	75.6	-60.9	164.5	0	0	0	110
221	S	30	Very low	29.2	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	74%	0.743	S	S	*	*			cis	-153.7	170.6	47.4	-105.9	0	0	0	0	112.3
222	Y	26.1	Very low	29.1	Very low	192 Å²	192	127.6 Å²	127.6	75%	0.753	74%	0.742	S	S	*	*			cis	-154.3	-89.6	-11.5	175.2	-130.7	0	0	0	113.5
223	S	33	Very low	29.1	Very low	73 Å²	73	125.9 Å²	125.9	51%	0.51	74%	0.743	S	S	.	*			trans	-174.1	164.3	-163.2	-90.9	0	0	0	0	111.9
224	S	29.3	Very low	29.4	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	75%	0.746	S	S	*	*			cis	86.6	145.8	25.1	105.5	0	0	0	0	116.5
225	Y	32.9	Very low	29.5	Very low	188 Å²	188	128.9 Å²	128.9	74%	0.737	75%	0.753	S	S	*	*			trans	-178.1	151.4	157.8	-118.8	-131	0	0	0	108.3
226	D	31	Very low	30.8	Very low	105 Å²	105	128.3 Å²	128.3	56%	0.561	75%	0.751	S	S	*	*			cis	-156.2	161.9	-1.3	-164.7	5.8	0	0	0	111.1
227	S	23.3	Very low	30.6	Very low	117 Å²	117	129.3 Å²	129.3	82%	0.818	76%	0.758	S	S	*	*			trans	176.2	115.6	144.3	-81.5	0	0	0	0	113.5
228	I	29.6	Very low	30.7	Very low	164 Å²	164	127.6 Å²	127.6	84%	0.841	75%	0.752	S	S	*	*			trans	-141.8	145.6	167.5	-56.1	175.2	0	0	0	106.3
229	G	28.1	Very low	30.6	Very low	61 Å²	61	131.9 Å²	131.9	63%	0.629	76%	0.756	S	S	*	*			cis	163.2	160.5	-7	0	0	0	0	0	111.8
230	Y	30	Very low	30.6	Very low	228 Å²	228	137 Å²	137	89%	0.894	76%	0.761	S	S	*	*			trans	66.1	152.7	158.8	-95.4	-84.7	0	0	0	124
231	T	28	Very low	31.4	Very low	121 Å²	121	135 Å²	135	74%	0.742	76%	0.759	S	S	*	*			trans	85.8	107.7	159.9	54.4	0	0	0	0	123.8
232	S	27.6	Very low	31.3	Very low	112 Å²	112	134 Å²	134	78%	0.783	76%	0.756	S	S	*	*				66.7	117.2	114.6	-51.4	0	0	0	0	125.3
233	A	25.4	Very low	31.4	Very low	107 Å²	107	131.7 Å²	131.7	88%	0.884	76%	0.757	S	S	*	*			trans	77.4	164.6	138.3	0	0	0	0	0	121
234	S	33.4	Very low	31.3	Very low	117 Å²	117	133 Å²	133	82%	0.818	77%	0.765	S	S	*	*			trans	-124	150.3	-153	-36.5	0	0	0	0	114.8
235	T	29.3	Very low	31.5	Very low	148 Å²	148	136.7 Å²	136.7	91%	0.908	77%	0.772	S	S	*	*			trans	-156.2	162.3	158.7	15.8	0	0	0	0	110.8
236	P	57.2	Low	31.8	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	77%	0.772	S	S	*	*			trans	-114.5	154	-150.3	40.2	-34.8	0	0	0	118.7
237	S	28.4	Very low	31.5	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	79%	0.786	S	S	*	*			trans	-176.7	159.7	160.9	-80.4	0	0	0	0	112
238	Y	29.6	Very low	32.9	Very low	195 Å²	195	136.6 Å²	136.6	77%	0.765	78%	0.782	S	S	*	*			cis	-164.9	144.4	-34.2	-161.3	-116.9	0	0	0	111.9
239	Y	29.5	Very low	34.2	Very low	174 Å²	174	134.3 Å²	134.3	68%	0.682	78%	0.777	S	S	*	*			trans	59.4	141	164.7	-106.5	-123.6	0	0	0	124.5
240	Q	30.1	Very low	35.8	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	78%	0.782	S	S	*	*			trans	67.7	146.4	167.3	-73.2	173.2	-79.2	0	0	119.9
241	P	47	Very low	35.6	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	78%	0.784	S	S	*	*			trans	-120	-157.1	-152	40	-20.1	0	0	0	112.1
242	A	28.1	Very low	35.7	Very low	86 Å²	86	138.4 Å²	138.4	71%	0.711	79%	0.789	S	S	*	*			cis	-167.7	170.5	16	0	0	0	0	0	110.3
243	L	29.3	Very low	36.7	Very low	145 Å²	145	137.8 Å²	137.8	76%	0.759	78%	0.783	S	S	*	*			cis	-171.7	148.6	-27.3	-116.4	176	0	0	0	109.7
244	S	29.3	Very low	36.8	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	78%	0.779	S	S	*	*			trans	60	144.8	152.7	59.3	0	0	0	0	121.2
245	Q	33.8	Very low	36.6	Very low	177 Å²	177	143.1 Å²	143.1	83%	0.827	78%	0.777	S	S	*	*			cis	-176.4	-174.3	-8.4	-108.9	-160.6	-1.2	0	0	108.5
246	P	40.7	Very low	37.4	Very low	113 Å²	113	140.7 Å²	140.7	73%	0.734	76%	0.764	S	S	*	*			cis	-138.6	-136.5	-44.7	42.7	-23.2	0	0	0	113.5
247	Q	24.1	Very low	36.1	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	77%	0.768	S	S	*	*			trans	-102.9	-174.2	-168.7	-109.4	-172.2	-31.5	0	0	114.4
248	P	52.1	Low	37	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	77%	0.768	S	S	*	*			trans	-93.8	-143.5	-163.6	40.5	-39	0	0	0	117.9
249	P	57.2	Low	36.8	Very low	115 Å²	115	139.9 Å²	139.9	75%	0.747	77%	0.766	S	S	*	*				-107.8	-159.8	-122.6	45.4	-29.4	0	0	0	114.6
250	P	61.3	Low	36.8	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	78%	0.775	S	S	*	*			cis	-126.3	-179.6	-33.4	39.2	-24.8	0	0	0	113.7
251	Q	26.1	Very low	36.6	Very low	202 Å²	202	139.7 Å²	139.7	94%	0.944	78%	0.775	S	S	*	*			trans	-177.6	-179.9	144	-105.1	169.1	41.7	0	0	117
252	Q	29.9	Very low	36.5	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	77%	0.773	S	S	*	*			trans	-119.5	-175.4	-173.3	-115.8	-175.3	12.4	0	0	111.1
253	P	48.4	Very low	37.6	Very low	100 Å²	100	140.5 Å²	140.5	65%	0.649	77%	0.773	S	S	*	*			cis	-147.9	-179.3	28.7	44.7	-24	0	0	0	119.5
254	Q	28.3	Very low	38.3	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	77%	0.768	S	S	*	*			trans	55.5	153	151.8	-78.9	174.6	-8.5	0	0	121
255	Q	28.6	Very low	38.1	Very low	164 Å²	164	142.3 Å²	142.3	77%	0.766	77%	0.772	S	S	*	*			cis	-170.8	-174.6	-23.3	-120.3	-167.3	-3	0	0	107
256	P	45.7	Very low	37.8	Very low	97 Å²	97	141.3 Å²	141.3	63%	0.63	77%	0.768	S	S	*	*			cis	-131.4	161.4	-8.1	39.6	-22.9	0	0	0	116.9
257	Q	30.5	Very low	37.1	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	77%	0.77	S	S	*	*			trans	46.7	154.5	148.4	-69.9	-178.4	-33.8	0	0	122.4
258	P	46.9	Very low	37.1	Very low	126 Å²	126	141 Å²	141	82%	0.818	77%	0.77	S	S	*	*			cis	-124.1	-144.3	8.6	43.7	-28.1	0	0	0	113.2
259	S	26.4	Very low	35.7	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	77%	0.767	S	S	*	*			trans	-162.6	168.7	174.4	68.3	0	0	0	0	111
260	I	29.3	Very low	34.3	Very low	170 Å²	170	139.3 Å²	139.3	87%	0.872	76%	0.764	S	S	*	*			trans	166.8	155.3	154.3	-89.6	156.2	0	0	0	112.5
261	Q	26.1	Very low	32.8	Very low	175 Å²	175	139 Å²	139	82%	0.818	76%	0.764	S	S	*	*			trans	-104.8	-158.6	174.5	-53	177.5	-27.3	0	0	111
262	P	44.8	Very low	32.8	Very low	112 Å²	112	140.3 Å²	140.3	73%	0.727	76%	0.76	S	S	*	*			cis	-114.1	-91.2	-35.3	14.2	8.7	0	0	0	116.6
263	P	50.3	Low	32.8	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	74%	0.741	S	S	*	*			trans	-118.5	-160.6	-145.8	43.2	-23.3	0	0	0	112.3
264	P	43.9	Very low	31.7	Very low	102 Å²	102	131.3 Å²	131.3	66%	0.662	72%	0.719	S	S	*	*			cis	-146.6	-175.7	5	44.4	-23.7	0	0	0	118.7
265	K	26.2	Very low	31.7	Very low	179 Å²	179	127 Å²	127	78%	0.778	71%	0.708	S	S	*	*			trans	60	130.1	140.8	-80.5	169.4	-177.8	177.4	0	123.8
266	Q	26.3	Very low	31.7	Very low	156 Å²	156	122.3 Å²	122.3	73%	0.729	70%	0.703	S	S	*	*				88.7	128.4	127.1	-83.7	-176.3	-29.4	0	0	124.1
267	L	25.9	Very low	31.1	Very low	151 Å²	151	122.2 Å²	122.2	79%	0.791	71%	0.705	S	S	*	*			trans	68	164.5	146.6	-58	166.1	0	0	0	116.1
268	T	25.1	Very low	31.1	Very low	137 Å²	137	120.7 Å²	120.7	84%	0.84	70%	0.703	S	S	*	*			cis	-127.7	-158	10	52.8	0	0	0	0	113.2
269	S	23.5	Very low	30.3	Very low	97 Å²	97	122.1 Å²	122.1	68%	0.678	70%	0.7	S	S	*	*			trans	-113.9	173.2	-157.5	56.5	0	0	0	0	116.1
270	S	27.8	Very low	30.4	Very low	96 Å²	96	122.5 Å²	122.5	67%	0.671	70%	0.699	S	S	*	*			trans	62.6	135.9	148.3	47.8	0	0	0	0	119.4
271	S	29.6	Very low	30.3	Very low	104 Å²	104	120.9 Å²	120.9	73%	0.727	70%	0.696	S	S	*	*			cis	84.7	134.8	37.5	-61.6	0	0	0	0	115.6
272	W	25.4	Very low	30.4	Very low	230 Å²	230	118.8 Å²	118.8	87%	0.871	70%	0.696	S	S	*	*			trans	91.4	-174.3	-177.5	-53.1	-24.2	0	0	0	115
273	S	30.4	Very low	30.4	Very low	63 Å²	63	118.2 Å²	118.2	44%	0.441	69%	0.692	S	S	.	*				-155.4	154.3	-71	-78.2	0	0	0	0	112.9
274	T	25.4	Very low	29.4	Very low	31 Å²	31	119.4 Å²	119.4	19%	0.19	70%	0.698	C	S	.	*			cis	110.7	143	-13.6	-146.1	0	0	0	0	119.1	N118 K119 Y121	N118-T274 WeakPolarHBondContact CB-OG1 3.37Å; N118-T274 WeakPolarHBondContact ND2-CB 3.38Å; N118-T274 PolarHBondContact ND2-OG1 3.23Å; N118-T274 PolarHBondContact OD1-OG1 2.95Å; K119-T274 HydrophobicContact CB-CG2 3.8Å; K119-T274 PolarHBondContact N-OG1 2.84Å; K119-T274 CarbonylContact O-C 3.56Å; K119-T274 VanDerWaalsContact O-CG2 3.3Å; K119-T274 WeakPolarHBondContact O-CG2 3.28Å; K119-T274 PolarHBondContact O-OG1 2.85Å; Y121-T274 VanDerWaalsContact CD1-O 3.28Å; Y121-T274 WeakPolarHBondContact CD1-O 3.42Å; Y121-T274 WeakPolarHBondContact CE1-O 3.38Å
275	S	27.8	Very low	28.6	Very low	81 Å²	81	120.3 Å²	120.3	57%	0.566	70%	0.701	S	S	*	*			cis	179.5	151.1	-28.7	-167.7	0	0	0	0	111.2	K119 Q120	K119-S275 WeakPolarHBondContact O-CA 3.26Å; K119-S275 VanDerWaalsContact O-CB 3.29Å; K119-S275 WeakPolarHBondContact O-CB 3.17Å; K119-S275 PolarHBondContact O-N 3.08Å; Q120-S275 WeakPolarHBondContact CB-O 3.33Å; Q120-S275 WeakPolarHBondContact CG-O 3.32Å; Q120-S275 PolarHBondContact NE2-O 3.11Å; Q120-S275 PolarHBondContact OE1-O 3.19Å
276	G	28	Very low	28.8	Very low	66 Å²	66	118.4 Å²	118.4	68%	0.68	70%	0.699	S	S	*	*			trans	173.8	-173.8	179.1	0	0	0	0	0	115.6
277	S	33.3	Very low	29	Very low	95 Å²	95	114.4 Å²	114.4	66%	0.664	69%	0.688	S	S	*	*			cis	-174.9	-170.8	-9.2	-96.6	0	0	0	0	111.1	Q120	Q120-S277 PolarHBondContact OE1-OG 3.06Å
278	N	30.8	Very low	29.1	Very low	152 Å²	152	117.6 Å²	117.6	81%	0.813	69%	0.692	S	S	*	*			trans	77.4	156.3	178.7	-75.8	-25.8	0	0	0	118
279	M	29.6	Very low	29.4	Very low	156 Å²	156	121.1 Å²	121.1	77%	0.768	70%	0.695	S	S	*	*			cis	-155.8	144.9	3.2	-111.7	-117.8	159.3	0	0	115.2
280	V	29.1	Very low	30.1	Very low	112 Å²	112	125.7 Å²	125.7	68%	0.679	70%	0.703	S	S	*	*			trans	37.5	120.9	142.4	-178.8	0	0	0	0	124.8
281	T	27.4	Very low	30.7	Very low	135 Å²	135	127.3 Å²	127.3	83%	0.828	71%	0.711	S	S	*	*				-168.6	167.6	114.7	2.4	0	0	0	0	112.9
282	T	28.3	Very low	30.6	Very low	131 Å²	131	127.8 Å²	127.8	80%	0.804	71%	0.71	S	S	*	*			trans	-147	-177.9	-172.9	63	0	0	0	0	110.7
283	P	45.2	Very low	30.8	Very low	100 Å²	100	125.4 Å²	125.4	65%	0.649	71%	0.706	S	S	*	*			cis	-139.5	164	0.7	41.7	-23.7	0	0	0	118.6
284	T	28	Very low	31	Very low	133 Å²	133	129.6 Å²	129.6	82%	0.816	72%	0.718	S	S	*	*			trans	62	154.1	154.6	44.1	0	0	0	0	119.2
285	V	27.2	Very low	31.4	Very low	121 Å²	121	135.4 Å²	135.4	73%	0.733	74%	0.743	S	S	*	*			cis	-138	140.7	19.9	172.9	0	0	0	0	112.5
286	N	30.2	Very low	31.7	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	75%	0.753	S	S	*	*			trans	34.3	114.6	154.8	-64.4	-2.3	0	0	0	124.4
287	S	30.1	Very low	32	Very low	71 Å²	71	143.6 Å²	143.6	50%	0.497	76%	0.757	S	S	.	*				110.2	119.9	106.1	-75.2	0	0	0	0	124
288	Y	29.5	Very low	31.9	Very low	219 Å²	219	145.7 Å²	145.7	86%	0.859	76%	0.76	S	S	*	*			trans	66.3	122.4	147.6	-41.2	-41.3	0	0	0	121.1
289	K	30.1	Very low	32.2	Very low	210 Å²	210	146.7 Å²	146.7	91%	0.913	76%	0.759	S	S	*	*			trans	-140.9	160.4	173.5	-80.4	-175.6	175.8	177.1	0	112.4
290	K	39.3	Very low	32.1	Very low	194 Å²	194	150.9 Å²	150.9	84%	0.843	77%	0.767	S	S	*	*			trans	-72.1	165.6	165.8	-56.2	173.8	-178.5	175.4	0	111.6
291	P	40.8	Very low	32.5	Very low	129 Å²	129	151.3 Å²	151.3	84%	0.838	77%	0.772	S	S	*	*			trans	-140.7	178.1	136.2	38.1	-24	0	0	0	115
292	T	26.3	Very low	32.8	Very low	115 Å²	115	154.8 Å²	154.8	71%	0.706	78%	0.775	S	S	*	*			trans	-149.1	135.6	-168.1	-50.4	0	0	0	0	111.7
293	F	29.4	Very low	33.2	Very low	180 Å²	180	151.6 Å²	151.6	79%	0.789	77%	0.769	S	S	*	*			trans	63.8	158.4	161.5	-90	-129.5	0	0	0	118.9
294	H	36.1	Very low	33.1	Very low	151 Å²	151	152.8 Å²	152.8	70%	0.699	78%	0.776	S	S	*	*			cis	-169.4	178.3	-26.8	-132.4	-112.5	0	0	0	111
295	Q	32.6	Very low	33.6	Very low	153 Å²	153	152.5 Å²	152.5	72%	0.715	78%	0.777	S	S	*	*			trans	99	114.2	161.8	-64.5	-87.4	12	0	0	122.7
296	N	34.5	Very low	34.2	Very low	143 Å²	143	156.6 Å²	156.6	77%	0.765	79%	0.785	S	S	*	*			trans	38.8	156.9	132	-76.1	-55.1	0	0	0	124.3
297	K	33.3	Very low	34.8	Very low	176 Å²	176	158.9 Å²	158.9	77%	0.765	79%	0.791	S	S	*	*			cis	-165.3	148.5	32.5	-142.9	-173.2	-180	178	0	113.5
298	L	31.7	Very low	35.8	Very low	138 Å²	138	160.4 Å²	160.4	72%	0.723	80%	0.802	S	S	*	*			trans	57.5	164.6	158.6	-65.1	160.8	0	0	0	121.1
299	Q	37.3	Very low	37	Very low	173 Å²	173	158.1 Å²	158.1	81%	0.808	80%	0.799	S	S	*	*				-172.1	132.4	-50.1	-147	-173.1	55.5	0	0	110.9
300	R	28.5	Very low	38.9	Very low	244 Å²	244	153.4 Å²	153.4	92%	0.921	78%	0.783	S	S	*	*			trans	-178.2	170.4	155.1	-107.5	179	-179.7	-155	-3.1	112.5
301	P	36.5	Very low	40.5	Very low	121 Å²	121	147.4 Å²	147.4	79%	0.786	76%	0.758	S	S	*	*			trans	-84	167	-150.5	34.2	-39.7	0	0	0	116.6
302	K	33.7	Very low	42.2	Very low	208 Å²	208	146.4 Å²	146.4	90%	0.904	74%	0.738	S	S	*	*			trans	-120.8	139.2	172.4	-76.5	-179.2	175.8	175.1	0	111.5
303	G	37.8	Very low	45	Very low	65 Å²	65	141 Å²	141	67%	0.67	71%	0.705	S	S	*	*			trans	-80.9	-158.5	168.7	0	0	0	0	0	113.2
304	P	42.3	Very low	47.3	Very low	124 Å²	124	137.4 Å²	137.4	81%	0.805	69%	0.694	S	S	*	*	S	Bend	trans	-62.1	152.5	-170.9	25.2	-34.6	0	0	0	113.6	K306	P304-K306 PolarHBondContact O-N 3.45Å
305	P	39.1	Very low	49.7	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.9	-172.1	27.2	-34.6	0	0	0	112.3
306	K	39.2	Very low	52	Low	208 Å²	208	126.7 Å²	126.7	90%	0.904	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-65.5	137.5	168.5	-74.4	-171.3	174.4	-174.3	0	110.2	P304	P304-K306 PolarHBondContact O-N 3.45Å
307	Q	42.1	Very low	54.2	Low	187 Å²	187	125.8 Å²	125.8	87%	0.874	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-63.4	139.6	177.8	-64.5	170.4	-8.9	0	0	111.2	Q309	Q307-Q309 PolarHBondContact O-N 3.36Å
308	S	51.2	Low	56.4	Low	104 Å²	104	121.4 Å²	121.4	73%	0.727	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-72.8	117.7	171.8	53.2	0	0	0	0	110.4	L310	S308-L310 PolarHBondContact O-N 3.41Å
309	Q	54.6	Low	58.7	Low	171 Å²	171	118.3 Å²	118.3	80%	0.799	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-67.7	116.9	176.9	-68.5	175.7	-18.5	0	0	110.2	Q307	Q307-Q309 PolarHBondContact O-N 3.36Å
310	L	70	Confident	60.8	Low	110 Å²	110	110.6 Å²	110.6	58%	0.576	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-84.5	135.5	176.4	-65.3	172.7	0	0	0	109.8	S308	S308-L310 PolarHBondContact O-N 3.41Å
311	H	72.6	Confident	63.1	Low	68 Å²	68	103.2 Å²	103.2	32%	0.315	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	113.4	-179.9	-71.2	-92.9	0	0	0	110.2	C320 P323 Y326	H311-C320 PolarHBondContact N-O 3.28Å; H311-C320 WeakPolarHBondContact O-CB 3.44Å; H311-C320 PolarHBondContact O-N 3.34Å; H311-P323 WeakPolarHBondContact NE2-CG 3.32Å; H311-Y326 HydrophobicContact CB-CD1 4.38Å; H311-Y326 HydrophobicContact CB-CD2 3.83Å; H311-Y326 HydrophobicContact CB-CG 3.76Å
312	Y	78.1	Confident	65.3	Low	109 Å²	109	98.1 Å²	98.1	43%	0.427	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	136.3	-175.7	-167.1	-109.4	0	0	0	112.3	K317 Y326	Y312-K317 HydrophobicContact CE1-CD 3.72Å; Y312-K317 WeakPolarHBondContact OH-CA 3.42Å; Y312-K317 VanDerWaalsContact OH-CB 3.3Å; Y312-K317 WeakPolarHBondContact OH-CB 3.22Å; Y312-K317 VanDerWaalsContact OH-CD 3.23Å; Y312-K317 WeakPolarHBondContact OH-CD 3.4Å; Y312-K317 PolarHBondContact OH-O 3.2Å; Y312-Y326 WeakPolarHBondContact O-CE2 3.38Å; Y312-Y326 PolarHBondContact O-OH 2.62Å
313	C	84.5	Confident	67.6	Low	1 Å²	1	91.7 Å²	91.7	1%	0.007	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.9	174	176.4	0	0	0	0	110.6	C316 K317 I318 Y326 H329 H335	C313-C316 PolarHBondContact SG-N 3.37Å; C313-C316 VanDerWaalsContact SG-N 3.35Å; C313-K317 WeakPolarHBondContact O-CA 3.17Å; C313-K317 PolarHBondContact O-N 2.95Å; C313-I318 PolarHBondContact N-O 3.26Å; C313-I318 PolarHBondContact O-N 3.2Å; C313-Y326 HydrophobicContact CB-CE2 3.82Å; C313-H329 PolarHBondContact SG-NE2 3.24Å; C313-H335 PolarHBondContact SG-CE1 3.47Å; C313-H335 PolarHBondContact SG-ND1 2.83Å; C313-H335 VanDerWaalsContact SG-ND1 3.38Å
314	D	78.4	Confident	69.5	Low	104 Å²	104	94 Å²	94	56%	0.556	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-27.5	178.9	-80.4	-65.2	0	0	0	115	K317	D314-K317 WeakPolarHBondContact O-CD 3.32Å; D314-K317 WeakPolarHBondContact O-CE 3.17Å; D314-K317 IonicContact OD1-NZ 3.79Å; D314-K317 PolarHBondContact OD1-NZ 3.1Å
315	I	84.9	Confident	71.5	Confident	57 Å²	57	91 Å²	91	29%	0.292	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-33.2	179.6	-64.6	174.1	0	0	0	111.8	K338 E339 L342	I315-K338 HydrophobicContact CG2-CB 3.67Å; I315-K338 HydrophobicContact CG2-CD 4.44Å; I315-E339 HydrophobicContact CD1-CB 3.98Å; I315-E339 HydrophobicContact CD1-CG 3.91Å; I315-L342 HydrophobicContact CG1-CD1 4.12Å; I315-L342 HydrophobicContact CG2-CD1 3.99Å
316	C	80.9	Confident	73.7	Confident	22 Å²	22	87.9 Å²	87.9	15%	0.149	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-10.2	179.5	-69	0	0	0	0	114.4	C313 I318 H329	C313-C316 PolarHBondContact SG-N 3.37Å; C313-C316 VanDerWaalsContact SG-N 3.35Å; C316-I318 VanDerWaalsContact C-N 3.31Å; C316-I318 HydrophobicContact CB-CD1 4.1Å; C316-I318 HydrophobicContact CB-CG1 4.38Å; C316-I318 PolarHBondContact O-N 3.44Å; C316-H329 WeakPolarHBondContact CB-NE2 3.46Å
317	K	80.9	Confident	75.9	Confident	124 Å²	124	84.2 Å²	84.2	54%	0.539	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	38.3	-177.5	-61.7	-64.8	-179.5	-177.7	0	114	Y312 C313 D314	Y312-K317 HydrophobicContact CE1-CD 3.72Å; Y312-K317 WeakPolarHBondContact OH-CA 3.42Å; Y312-K317 VanDerWaalsContact OH-CB 3.3Å; Y312-K317 WeakPolarHBondContact OH-CB 3.22Å; Y312-K317 VanDerWaalsContact OH-CD 3.23Å; Y312-K317 WeakPolarHBondContact OH-CD 3.4Å; Y312-K317 PolarHBondContact OH-O 3.2Å; C313-K317 WeakPolarHBondContact O-CA 3.17Å; C313-K317 PolarHBondContact O-N 2.95Å; D314-K317 WeakPolarHBondContact O-CD 3.32Å; D314-K317 WeakPolarHBondContact O-CE 3.17Å; D314-K317 IonicContact OD1-NZ 3.79Å; D314-K317 PolarHBondContact OD1-NZ 3.1Å
318	I	79.4	Confident	78	Confident	85 Å²	85	80.7 Å²	80.7	44%	0.436	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.1	-179.1	-66.6	167.8	0	0	0	110.2	C313 C316	C313-I318 PolarHBondContact N-O 3.26Å; C313-I318 PolarHBondContact O-N 3.2Å; C316-I318 VanDerWaalsContact C-N 3.31Å; C316-I318 HydrophobicContact CB-CD1 4.1Å; C316-I318 HydrophobicContact CB-CG1 4.38Å; C316-I318 PolarHBondContact O-N 3.44Å
319	S	80.2	Confident	79.8	Confident	73 Å²	73	77.8 Å²	77.8	51%	0.51	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.4	166.8	40.9	0	0	0	0	111.1
320	C	81	Confident	81.4	Confident	10 Å²	10	71.7 Å²	71.7	7%	0.068	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.5	175.8	-61.9	0	0	0	0	110	H311 G322 Y326	H311-C320 PolarHBondContact N-O 3.28Å; H311-C320 WeakPolarHBondContact O-CB 3.44Å; H311-C320 PolarHBondContact O-N 3.34Å; C320-G322 PolarHBondContact O-N 2.68Å; C320-G322 VanDerWaalsContact O-N 3.09Å; C320-Y326 HydrophobicContact CB-CD2 4.12Å
321	A	77.8	Confident	82.2	Confident	89 Å²	89	72.9 Å²	72.9	74%	0.736	38%	0.375	S	S	*	.	S	Bend	trans	-73	2.5	-172.7	0	0	0	0	0	115.1
322	G	82.9	Confident	82.8	Confident	15 Å²	15	71 Å²	71	16%	0.155	38%	0.375	C	S	.	.	S	Bend	trans	178.1	174	171.8	0	0	0	0	0	113.2	C320 Q324 T325 Y326	C320-G322 PolarHBondContact O-N 2.68Å; C320-G322 VanDerWaalsContact O-N 3.09Å; G322-Q324 PolarHBondContact O-N 3.3Å; G322-T325 PolarHBondContact N-OG1 3.25Å; G322-T325 PolarHBondContact O-N 3.21Å; G322-T325 PolarHBondContact O-OG1 3.47Å; G322-Y326 WeakPolarHBondContact O-CB 3.38Å; G322-Y326 PolarHBondContact O-N 3.43Å; G322-Y326 VanDerWaalsContact O-N 3.11Å
323	P	81.5	Confident	82.8	Confident	72 Å²	72	74.3 Å²	74.3	47%	0.468	39%	0.394	S	S	.	.	H	α-helix	trans	-58.8	-33.4	-178.4	-22.3	29.5	0	0	0	114	H311 R327	H311-P323 WeakPolarHBondContact NE2-CG 3.32Å; P323-R327 PolarHBondContact O-N 3.28Å; P323-R327 VanDerWaalsContact O-N 3.15Å
324	Q	77.8	Confident	82.5	Confident	113 Å²	113	83.2 Å²	83.2	53%	0.528	43%	0.433	S	S	.	.	H	α-helix	trans	-64.9	-54.6	-179.1	-165.6	72.2	2.4	0	0	111.4	G322 Y326 R327 E328	G322-Q324 PolarHBondContact O-N 3.3Å; Q324-Y326 PolarHBondContact O-N 2.67Å; Q324-R327 PolarHBondContact O-N 3.01Å; Q324-R327 VanDerWaalsContact O-N 3.16Å; Q324-E328 PolarHBondContact O-N 2.79Å; Q324-E328 VanDerWaalsContact O-N 3.16Å
325	T	83.4	Confident	82.9	Confident	61 Å²	61	78.7 Å²	78.7	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-24	180	52.4	0	0	0	0	112.5	G322 H329	G322-T325 PolarHBondContact N-OG1 3.25Å; G322-T325 PolarHBondContact O-N 3.21Å; G322-T325 PolarHBondContact O-OG1 3.47Å; T325-H329 VanDerWaalsContact O-CB 3.22Å; T325-H329 WeakPolarHBondContact O-CB 3.14Å; T325-H329 PolarHBondContact O-N 3.41Å
326	Y	87	Confident	82.9	Confident	63 Å²	63	82.3 Å²	82.3	25%	0.247	42%	0.422	C	S	.	.	H	α-helix	trans	-68	-39.9	170.9	-171.9	-109.5	0	0	0	112.9	H311 Y312 C313 C320 G322 Q324 H329 N330	H311-Y326 HydrophobicContact CB-CD1 4.38Å; H311-Y326 HydrophobicContact CB-CD2 3.83Å; H311-Y326 HydrophobicContact CB-CG 3.76Å; Y312-Y326 WeakPolarHBondContact O-CE2 3.38Å; Y312-Y326 PolarHBondContact O-OH 2.62Å; C313-Y326 HydrophobicContact CB-CE2 3.82Å; C320-Y326 HydrophobicContact CB-CD2 4.12Å; G322-Y326 WeakPolarHBondContact O-CB 3.38Å; G322-Y326 PolarHBondContact O-N 3.43Å; G322-Y326 VanDerWaalsContact O-N 3.11Å; Q324-Y326 PolarHBondContact O-N 2.67Å; Y326-H329 PolarHBondContact O-N 3.38Å; Y326-N330 VanDerWaalsContact CE1-ND2 3.25Å; Y326-N330 WeakPolarHBondContact CE1-ND2 3.45Å; Y326-N330 VanDerWaalsContact O-CG 3.24Å; Y326-N330 PolarHBondContact O-N 3.45Å; Y326-N330 VanDerWaalsContact O-N 3.11Å; Y326-N330 PolarHBondContact O-ND2 3.46Å; Y326-N330 PolarHBondContact O-OD1 3.14Å
327	R	84.9	Confident	83	Confident	130 Å²	130	89.4 Å²	89.4	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-64.6	-51.8	173.7	-74	-176.4	-72.1	-135.9	4.4	111.5	P323 Q324 H329 N330 E331	P323-R327 PolarHBondContact O-N 3.28Å; P323-R327 VanDerWaalsContact O-N 3.15Å; Q324-R327 PolarHBondContact O-N 3.01Å; Q324-R327 VanDerWaalsContact O-N 3.16Å; R327-H329 PolarHBondContact O-N 3.43Å; R327-N330 PolarHBondContact O-N 3.11Å; R327-E331 WeakPolarHBondContact O-CB 3.35Å; R327-E331 WeakPolarHBondContact O-CG 3.33Å; R327-E331 PolarHBondContact O-N 3.3Å
328	E	86.3	Confident	83	Confident	114 Å²	114	88.6 Å²	88.6	53%	0.533	45%	0.447	S	S	.	.	H	α-helix	trans	-56.2	-35.8	175.5	-67.9	166.9	-169.4	0	0	112.4	Q324 G332	Q324-E328 PolarHBondContact O-N 2.79Å; Q324-E328 VanDerWaalsContact O-N 3.16Å; E328-G332 PolarHBondContact O-N 2.88Å; E328-G332 VanDerWaalsContact O-N 3.15Å
329	H	88.6	Confident	83.2	Confident	42 Å²	42	88.2 Å²	88.2	19%	0.194	44%	0.443	C	S	.	.	H	α-helix	trans	-64.8	-47.8	174.4	173.9	65.8	0	0	0	112.7	C313 C316 T325 Y326 R327 G332 H335	C313-H329 PolarHBondContact SG-NE2 3.24Å; C316-H329 WeakPolarHBondContact CB-NE2 3.46Å; T325-H329 VanDerWaalsContact O-CB 3.22Å; T325-H329 WeakPolarHBondContact O-CB 3.14Å; T325-H329 PolarHBondContact O-N 3.41Å; Y326-H329 PolarHBondContact O-N 3.38Å; R327-H329 PolarHBondContact O-N 3.43Å; H329-G332 PolarHBondContact O-N 2.96Å; H329-H335 AromaticContact CD2-ND1 3.45Å; H329-H335 PolarHBondContact CD2-ND1 3.35Å; H329-H335 AromaticContact NE2-ND1 3.11Å; H329-H335 PolarHBondContact NE2-ND1 2.81Å; H329-H335 VanDerWaalsContact NE2-ND1 3.11Å; H329-H335 WeakPolarHBondContact O-CB 3.48Å
330	N	88.6	Confident	82.9	Confident	43 Å²	43	87.7 Å²	87.7	23%	0.23	44%	0.443	C	S	.	.	H	α-helix	trans	-68.6	-39.1	-178.5	-63.9	-12.3	0	0	0	111.8	Y326 R327 G332 H335	Y326-N330 VanDerWaalsContact CE1-ND2 3.25Å; Y326-N330 WeakPolarHBondContact CE1-ND2 3.45Å; Y326-N330 VanDerWaalsContact O-CG 3.24Å; Y326-N330 PolarHBondContact O-N 3.45Å; Y326-N330 VanDerWaalsContact O-N 3.11Å; Y326-N330 PolarHBondContact O-ND2 3.46Å; Y326-N330 PolarHBondContact O-OD1 3.14Å; R327-N330 PolarHBondContact O-N 3.11Å; N330-G332 PolarHBondContact O-N 3.37Å; N330-H335 PolarHBondContact OD1-CE1 2.83Å; N330-H335 PolarHBondContact OD1-ND1 2.75Å
331	E	86.4	Confident	82.4	Confident	135 Å²	135	90.5 Å²	90.5	63%	0.631	47%	0.467	S	S	*	.	H	α-helix	trans	-67.6	-24.5	176.4	-69.8	164.6	-148.2	0	0	112.6	R327	R327-E331 WeakPolarHBondContact O-CB 3.35Å; R327-E331 WeakPolarHBondContact O-CG 3.33Å; R327-E331 PolarHBondContact O-N 3.3Å
332	G	86.3	Confident	82	Confident	29 Å²	29	91.7 Å²	91.7	30%	0.299	46%	0.461	S	S	.	.	S	Bend	trans	-62.7	134.2	-179.4	0	0	0	0	0	114.1	E328 H329 N330 K334 H335 K336	E328-G332 PolarHBondContact O-N 2.88Å; E328-G332 VanDerWaalsContact O-N 3.15Å; H329-G332 PolarHBondContact O-N 2.96Å; N330-G332 PolarHBondContact O-N 3.37Å; G332-K334 PolarHBondContact O-N 3.01Å; G332-H335 PolarHBondContact O-N 3.27Å; G332-K336 PolarHBondContact O-N 3.28Å
333	Q	76.6	Confident	81.4	Confident	179 Å²	179	99.5 Å²	99.5	84%	0.836	49%	0.49	S	S	*	.	H	α-helix	trans	-48.6	-33.9	-175.9	-68.9	-177.5	-10.1	0	0	115	K337	Q333-K337 VanDerWaalsContact O-CB 3.25Å; Q333-K337 WeakPolarHBondContact O-CB 3.38Å; Q333-K337 PolarHBondContact O-N 2.84Å
334	K	79.8	Confident	80.1	Confident	188 Å²	188	100.4 Å²	100.4	82%	0.817	50%	0.504	S	S	*	.	H	α-helix	trans	-71.2	-32.9	179.3	-69	-178	-180	176.3	0	113.3	G332	G332-K334 PolarHBondContact O-N 3.01Å
335	H	86.4	Confident	78.7	Confident	9 Å²	9	98 Å²	98	4%	0.042	51%	0.51	C	S	.	.	H	α-helix	trans	-75.4	-54.8	171.3	-178.4	122.7	0	0	0	109.3	C313 H329 N330 G332 K337 K338 E339	C313-H335 PolarHBondContact SG-CE1 3.47Å; C313-H335 PolarHBondContact SG-ND1 2.83Å; C313-H335 VanDerWaalsContact SG-ND1 3.38Å; H329-H335 AromaticContact CD2-ND1 3.45Å; H329-H335 PolarHBondContact CD2-ND1 3.35Å; H329-H335 AromaticContact NE2-ND1 3.11Å; H329-H335 PolarHBondContact NE2-ND1 2.81Å; H329-H335 VanDerWaalsContact NE2-ND1 3.11Å; H329-H335 WeakPolarHBondContact O-CB 3.48Å; N330-H335 PolarHBondContact OD1-CE1 2.83Å; N330-H335 PolarHBondContact OD1-ND1 2.75Å; G332-H335 PolarHBondContact O-N 3.27Å; H335-K337 PolarHBondContact O-N 2.59Å; H335-K337 VanDerWaalsContact O-N 3.1Å; H335-K338 WeakPolarHBondContact O-CA 3.31Å; H335-K338 WeakPolarHBondContact O-CB 3.31Å; H335-K338 PolarHBondContact O-N 2.81Å; H335-E339 PolarHBondContact O-N 3.14Å
336	K	85.1	Confident	76.6	Confident	133 Å²	133	98.4 Å²	98.4	58%	0.578	53%	0.525	S	S	*	.	H	α-helix	trans	-54.3	-34.4	-176.9	-161	164.7	-173.5	167.4	0	113.4	G332 A340	G332-K336 PolarHBondContact O-N 3.28Å; K336-A340 VanDerWaalsContact O-CB 3.3Å; K336-A340 WeakPolarHBondContact O-CB 3.24Å; K336-A340 PolarHBondContact O-N 2.97Å
337	K	82.8	Confident	74.3	Confident	170 Å²	170	104.6 Å²	104.6	74%	0.739	56%	0.557	S	S	*	*	H	α-helix	trans	-71.9	-32.3	173.4	-174.3	168.1	-178.2	172.1	0	114	Q333 H335 A341	Q333-K337 VanDerWaalsContact O-CB 3.25Å; Q333-K337 WeakPolarHBondContact O-CB 3.38Å; Q333-K337 PolarHBondContact O-N 2.84Å; H335-K337 PolarHBondContact O-N 2.59Å; H335-K337 VanDerWaalsContact O-N 3.1Å; K337-A341 WeakPolarHBondContact O-CB 3.23Å; K337-A341 PolarHBondContact O-N 3.46Å
338	K	80.3	Confident	71.8	Confident	108 Å²	108	105 Å²	105	47%	0.47	57%	0.574	S	S	.	*	H	α-helix	trans	-75.1	-42.7	173.5	-76.2	-178	167	-167.7	0	111.8	I315 H335 A341 L342	I315-K338 HydrophobicContact CG2-CB 3.67Å; I315-K338 HydrophobicContact CG2-CD 4.44Å; H335-K338 WeakPolarHBondContact O-CA 3.31Å; H335-K338 WeakPolarHBondContact O-CB 3.31Å; H335-K338 PolarHBondContact O-N 2.81Å; K338-A341 PolarHBondContact O-N 3.44Å; K338-L342 PolarHBondContact O-N 3.41Å
339	E	83.3	Confident	69	Low	76 Å²	76	103.3 Å²	103.3	36%	0.355	59%	0.587	S	S	.	*	H	α-helix	trans	-58.2	-49.3	175.1	-174.9	-169.5	-173.6	0	0	110.9	I315 H335 A341 L342 K343	I315-E339 HydrophobicContact CD1-CB 3.98Å; I315-E339 HydrophobicContact CD1-CG 3.91Å; H335-E339 PolarHBondContact O-N 3.14Å; E339-A341 VanDerWaalsContact C-N 3.29Å; E339-A341 PolarHBondContact O-N 2.96Å; E339-L342 PolarHBondContact O-N 2.93Å; E339-K343 WeakPolarHBondContact O-CB 3.3Å; E339-K343 PolarHBondContact O-N 3.23Å
340	A	74.4	Confident	66.4	Low	62 Å²	62	107.5 Å²	107.5	51%	0.512	62%	0.616	S	S	.	*	H	α-helix	trans	-60.1	-36.1	176.2	0	0	0	0	0	113.1	K336 A344	K336-A340 VanDerWaalsContact O-CB 3.3Å; K336-A340 WeakPolarHBondContact O-CB 3.24Å; K336-A340 PolarHBondContact O-N 2.97Å; A340-A344 WeakPolarHBondContact O-CB 3.24Å; A340-A344 PolarHBondContact O-N 2.83Å
341	A	70.8	Confident	63.6	Low	70 Å²	70	111.7 Å²	111.7	58%	0.579	64%	0.643	S	S	*	*	H	α-helix	trans	-69.8	-36.3	176.6	0	0	0	0	0	112.9	K337 K338 E339	K337-A341 WeakPolarHBondContact O-CB 3.23Å; K337-A341 PolarHBondContact O-N 3.46Å; K338-A341 PolarHBondContact O-N 3.44Å; E339-A341 VanDerWaalsContact C-N 3.29Å; E339-A341 PolarHBondContact O-N 2.96Å
342	L	69.7	Low	60.9	Low	114 Å²	114	112.9 Å²	112.9	60%	0.597	65%	0.654	S	S	*	*	H	α-helix	trans	-71	-39.4	173.5	-73.9	164.6	0	0	0	111.8	I315 K338 E339 A344 G345	I315-L342 HydrophobicContact CG1-CD1 4.12Å; I315-L342 HydrophobicContact CG2-CD1 3.99Å; K338-L342 PolarHBondContact O-N 3.41Å; E339-L342 PolarHBondContact O-N 2.93Å; L342-A344 PolarHBondContact O-N 3.01Å; L342-G345 PolarHBondContact O-N 3.03Å
343	K	69.2	Low	58.4	Low	179 Å²	179	115.1 Å²	115.1	78%	0.778	68%	0.677	S	S	*	*	H	α-helix	trans	-71.5	-10.8	-178.9	-156.7	168.2	-172.3	171.8	0	113.8	E339	E339-K343 WeakPolarHBondContact O-CB 3.3Å; E339-K343 PolarHBondContact O-N 3.23Å
344	A	54.3	Low	57.1	Low	90 Å²	90	111.8 Å²	111.8	74%	0.744	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	3.1	176.9	0	0	0	0	0	114.2	A340 L342	A340-A344 WeakPolarHBondContact O-CB 3.24Å; A340-A344 PolarHBondContact O-N 2.83Å; L342-A344 PolarHBondContact O-N 3.01Å
345	G	49.3	Very low	55	Low	64 Å²	64	114.4 Å²	114.4	66%	0.66	68%	0.675	S	S	*	*			trans	-131.5	100.7	-176.9	0	0	0	0	0	113.7	L342	L342-G345 PolarHBondContact O-N 3.03Å
346	G	38.1	Very low	52.4	Low	68 Å²	68	117.6 Å²	117.6	70%	0.701	71%	0.711	S	S	*	*			trans	-169.3	135.3	170.9	0	0	0	0	0	113.7
347	Q	40.2	Very low	50.6	Low	193 Å²	193	117.8 Å²	117.8	90%	0.902	72%	0.722	S	S	*	*			trans	71	136.3	174.5	-52.7	-170.6	22.3	0	0	115
348	T	31.7	Very low	49.1	Very low	138 Å²	138	118.5 Å²	118.5	85%	0.847	73%	0.729	S	S	*	*			cis	-142.5	176.6	-6.5	52.6	0	0	0	0	110.1
349	G	27.5	Very low	47.8	Very low	79 Å²	79	116.7 Å²	116.7	81%	0.814	73%	0.727	S	S	*	*			trans	122.2	127.5	152.9	0	0	0	0	0	117.7
350	T	33.8	Very low	46.6	Very low	131 Å²	131	119.2 Å²	119.2	80%	0.804	74%	0.738	S	S	*	*			trans	-77.6	141.3	-177.4	46.5	0	0	0	0	115.5
351	T	30.1	Very low	46.7	Very low	130 Å²	130	117.6 Å²	117.6	80%	0.798	72%	0.721	S	S	*	*				176.6	148.4	121.7	27.3	0	0	0	0	113.7
352	N	30.3	Very low	47	Very low	161 Å²	161	121 Å²	121	86%	0.861	72%	0.719	S	S	*	*			trans	19.4	132.3	158.7	-55	-12.6	0	0	0	122.2
353	G	33.2	Very low	47.8	Very low	75 Å²	75	115.7 Å²	115.7	77%	0.773	69%	0.691	S	S	*	*			trans	-86.7	-158.1	167.8	0	0	0	0	0	114.3
354	P	48.1	Very low	48.1	Very low	109 Å²	109	114.7 Å²	114.7	71%	0.708	69%	0.689	S	S	*	*			cis	-139	-170.7	11.9	44.1	-26.4	0	0	0	116.6
355	R	35.5	Very low	49.3	Very low	244 Å²	244	112.8 Å²	112.8	92%	0.921	67%	0.666	S	S	*	*			trans	82.2	139.2	167.4	-69.5	178.3	-83.5	-151.7	-7.5	118.5
356	G	31.9	Very low	50.8	Low	76 Å²	76	111.6 Å²	111.6	78%	0.784	65%	0.648	S	S	*	*			trans	159.6	54.5	175.3	0	0	0	0	0	115.9
357	V	47.3	Very low	52.8	Low	136 Å²	136	113.2 Å²	113.2	82%	0.824	64%	0.64	S	S	*	*			trans	-74.6	138	178.7	177.9	0	0	0	0	111.2	T359	V357-T359 HydrophobicContact CG1-CG2 4.41Å
358	Q	51.2	Low	54.8	Low	186 Å²	186	107 Å²	107	87%	0.869	62%	0.615	S	S	*	*			trans	-119.2	127	164.3	-69.8	-165	-6.3	0	0	110.9
359	T	53.6	Low	57.1	Low	70 Å²	70	103.7 Å²	103.7	43%	0.429	60%	0.597	S	S	.	*			trans	-94.8	136.4	-178.8	43	0	0	0	0	111.4	V357 L406	V357-T359 HydrophobicContact CG1-CG2 4.41Å; T359-L406 HydrophobicContact CG2-CD2 3.98Å
360	Q	59.2	Low	59.8	Low	128 Å²	128	100.3 Å²	100.3	60%	0.598	56%	0.561	S	S	*	*			trans	-104	122.5	176.7	-166.1	174	10.7	0	0	109.6	S369	Q360-S369 PolarHBondContact NE2-OG 2.88Å
361	L	76	Confident	62	Low	28 Å²	28	99.6 Å²	99.6	15%	0.147	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	121.1	-170.9	-65.9	169	0	0	0	110.7	C370 V373 Y376	L361-C370 PolarHBondContact N-O 3.07Å; L361-C370 PolarHBondContact O-N 3.12Å; L361-V373 HydrophobicContact CD1-CB 4.34Å; L361-V373 HydrophobicContact CD1-CG2 3.89Å; L361-Y376 HydrophobicContact CB-CD2 3.97Å; L361-Y376 HydrophobicContact CB-CG 4.17Å
362	R	77.7	Confident	64.5	Low	143 Å²	143	94.4 Å²	94.4	54%	0.54	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	143.7	179.5	-175.6	177.5	178.9	158.5	-8.6	111.3	D367 V368 Y376	R362-D367 IonicContact CZ-OD1 3.35Å; R362-D367 IonicContact NE-OD1 2.65Å; R362-D367 PolarHBondContact NE-OD1 3.15Å; R362-D367 IonicContact NH2-OD1 3.09Å; R362-D367 PolarHBondContact NH2-OD1 3.23Å; R362-D367 IonicContact NH2-OD2 2.66Å; R362-D367 PolarHBondContact NH2-OD2 3.03Å; R362-V368 WeakPolarHBondContact CA-O 3.37Å; R362-Y376 WeakPolarHBondContact O-CE2 3.42Å
363	C	84.6	Confident	66.8	Low	2 Å²	2	91.5 Å²	91.5	1%	0.014	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	104.1	175.3	-166.9	0	0	0	0	111.6	L365 C366 D367 V368 Y376 H385	C363-L365 PolarHBondContact O-N 3.35Å; C363-C366 HydrophobicContact CB-CB 4.43Å; C363-C366 CarbonylContact O-C 3.59Å; C363-C366 PolarHBondContact O-N 2.86Å; C363-D367 WeakPolarHBondContact O-CA 3.36Å; C363-D367 PolarHBondContact O-N 3.28Å; C363-V368 PolarHBondContact N-O 2.96Å; C363-Y376 HydrophobicContact CB-CD2 4.47Å; C363-Y376 HydrophobicContact CB-CE2 3.6Å; C363-H385 PolarHBondContact SG-CE1 2.76Å
364	E	76.8	Confident	68.8	Low	157 Å²	157	94.1 Å²	94.1	73%	0.734	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-35.5	179.2	-62	-64.5	107.5	0	0	114.1	C366	E364-C366 VanDerWaalsContact C-N 3.35Å; E364-C366 PolarHBondContact O-N 3.37Å
365	L	80.1	Confident	70.4	Confident	50 Å²	50	91 Å²	91	26%	0.262	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-6	-178.3	-63	-180	0	0	0	114.5	C363 V388 V389	C363-L365 PolarHBondContact O-N 3.35Å; L365-V388 WeakPolarHBondContact O-CG1 3.42Å; L365-V389 HydrophobicContact CD1-CG2 4.01Å
366	C	80.5	Confident	72.7	Confident	40 Å²	40	82.3 Å²	82.3	27%	0.27	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.8	-5.1	-172.7	-78.6	0	0	0	0	114.8	C363 E364 V368 H379	C363-C366 HydrophobicContact CB-CB 4.43Å; C363-C366 CarbonylContact O-C 3.59Å; C363-C366 PolarHBondContact O-N 2.86Å; E364-C366 VanDerWaalsContact C-N 3.35Å; E364-C366 PolarHBondContact O-N 3.37Å; C366-V368 HydrophobicContact CB-CG2 4.43Å; C366-V368 PolarHBondContact O-N 3.27Å; C366-H379 WeakPolarHBondContact CB-NE2 3.3Å
367	D	79.2	Confident	75	Confident	102 Å²	102	79.5 Å²	79.5	55%	0.545	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	22.9	-176.7	-85.4	-23.6	0	0	0	116.8	R362 C363	R362-D367 IonicContact CZ-OD1 3.35Å; R362-D367 IonicContact NE-OD1 2.65Å; R362-D367 PolarHBondContact NE-OD1 3.15Å; R362-D367 IonicContact NH2-OD1 3.09Å; R362-D367 PolarHBondContact NH2-OD1 3.23Å; R362-D367 IonicContact NH2-OD2 2.66Å; R362-D367 PolarHBondContact NH2-OD2 3.03Å; C363-D367 WeakPolarHBondContact O-CA 3.36Å; C363-D367 PolarHBondContact O-N 3.28Å
368	V	81.6	Confident	76.8	Confident	63 Å²	63	75.7 Å²	75.7	38%	0.382	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.9	172.9	-179.3	0	0	0	0	109.8	R362 C363 C366	R362-V368 WeakPolarHBondContact CA-O 3.37Å; C363-V368 PolarHBondContact N-O 2.96Å; C366-V368 HydrophobicContact CB-CG2 4.43Å; C366-V368 PolarHBondContact O-N 3.27Å
369	S	81.8	Confident	78.6	Confident	67 Å²	67	68.6 Å²	68.6	47%	0.469	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.5	169	53.6	0	0	0	0	111	Q360	Q360-S369 PolarHBondContact NE2-OG 2.88Å
370	C	82.9	Confident	80.3	Confident	9 Å²	9	68 Å²	68	6%	0.061	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.9	-178.5	-65.6	0	0	0	0	110.6	L361 G372 A375 Y376	L361-C370 PolarHBondContact N-O 3.07Å; L361-C370 PolarHBondContact O-N 3.12Å; C370-G372 PolarHBondContact O-N 3.32Å; C370-A375 HydrophobicContact CB-CB 3.98Å; C370-Y376 HydrophobicContact CB-CD2 4.33Å
371	T	80.7	Confident	81.4	Confident	115 Å²	115	69.8 Å²	69.8	71%	0.706	38%	0.378	S	S	*	.	S	Bend	trans	-82.2	49.5	-178	57.7	0	0	0	0	112.2
372	G	82.5	Confident	81.9	Confident	22 Å²	22	69.5 Å²	69.5	23%	0.227	38%	0.383	C	S	.	.	S	Bend	trans	139.4	163	178.6	0	0	0	0	0	114.4	C370 D374 A375 Y376	C370-G372 PolarHBondContact O-N 3.32Å; G372-D374 PolarHBondContact O-N 2.99Å; G372-A375 PolarHBondContact O-N 2.84Å; G372-Y376 PolarHBondContact O-N 3.09Å
373	V	77.9	Confident	82.2	Confident	99 Å²	99	66 Å²	66	60%	0.6	38%	0.384	S	S	*	.	H	α-helix	trans	-59.7	-45.8	-175.2	-176.4	0	0	0	0	112	L361 A375 Y376 A377	L361-V373 HydrophobicContact CD1-CB 4.34Å; L361-V373 HydrophobicContact CD1-CG2 3.89Å; V373-A375 PolarHBondContact O-N 3.3Å; V373-Y376 WeakPolarHBondContact O-CB 3.25Å; V373-Y376 PolarHBondContact O-N 3.02Å; V373-A377 WeakPolarHBondContact O-CB 3.38Å; V373-A377 PolarHBondContact O-N 3.38Å
374	D	76.5	Confident	82	Confident	131 Å²	131	74.7 Å²	74.7	70%	0.701	42%	0.422	S	S	*	.	H	α-helix	trans	-67.7	-34.8	-178.8	-64.4	-60.4	0	0	0	113.1	G372 Y376 A377 A378	G372-D374 PolarHBondContact O-N 2.99Å; D374-Y376 VanDerWaalsContact C-N 3.33Å; D374-A377 PolarHBondContact O-N 3.01Å; D374-A378 VanDerWaalsContact O-CB 3.24Å; D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 2.61Å
375	A	80.3	Confident	82.5	Confident	43 Å²	43	68 Å²	68	36%	0.355	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-38.5	173.5	0	0	0	0	0	111.2	C370 G372 V373 H379	C370-A375 HydrophobicContact CB-CB 3.98Å; G372-A375 PolarHBondContact O-N 2.84Å; V373-A375 PolarHBondContact O-N 3.3Å; A375-H379 WeakPolarHBondContact O-CB 3.15Å; A375-H379 PolarHBondContact O-N 3.44Å
376	Y	84.5	Confident	82.8	Confident	61 Å²	61	70 Å²	70	24%	0.239	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-46.6	173.8	-171.7	-98.4	0	0	0	112	L361 R362 C363 C370 G372 V373 D374 A378 H379 I380	L361-Y376 HydrophobicContact CB-CD2 3.97Å; L361-Y376 HydrophobicContact CB-CG 4.17Å; R362-Y376 WeakPolarHBondContact O-CE2 3.42Å; C363-Y376 HydrophobicContact CB-CD2 4.47Å; C363-Y376 HydrophobicContact CB-CE2 3.6Å; C370-Y376 HydrophobicContact CB-CD2 4.33Å; G372-Y376 PolarHBondContact O-N 3.09Å; V373-Y376 WeakPolarHBondContact O-CB 3.25Å; V373-Y376 PolarHBondContact O-N 3.02Å; D374-Y376 VanDerWaalsContact C-N 3.33Å; Y376-A378 VanDerWaalsContact C-N 3.31Å; Y376-A378 PolarHBondContact O-N 3.42Å; Y376-H379 WeakPolarHBondContact O-CB 3.42Å; Y376-H379 PolarHBondContact O-N 3.29Å; Y376-I380 HydrophobicContact CD1-CG2 4.4Å; Y376-I380 HydrophobicContact CE1-CD1 4.33Å; Y376-I380 HydrophobicContact CE1-CG2 3.92Å; Y376-I380 PolarHBondContact O-N 2.94Å
377	A	80	Confident	83.1	Confident	18 Å²	18	75.6 Å²	75.6	15%	0.149	42%	0.418	C	S	.	.	H	α-helix	trans	-62.6	-36.2	176.8	0	0	0	0	0	112.3	V373 D374 I380 R381	V373-A377 WeakPolarHBondContact O-CB 3.38Å; V373-A377 PolarHBondContact O-N 3.38Å; D374-A377 PolarHBondContact O-N 3.01Å; A377-I380 WeakPolarHBondContact O-CG1 3.08Å; A377-R381 WeakPolarHBondContact O-CB 3.47Å; A377-R381 WeakPolarHBondContact O-CG 3.29Å; A377-R381 VanDerWaalsContact O-CZ 3.26Å; A377-R381 PolarHBondContact O-N 3.25Å; A377-R381 PolarHBondContact O-NE 2.84Å; A377-R381 VanDerWaalsContact O-NE 3.13Å
378	A	86.1	Confident	83.2	Confident	55 Å²	55	73 Å²	73	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-68.9	-37.7	170.7	0	0	0	0	0	112.7	D374 Y376 G382	D374-A378 VanDerWaalsContact O-CB 3.24Å; D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 2.61Å; Y376-A378 VanDerWaalsContact C-N 3.31Å; Y376-A378 PolarHBondContact O-N 3.42Å; A378-G382 PolarHBondContact O-N 2.87Å
379	H	87.9	Confident	83.3	Confident	37 Å²	37	71.9 Å²	71.9	17%	0.171	40%	0.399	C	S	.	.	H	α-helix	trans	-61.5	-51.9	176	172.4	89.1	0	0	0	111.9	C366 A375 Y376 R381 G382 H385	C366-H379 WeakPolarHBondContact CB-NE2 3.3Å; A375-H379 WeakPolarHBondContact O-CB 3.15Å; A375-H379 PolarHBondContact O-N 3.44Å; Y376-H379 WeakPolarHBondContact O-CB 3.42Å; Y376-H379 PolarHBondContact O-N 3.29Å; H379-R381 VanDerWaalsContact C-N 3.33Å; H379-R381 PolarHBondContact O-N 2.93Å; H379-G382 WeakPolarHBondContact O-CA 3.37Å; H379-G382 PolarHBondContact O-N 2.79Å; H379-H385 AromaticContact CD2-ND1 3.74Å; H379-H385 AromaticContact NE2-ND1 3.39Å; H379-H385 PolarHBondContact NE2-ND1 2.87Å; H379-H385 WeakPolarHBondContact O-CB 3.33Å
380	I	89	Confident	83.2	Confident	58 Å²	58	75.6 Å²	75.6	30%	0.297	41%	0.407	S	S	.	.	H	α-helix	trans	-67.6	-31.3	-176.6	64.9	-178.6	0	0	0	112.9	Y376 A377 G382 H385	Y376-I380 HydrophobicContact CD1-CG2 4.4Å; Y376-I380 HydrophobicContact CE1-CD1 4.33Å; Y376-I380 HydrophobicContact CE1-CG2 3.92Å; Y376-I380 PolarHBondContact O-N 2.94Å; A377-I380 WeakPolarHBondContact O-CG1 3.08Å; I380-G382 PolarHBondContact O-N 3.21Å; I380-H385 PolarHBondContact O-CD2 2.89Å
381	R	83.7	Confident	83	Confident	165 Å²	165	79.9 Å²	79.9	62%	0.623	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-7.7	170.4	-68.5	-175.6	-64.5	-113.7	0.9	113.4	A377 H379 Q386	A377-R381 WeakPolarHBondContact O-CB 3.47Å; A377-R381 WeakPolarHBondContact O-CG 3.29Å; A377-R381 VanDerWaalsContact O-CZ 3.26Å; A377-R381 PolarHBondContact O-N 3.25Å; A377-R381 PolarHBondContact O-NE 2.84Å; A377-R381 VanDerWaalsContact O-NE 3.13Å; H379-R381 VanDerWaalsContact C-N 3.33Å; H379-R381 PolarHBondContact O-N 2.93Å; R381-Q386 PolarHBondContact O-NE2 3.5Å
382	G	86.2	Confident	82.4	Confident	23 Å²	23	78.3 Å²	78.3	24%	0.237	41%	0.413	C	S	.	.	S	Bend	trans	-75.9	141.3	-174.6	0	0	0	0	0	114.1	A378 H379 I380 K384 H385 Q386	A378-G382 PolarHBondContact O-N 2.87Å; H379-G382 WeakPolarHBondContact O-CA 3.37Å; H379-G382 PolarHBondContact O-N 2.79Å; I380-G382 PolarHBondContact O-N 3.21Å; G382-K384 PolarHBondContact O-N 2.88Å; G382-H385 PolarHBondContact O-N 2.89Å; G382-H385 VanDerWaalsContact O-N 3.09Å; G382-Q386 PolarHBondContact O-N 3.4Å
383	A	83.9	Confident	82.2	Confident	69 Å²	69	81.3 Å²	81.3	57%	0.57	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-1.5	179.3	0	0	0	0	0	115.5	K387	A383-K387 WeakPolarHBondContact O-CD 3.39Å; A383-K387 WeakPolarHBondContact O-CE 3.39Å; A383-K387 WeakPolarHBondContact O-CG 3.39Å
384	K	81.1	Confident	81.9	Confident	184 Å²	184	85.3 Å²	85.3	80%	0.8	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-57.2	166.5	-69	-174.8	178.3	-177.7	0	110.5	G382 Q386 K387 V388	G382-K384 PolarHBondContact O-N 2.88Å; K384-Q386 VanDerWaalsContact C-N 3.33Å; K384-Q386 PolarHBondContact O-N 2.82Å; K384-K387 WeakPolarHBondContact O-CB 3.5Å; K384-K387 PolarHBondContact O-N 2.92Å; K384-V388 PolarHBondContact O-N 2.87Å
385	H	87	Confident	81.5	Confident	17 Å²	17	84.3 Å²	84.3	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-54.6	-47.4	177.4	-179.6	93.9	0	0	0	111.8	C363 H379 I380 G382 K387 V388 V389	C363-H385 PolarHBondContact SG-CE1 2.76Å; H379-H385 AromaticContact CD2-ND1 3.74Å; H379-H385 AromaticContact NE2-ND1 3.39Å; H379-H385 PolarHBondContact NE2-ND1 2.87Å; H379-H385 WeakPolarHBondContact O-CB 3.33Å; I380-H385 PolarHBondContact O-CD2 2.89Å; G382-H385 PolarHBondContact O-N 2.89Å; G382-H385 VanDerWaalsContact O-N 3.09Å; H385-K387 PolarHBondContact O-N 3.45Å; H385-K387 VanDerWaalsContact O-N 3.09Å; H385-V388 PolarHBondContact O-N 2.9Å; H385-V389 WeakPolarHBondContact NE2-CG2 3.43Å; H385-V389 PolarHBondContact O-N 3.35Å
386	Q	86.1	Confident	80.2	Confident	92 Å²	92	85.8 Å²	85.8	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-20.7	178.4	-68.2	176.6	-14.4	0	0	114.6	R381 G382 K384 K390	R381-Q386 PolarHBondContact O-NE2 3.5Å; G382-Q386 PolarHBondContact O-N 3.4Å; K384-Q386 VanDerWaalsContact C-N 3.33Å; K384-Q386 PolarHBondContact O-N 2.82Å; Q386-K390 WeakPolarHBondContact O-CB 3.23Å; Q386-K390 VanDerWaalsContact O-CG 3.26Å; Q386-K390 WeakPolarHBondContact O-CG 3.49Å; Q386-K390 PolarHBondContact O-N 2.71Å
387	K	85.9	Confident	78.9	Confident	157 Å²	157	90.2 Å²	90.2	68%	0.683	47%	0.47	S	S	*	.	H	α-helix	trans	-79.2	-35.9	172.1	-71.7	176.1	-176.5	-176.3	0	111.7	A383 K384 H385 L391	A383-K387 WeakPolarHBondContact O-CD 3.39Å; A383-K387 WeakPolarHBondContact O-CE 3.39Å; A383-K387 WeakPolarHBondContact O-CG 3.39Å; K384-K387 WeakPolarHBondContact O-CB 3.5Å; K384-K387 PolarHBondContact O-N 2.92Å; H385-K387 PolarHBondContact O-N 3.45Å; H385-K387 VanDerWaalsContact O-N 3.09Å; K387-L391 PolarHBondContact O-N 3.01Å
388	V	82.4	Confident	77.1	Confident	47 Å²	47	95.4 Å²	95.4	29%	0.285	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-43.1	175.3	-173.7	0	0	0	0	110.6	L365 K384 H385 K390 L391 H392	L365-V388 WeakPolarHBondContact O-CG1 3.42Å; K384-V388 PolarHBondContact O-N 2.87Å; H385-V388 PolarHBondContact O-N 2.9Å; V388-K390 PolarHBondContact O-N 2.88Å; V388-L391 WeakPolarHBondContact O-CB 3.02Å; V388-L391 PolarHBondContact O-N 3.3Å; V388-H392 PolarHBondContact O-N 3.32Å
389	V	82.6	Confident	75.3	Confident	40 Å²	40	96.9 Å²	96.9	24%	0.242	50%	0.502	C	S	.	.	H	α-helix	trans	-54.7	-52.8	171.2	176.6	0	0	0	0	110.5	L365 H385 L391 H392 T393	L365-V389 HydrophobicContact CD1-CG2 4.01Å; H385-V389 WeakPolarHBondContact NE2-CG2 3.43Å; H385-V389 PolarHBondContact O-N 3.35Å; V389-L391 PolarHBondContact O-N 2.87Å; V389-L391 VanDerWaalsContact O-N 3.16Å; V389-H392 PolarHBondContact O-N 3.29Å; V389-H392 VanDerWaalsContact O-N 3.09Å; V389-T393 PolarHBondContact O-N 3.48Å; V389-T393 PolarHBondContact O-OG1 3.36Å
390	K	80.1	Confident	73.3	Confident	146 Å²	146	100 Å²	100	64%	0.635	53%	0.525	S	S	*	.	H	α-helix	trans	-63.4	-19.7	177.9	-75	176.9	-179.7	-177.7	0	114.4	Q386 V388 K394	Q386-K390 WeakPolarHBondContact O-CB 3.23Å; Q386-K390 VanDerWaalsContact O-CG 3.26Å; Q386-K390 WeakPolarHBondContact O-CG 3.49Å; Q386-K390 PolarHBondContact O-N 2.71Å; V388-K390 PolarHBondContact O-N 2.88Å; K390-K394 VanDerWaalsContact O-CG 3.31Å; K390-K394 WeakPolarHBondContact O-CG 3.31Å
391	L	77.9	Confident	71.3	Confident	99 Å²	99	102.5 Å²	102.5	52%	0.518	55%	0.548	S	S	.	.	H	α-helix	trans	-78.7	-46.8	171.1	-175.5	64.6	0	0	0	110.5	K387 V388 V389 K394 L395	K387-L391 PolarHBondContact O-N 3.01Å; V388-L391 WeakPolarHBondContact O-CB 3.02Å; V388-L391 PolarHBondContact O-N 3.3Å; V389-L391 PolarHBondContact O-N 2.87Å; V389-L391 VanDerWaalsContact O-N 3.16Å; L391-K394 PolarHBondContact O-N 2.68Å; L391-K394 VanDerWaalsContact O-N 3.17Å; L391-L395 HydrophobicContact CD1-CD1 4.38Å; L391-L395 HydrophobicContact CG-CD1 4.12Å; L391-L395 WeakPolarHBondContact O-CG 3.46Å; L391-L395 PolarHBondContact O-N 3.09Å
392	H	68.2	Low	70	Confident	82 Å²	82	101 Å²	101	38%	0.38	56%	0.557	S	S	.	*	H	α-helix	trans	-62.7	-42.5	177	-83.4	-126.9	0	0	0	112.4	V388 V389 K394 L395	V388-H392 PolarHBondContact O-N 3.32Å; V389-H392 PolarHBondContact O-N 3.29Å; V389-H392 VanDerWaalsContact O-N 3.09Å; H392-K394 PolarHBondContact O-N 3.33Å; H392-L395 PolarHBondContact O-N 2.91Å
393	T	78.6	Confident	67.9	Low	84 Å²	84	107.9 Å²	107.9	52%	0.515	58%	0.583	S	S	.	*	H	α-helix	trans	-57.6	-36.6	174.2	-44.6	0	0	0	0	112.1	V389 L395	V389-T393 PolarHBondContact O-N 3.48Å; V389-T393 PolarHBondContact O-OG1 3.36Å; T393-L395 VanDerWaalsContact C-N 3.29Å; T393-L395 PolarHBondContact O-N 3.45Å
394	K	72.3	Confident	66.1	Low	183 Å²	183	109.7 Å²	109.7	80%	0.796	59%	0.589	S	S	*	*	H	α-helix	trans	-76.9	-11.9	177.8	-76.3	-177.1	173.7	-162.9	0	114.3	K390 L391 H392	K390-K394 VanDerWaalsContact O-CG 3.31Å; K390-K394 WeakPolarHBondContact O-CG 3.31Å; L391-K394 PolarHBondContact O-N 2.68Å; L391-K394 VanDerWaalsContact O-N 3.17Å; H392-K394 PolarHBondContact O-N 3.33Å
395	L	68.8	Low	64.2	Low	110 Å²	110	107.1 Å²	107.1	58%	0.576	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	10	-179.9	-67.7	170.7	0	0	0	112.9	L391 H392 T393 K397	L391-L395 HydrophobicContact CD1-CD1 4.38Å; L391-L395 HydrophobicContact CG-CD1 4.12Å; L391-L395 WeakPolarHBondContact O-CG 3.46Å; L391-L395 PolarHBondContact O-N 3.09Å; H392-L395 PolarHBondContact O-N 2.91Å; T393-L395 VanDerWaalsContact C-N 3.29Å; T393-L395 PolarHBondContact O-N 3.45Å; L395-K397 PolarHBondContact O-N 3.08Å; L395-K397 VanDerWaalsContact O-N 3.09Å
396	G	52.2	Low	62.2	Low	74 Å²	74	112.5 Å²	112.5	76%	0.763	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.6	8.9	165.8	0	0	0	0	0	116.5
397	K	56.8	Low	59.9	Low	154 Å²	154	113.9 Å²	113.9	67%	0.67	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-90.5	141.2	178	-64.6	-176.6	-179.4	-175.5	0	110.5	L395	L395-K397 PolarHBondContact O-N 3.08Å; L395-K397 VanDerWaalsContact O-N 3.09Å
398	P	43.4	Very low	57.5	Low	128 Å²	128	114 Å²	114	83%	0.831	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-61.5	140.6	180	25.9	-34.2	0	0	0	111.2
399	I	46.9	Very low	55.2	Low	86 Å²	86	117.4 Å²	117.4	44%	0.441	67%	0.665	S	S	.	*	P	Polyproline II helix	trans	-97.2	122.2	179.9	-56.8	175.5	0	0	0	107.6
400	P	47.3	Very low	52.6	Low	101 Å²	101	120.1 Å²	120.1	66%	0.656	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60.4	146.6	174.5	-23.9	34.7	0	0	0	112.3
401	S	46.8	Very low	50.6	Low	112 Å²	112	118.9 Å²	118.9	78%	0.783	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-67.2	150.5	177.6	-164.6	0	0	0	0	111.8	E403	S401-E403 PolarHBondContact O-N 3.44Å
402	T	55.6	Low	48.2	Very low	132 Å²	132	121.2 Å²	121.2	81%	0.81	72%	0.717	S	S	*	*			trans	-91.2	74.7	-171.7	55.1	0	0	0	0	112.9
403	E	41.2	Very low	46.2	Very low	169 Å²	169	122.8 Å²	122.8	79%	0.79	73%	0.733	S	S	*	*			trans	-126.3	140	167.5	-66.3	-168.5	145.8	0	0	111.2	S401	S401-E403 PolarHBondContact O-N 3.44Å
404	P	46.6	Very low	43.6	Very low	106 Å²	106	124.1 Å²	124.1	69%	0.688	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-87.4	117.1	-172.1	32.8	-33.3	0	0	0	113
405	V	41.7	Very low	41.3	Very low	130 Å²	130	122.4 Å²	122.4	79%	0.788	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-83.7	131.8	169.2	-179.7	0	0	0	0	110.1	V407	V405-V407 HydrophobicContact CG1-CG2 4.33Å
406	L	44.6	Very low	39.1	Very low	131 Å²	131	122.2 Å²	122.2	69%	0.686	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-90.7	131.8	174.7	-77.4	162.6	0	0	0	110.7	T359	T359-L406 HydrophobicContact CG2-CD2 3.98Å
407	V	38.9	Very low	37.7	Very low	120 Å²	120	124.8 Å²	124.8	73%	0.727	75%	0.749	S	S	*	*			trans	-132.1	120	174.2	-175.9	0	0	0	0	109.8	V405	V405-V407 HydrophobicContact CG1-CG2 4.33Å
408	N	35.2	Very low	36.1	Very low	160 Å²	160	123 Å²	123	86%	0.856	76%	0.756	S	S	*	*			trans	-102.8	142.9	165.9	-83.9	-3.2	0	0	0	109.1
409	S	33.7	Very low	35.3	Very low	118 Å²	118	120.7 Å²	120.7	83%	0.825	76%	0.756	S	S	*	*			trans	-156.4	134.1	168.3	56	0	0	0	0	112
410	A	27.8	Very low	34.4	Very low	98 Å²	98	126.1 Å²	126.1	81%	0.81	78%	0.776	S	S	*	*			trans	-125.1	156.5	168.4	0	0	0	0	0	109.3
411	P	38.9	Very low	33.8	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	78%	0.781	S	S	*	*			trans	-101	150.3	-159.4	37.3	-34.8	0	0	0	115.3
412	V	26.7	Very low	32.7	Very low	147 Å²	147	125.7 Å²	125.7	89%	0.891	78%	0.778	S	S	*	*			trans	-141	157.1	162.1	-179	0	0	0	0	108.7
413	T	25.7	Very low	31.3	Very low	116 Å²	116	124 Å²	124	71%	0.712	78%	0.777	S	S	*	*			trans	-124.1	162.8	-167.1	-39.5	0	0	0	0	112.2
414	T	24.5	Very low	30.5	Very low	112 Å²	112	120.8 Å²	120.8	69%	0.687	77%	0.774	S	S	*	*			trans	90.7	124.4	159	69.7	0	0	0	0	121.4
415	N	23.6	Very low	29.6	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	77%	0.774	S	S	*	*			trans	69.1	149.3	133.5	-61.7	7.9	0	0	0	124.4
416	S	23.6	Very low	28.8	Very low	106 Å²	106	119.8 Å²	119.8	74%	0.741	77%	0.771	S	S	*	*			trans	95.4	97.3	149.9	-33.4	0	0	0	0	120.6
417	T	23.2	Very low	27.9	Very low	127 Å²	127	119.8 Å²	119.8	78%	0.779	78%	0.776	S	S	*	*				45.9	131.4	120.4	-22.7	0	0	0	0	123.2
418	S	22.5	Very low	27.4	Very low	117 Å²	117	119 Å²	119	82%	0.818	78%	0.775	S	S	*	*			trans	61.9	135.1	145.6	55.3	0	0	0	0	122.3
419	G	26.4	Very low	27.8	Very low	80 Å²	80	116.4 Å²	116.4	83%	0.825	77%	0.768	S	S	*	*			trans	162.8	98.7	160.4	0	0	0	0	0	117.1
420	K	27.4	Very low	27.6	Very low	199 Å²	199	116 Å²	116	87%	0.865	77%	0.765	S	S	*	*			trans	-91.5	164.3	148.7	-123.1	-174	179	-179	0	107
421	P	36.4	Very low	27.7	Very low	116 Å²	116	117 Å²	117	75%	0.753	76%	0.761	S	S	*	*			cis	-114.1	179	39.1	4.7	21.7	0	0	0	112.8
422	A	23.5	Very low	27.2	Very low	88 Å²	88	116.1 Å²	116.1	73%	0.727	76%	0.757	S	S	*	*				65.5	143.8	51.4	0	0	0	0	0	114
423	A	25.8	Very low	27.3	Very low	96 Å²	96	115 Å²	115	79%	0.793	75%	0.751	S	S	*	*			cis	-145.2	-169.8	11.1	0	0	0	0	0	113.6
424	S	24.9	Very low	27.4	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	75%	0.754	S	S	*	*			trans	-67.1	-179.8	173.3	54.8	0	0	0	0	112.5
425	T	25.9	Very low	27.6	Very low	113 Å²	113	114 Å²	114	69%	0.693	75%	0.748	S	S	*	*			cis	-172.8	148.3	41.1	-33.9	0	0	0	0	111.9
426	S	25.3	Very low	27.8	Very low	102 Å²	102	113.3 Å²	113.3	71%	0.713	75%	0.749	S	S	*	*			trans	56	157.9	150.6	58.9	0	0	0	0	120.2
427	V	26	Very low	28.9	Very low	130 Å²	130	113.3 Å²	113.3	79%	0.788	75%	0.746	S	S	*	*			cis	-146	152.8	15.7	-137.2	0	0	0	0	112.9
428	S	27.8	Very low	29.1	Very low	103 Å²	103	113.6 Å²	113.6	72%	0.72	75%	0.748	S	S	*	*			trans	-24.6	178	144.2	-51.4	0	0	0	0	119.5
429	P	44.5	Very low	29.4	Very low	107 Å²	107	114.2 Å²	114.2	70%	0.695	75%	0.746	S	S	*	*			cis	-144.3	177.6	-35.6	36.1	-17.4	0	0	0	116.3
430	S	28.5	Very low	29.5	Very low	110 Å²	110	116.5 Å²	116.5	77%	0.769	74%	0.744	S	S	*	*			trans	70.8	171.4	146	75.3	0	0	0	0	118.1
431	V	30.5	Very low	30.2	Very low	119 Å²	119	111.9 Å²	111.9	72%	0.721	74%	0.735	S	S	*	*			cis	-156.5	142.7	10.7	83.9	0	0	0	0	112.5
432	S	29.4	Very low	29.8	Very low	101 Å²	101	114.9 Å²	114.9	71%	0.706	74%	0.736	S	S	*	*			trans	55.2	175.6	147.2	-59.4	0	0	0	0	120.9
433	T	27.2	Very low	30	Very low	122 Å²	122	118.1 Å²	118.1	75%	0.748	74%	0.736	S	S	*	*			cis	-163.8	166.6	-8.2	4	0	0	0	0	111.5
434	V	28.7	Very low	29.9	Very low	128 Å²	128	120.6 Å²	120.6	78%	0.776	74%	0.735	S	S	*	*			trans	69	151.9	145.4	161	0	0	0	0	118.9
435	S	27.9	Very low	29.8	Very low	80 Å²	80	121.8 Å²	121.8	56%	0.559	74%	0.738	S	S	*	*			cis	-171.2	153.6	-35	-79.9	0	0	0	0	110.8
436	T	28.8	Very low	30	Very low	133 Å²	133	122 Å²	122	82%	0.816	74%	0.739	S	S	*	*			trans	65.8	171.9	145.4	49.5	0	0	0	0	120.3
437	P	47.2	Very low	30	Very low	105 Å²	105	123.9 Å²	123.9	68%	0.682	75%	0.746	S	S	*	*			cis	-143.6	177.9	-42.8	37.7	-18.5	0	0	0	117.9
438	V	25.6	Very low	30.1	Very low	134 Å²	134	122.9 Å²	122.9	81%	0.812	74%	0.741	S	S	*	*			trans	74	156.2	155.3	-135	0	0	0	0	123.3
439	V	29.6	Very low	30.1	Very low	129 Å²	129	124.5 Å²	124.5	78%	0.782	75%	0.747	S	S	*	*			trans	101.6	127.8	151.1	-138.3	0	0	0	0	120
440	T	29.1	Very low	29.3	Very low	128 Å²	128	123.4 Å²	123.4	79%	0.785	75%	0.747	S	S	*	*			trans	-97.8	-161.8	173.8	50.8	0	0	0	0	109.1
441	P	40.5	Very low	29.2	Very low	103 Å²	103	127.3 Å²	127.3	67%	0.669	75%	0.749	S	S	*	*			cis	-140.1	-175.1	1.4	45	-25.7	0	0	0	116.6
442	K	28.3	Very low	29	Very low	178 Å²	178	127.6 Å²	127.6	77%	0.774	75%	0.752	S	S	*	*			trans	42.1	150.7	137.5	-74.1	173.2	166.4	-170.6	0	120.6
443	Q	27.7	Very low	29	Very low	157 Å²	157	127.3 Å²	127.3	73%	0.734	76%	0.755	S	S	*	*			cis	-159.7	-157.1	9.4	-135.6	166	-53.5	0	0	113
444	L	24.1	Very low	30.5	Very low	148 Å²	148	127.1 Å²	127.1	78%	0.775	76%	0.756	S	S	*	*			trans	-73.2	-179.2	-178.2	-61.3	175.7	0	0	0	112.6
445	T	23.5	Very low	31.6	Very low	128 Å²	128	126 Å²	126	79%	0.785	75%	0.752	S	S	*	*			cis	-162.3	166.3	36.3	-36.9	0	0	0	0	115.2
446	V	29.2	Very low	31.8	Very low	118 Å²	118	129 Å²	129	72%	0.715	76%	0.76	S	S	*	*			trans	-46.1	150.4	170.7	170.7	0	0	0	0	116.3
447	T	25.5	Very low	31.9	Very low	140 Å²	140	131.1 Å²	131.1	86%	0.859	76%	0.758	S	S	*	*			trans	-158.6	172.4	142.4	-3.5	0	0	0	0	113.2
448	T	28.5	Very low	31	Very low	109 Å²	109	135.5 Å²	135.5	67%	0.669	77%	0.766	S	S	*	*			trans	-136.5	-179.7	-162.3	52.5	0	0	0	0	113.9
449	T	27.1	Very low	31.7	Very low	138 Å²	138	135.1 Å²	135.1	85%	0.847	77%	0.766	S	S	*	*			trans	77.3	-178.8	169.7	79	0	0	0	0	117.9
450	A	27.7	Very low	31.7	Very low	84 Å²	84	133.2 Å²	133.2	69%	0.694	76%	0.764	S	S	*	*				-163.5	158.2	-70.8	0	0	0	0	0	112.6
451	K	27.7	Very low	32.8	Very low	191 Å²	191	132.7 Å²	132.7	83%	0.83	76%	0.763	S	S	*	*			trans	49.5	127.1	153.2	-74	-176.1	175.2	178.5	0	123.6
452	T	25	Very low	32.2	Very low	126 Å²	126	135.2 Å²	135.2	77%	0.773	78%	0.777	S	S	*	*			trans	74.9	117.7	133.8	53.1	0	0	0	0	126.8
453	A	30.8	Very low	32.1	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	78%	0.778	S	S	*	*				73	175.7	125	0	0	0	0	0	121.1
454	P	57.2	Low	32	Very low	119 Å²	119	134.5 Å²	134.5	77%	0.773	78%	0.777	S	S	*	*			cis	-138.5	-18.4	-1.8	43.4	-31.3	0	0	0	128.2
455	P	51.8	Low	32	Very low	105 Å²	105	132.8 Å²	132.8	68%	0.682	77%	0.772	S	S	*	*			trans	-121.6	135.8	-131.6	30.9	-12.9	0	0	0	123.9
456	I	32.1	Very low	32.3	Very low	143 Å²	143	134.4 Å²	134.4	73%	0.733	78%	0.775	S	S	*	*				78.5	99.7	125.7	-61.2	176.7	0	0	0	125.6
457	K	30.7	Very low	32	Very low	177 Å²	177	135.1 Å²	135.1	77%	0.77	78%	0.78	S	S	*	*				61.5	117.3	126.5	-57.9	178.5	-171.1	168.1	0	127.4
458	K	28.4	Very low	32	Very low	196 Å²	196	134.2 Å²	134.2	85%	0.852	78%	0.779	S	S	*	*			trans	69.1	164.2	130.1	-71.4	-169.9	175.8	-172.4	0	121.2
459	P	40.5	Very low	32.1	Very low	126 Å²	126	136.2 Å²	136.2	82%	0.818	79%	0.786	S	S	*	*			cis	-124.8	-155.5	-4.7	40.3	-22	0	0	0	115.1
460	A	29.7	Very low	32.5	Very low	89 Å²	89	138.6 Å²	138.6	74%	0.736	79%	0.785	S	S	*	*			trans	-146.5	-163.5	-179.8	0	0	0	0	0	109.3
461	P	53.5	Low	33.2	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	79%	0.788	S	S	*	*			cis	-139.1	172.8	-9.2	42.8	-25.5	0	0	0	116.6
462	T	26.4	Very low	33.3	Very low	157 Å²	157	135.1 Å²	135.1	96%	0.963	78%	0.782	S	S	*	*			trans	-150.5	-176.2	164.4	14.1	0	0	0	0	114
463	K	26.5	Very low	33.4	Very low	182 Å²	182	135 Å²	135	79%	0.791	79%	0.786	S	S	*	*			trans	-144.2	170.9	-153.6	-168.1	-166.8	179.5	-175.6	0	110.9
464	I	26.3	Very low	33.2	Very low	138 Å²	138	135.5 Å²	135.5	71%	0.708	78%	0.784	S	S	*	*			trans	77.4	135.4	168.9	-53.4	170.1	0	0	0	112.5
465	T	24	Very low	32.6	Very low	112 Å²	112	135.2 Å²	135.2	69%	0.687	78%	0.782	S	S	*	*			cis	111.7	117.1	9.4	-63.1	0	0	0	0	114
466	L	30.1	Very low	31.5	Very low	162 Å²	162	134.9 Å²	134.9	85%	0.848	79%	0.788	S	S	*	*			trans	57.3	133.4	163.4	-72.7	167.1	0	0	0	120
467	T	23.3	Very low	31.3	Very low	132 Å²	132	132.6 Å²	132.6	81%	0.81	79%	0.79	S	S	*	*			trans	-137.7	133	147.7	43.7	0	0	0	0	111.3
468	S	25.3	Very low	31.4	Very low	121 Å²	121	128.8 Å²	128.8	85%	0.846	79%	0.792	S	S	*	*			trans	-157.6	124.5	161.4	-175.4	0	0	0	0	105.8
469	N	31.2	Very low	31.5	Very low	151 Å²	151	124.7 Å²	124.7	81%	0.807	79%	0.788	S	S	*	*			trans	-103.6	152.5	-162.1	-73	-2.1	0	0	0	113.5
470	K	33.4	Very low	31.1	Very low	188 Å²	188	124.4 Å²	124.4	82%	0.817	78%	0.784	S	S	*	*			trans	-86.3	172.1	179.3	-144.4	-167.9	177.8	179.9	0	110.7
471	P	43.5	Very low	31.2	Very low	119 Å²	119	128.1 Å²	128.1	77%	0.773	79%	0.788	S	S	*	*				-145.8	159.3	78.3	36	-17.4	0	0	0	117.4
472	A	28.8	Very low	29.9	Very low	84 Å²	84	128.3 Å²	128.3	69%	0.694	79%	0.787	S	S	*	*			trans	57.7	158.6	144.9	0	0	0	0	0	121.5
473	S	27.3	Very low	30	Very low	122 Å²	122	126.7 Å²	126.7	85%	0.853	78%	0.777	S	S	*	*			cis	-137.7	-162.6	2.6	57.6	0	0	0	0	112.8
474	S	27.6	Very low	30.3	Very low	105 Å²	105	123.7 Å²	123.7	73%	0.734	77%	0.773	S	S	*	*			trans	-118.6	-169.1	-173.5	56.8	0	0	0	0	111.2
475	P	43.9	Very low	30.4	Very low	113 Å²	113	123.1 Å²	123.1	73%	0.734	78%	0.776	S	S	*	*			cis	-145	-177.5	5.9	44.9	-25.3	0	0	0	119.1
476	A	28.6	Very low	30.4	Very low	99 Å²	99	125.2 Å²	125.2	82%	0.818	78%	0.776	S	S	*	*			trans	65.7	153.4	147.2	0	0	0	0	0	122.5
477	A	28.7	Very low	30.3	Very low	94 Å²	94	124 Å²	124	78%	0.777	77%	0.766	S	S	*	*			cis	-171	149.4	-24.5	0	0	0	0	0	113.5
478	A	31.9	Very low	30.4	Very low	97 Å²	97	126.2 Å²	126.2	80%	0.802	77%	0.767	S	S	*	*			trans	54.6	166.1	158.1	0	0	0	0	0	119.7
479	S	31.1	Very low	31	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	76%	0.757	S	S	*	*			cis	-158.5	-174	5.6	-23.6	0	0	0	0	109.6
480	V	32.4	Very low	30.7	Very low	121 Å²	121	123.7 Å²	123.7	73%	0.733	75%	0.753	S	S	*	*			cis	-170.4	132.3	-43.5	144	0	0	0	0	110.4
481	M	31.3	Very low	30.4	Very low	167 Å²	167	122.3 Å²	122.3	82%	0.823	75%	0.75	S	S	*	*			trans	60.4	168.2	165.5	-65.1	167	68.8	0	0	118.1
482	T	26.6	Very low	29.6	Very low	120 Å²	120	124 Å²	124	74%	0.736	75%	0.751	S	S	*	*			cis	-150.7	-176.8	19.8	-39.9	0	0	0	0	112.3
483	V	29.1	Very low	29.5	Very low	123 Å²	123	125.9 Å²	125.9	75%	0.745	76%	0.76	S	S	*	*			trans	-128.3	-179.8	-177.1	-73.7	0	0	0	0	111.4
484	V	31.1	Very low	29.6	Very low	120 Å²	120	126.4 Å²	126.4	73%	0.727	76%	0.757	S	S	*	*			cis	-166.3	173.2	39.1	-121	0	0	0	0	113.3
485	T	28.1	Very low	29.7	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	76%	0.764	S	S	*	*			trans	69.5	164.7	156.6	46.9	0	0	0	0	118.9
486	K	26	Very low	29	Very low	156 Å²	156	134.4 Å²	134.4	68%	0.678	77%	0.771	S	S	*	*			cis	-156.8	159.7	10.5	-140.5	-178.6	-176.3	-125.5	0	113.3
487	E	27.3	Very low	28.9	Very low	137 Å²	137	137.9 Å²	137.9	64%	0.64	77%	0.772	S	S	*	*			trans	42.3	125.1	148.3	-80	149.9	-149.9	0	0	126.3
488	E	24.6	Very low	28.9	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	78%	0.775	S	S	*	*				34.3	162.4	118.5	-78.5	-140.2	121.7	0	0	124.8
489	P	37.6	Very low	29.1	Very low	97 Å²	97	142.4 Å²	142.4	63%	0.63	77%	0.769	S	S	*	*			cis	-145.5	-166.1	-24.4	38.8	-17.4	0	0	0	116.6
490	V	26.5	Very low	28.9	Very low	121 Å²	121	145 Å²	145	73%	0.733	77%	0.769	S	S	*	*			trans	85.8	118.4	154.2	175.1	0	0	0	0	122.7
491	Q	27.2	Very low	28.6	Very low	160 Å²	160	144.8 Å²	144.8	75%	0.748	77%	0.768	S	S	*	*			trans	24.7	135.9	144.9	-59.5	179.7	-53.8	0	0	126.1
492	L	26.3	Very low	28.5	Very low	153 Å²	153	145.9 Å²	145.9	80%	0.801	77%	0.771	S	S	*	*			trans	51	117.2	131.6	-64.4	166.4	0	0	0	121.4
493	S	26.9	Very low	28.6	Very low	124 Å²	124	147.5 Å²	147.5	87%	0.867	78%	0.776	S	S	*	*				-175.7	175	106.5	47.8	0	0	0	0	112.3
494	V	28.4	Very low	28.8	Very low	133 Å²	133	150.1 Å²	150.1	81%	0.806	78%	0.78	S	S	*	*			trans	-97.1	135.3	-172.4	173.6	0	0	0	0	111.7
495	Q	29.6	Very low	29.2	Very low	186 Å²	186	155.1 Å²	155.1	87%	0.869	79%	0.786	S	S	*	*			trans	-155.2	162.8	144.8	-119.8	161.2	94.8	0	0	113.5
496	K	28.9	Very low	29.3	Very low	201 Å²	201	154.5 Å²	154.5	87%	0.874	79%	0.786	S	S	*	*			trans	-118.8	120.3	-165	168.1	-158.9	170.3	-171.8	0	110.2
497	M	27.7	Very low	29.6	Very low	172 Å²	172	154.7 Å²	154.7	85%	0.847	80%	0.795	S	S	*	*			trans	-158.3	132.3	160.6	32.9	-166.4	158.2	0	0	111.6
498	E	28.7	Very low	29.7	Very low	182 Å²	182	157.5 Å²	157.5	85%	0.85	81%	0.808	S	S	*	*			trans	-91.9	154	160.5	-119.1	-176.1	116.5	0	0	107.1
499	P	35.9	Very low	30.3	Very low	103 Å²	103	153.6 Å²	153.6	67%	0.669	81%	0.806	S	S	*	*				-145.4	-179.8	64.6	41.8	-23.9	0	0	0	115.7
500	Q	26.1	Very low	30	Very low	164 Å²	164	152.8 Å²	152.8	77%	0.766	82%	0.815	S	S	*	*			trans	25.6	134.1	137.8	-64.6	-176.6	-36	0	0	118.9
501	T	26.8	Very low	30.4	Very low	117 Å²	117	150.7 Å²	150.7	72%	0.718	82%	0.819	S	S	*	*			cis	-171	171.6	21.1	1.4	0	0	0	0	113.2
502	E	28.7	Very low	31	Very low	190 Å²	190	152.6 Å²	152.6	89%	0.888	83%	0.827	S	S	*	*			trans	78.6	156	160.4	-44	-136.1	128.2	0	0	119.5
503	D	29.3	Very low	31.7	Very low	155 Å²	155	148.4 Å²	148.4	83%	0.829	82%	0.821	S	S	*	*			trans	-79.9	142.1	-172.7	-81.6	-84.6	0	0	0	113.4
504	E	33.2	Very low	32.8	Very low	177 Å²	177	148.8 Å²	148.8	83%	0.827	81%	0.813	S	S	*	*			trans	-143	144.6	138.5	-118.6	-67.5	62.2	0	0	110.3
505	R	38.7	Very low	34.4	Very low	226 Å²	226	146.7 Å²	146.7	85%	0.853	80%	0.796	S	S	*	*			trans	-143	88.2	-162.5	-173.7	-168.6	176.8	-178.2	1.2	112.3
506	S	30.9	Very low	35.9	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	79%	0.789	S	S	*	*			trans	-134.3	161	175.8	-157.1	0	0	0	0	114.1
507	D	31.4	Very low	38	Very low	160 Å²	160	137 Å²	137	86%	0.856	76%	0.757	S	S	*	*			trans	-73.1	131.9	-157.8	-71.8	-58.2	0	0	0	115.5
508	Q	30.4	Very low	39.9	Very low	196 Å²	196	130 Å²	130	92%	0.916	72%	0.724	S	S	*	*			trans	-98.9	91.7	166.7	-161.1	128.2	79.3	0	0	111.1
509	A	36.2	Very low	41.8	Very low	96 Å²	96	121.7 Å²	121.7	79%	0.793	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-71	135.2	170.2	0	0	0	0	0	110.7	G511	A509-G511 PolarHBondContact O-N 2.89Å
510	G	32.7	Very low	43.3	Very low	80 Å²	80	121 Å²	121	83%	0.825	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-74.5	126.1	-167.6	0	0	0	0	0	114.9
511	G	33.3	Very low	45.4	Very low	78 Å²	78	119.8 Å²	119.8	80%	0.804	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-66.8	153.7	165.2	0	0	0	0	0	112.6	A509 G513	A509-G511 PolarHBondContact O-N 2.89Å; G511-G513 PolarHBondContact O-N 3.02Å
512	Q	40.5	Very low	47.5	Very low	200 Å²	200	118.3 Å²	118.3	94%	0.935	66%	0.655	S	S	*	*			trans	-82.8	110.2	169.8	-63.1	-174.3	21.4	0	0	108.7
513	G	41.2	Very low	49.8	Very low	64 Å²	64	109.8 Å²	109.8	66%	0.66	62%	0.616	S	S	*	*			trans	-62.9	136	171.7	0	0	0	0	0	110.8	G511 I515	G511-G513 PolarHBondContact O-N 3.02Å; G513-I515 PolarHBondContact O-N 3.45Å
514	D	51	Low	52	Low	132 Å²	132	106.7 Å²	106.7	71%	0.706	60%	0.597	S	S	*	*			trans	-69.4	122.8	-174.8	-170	32	0	0	0	111.4	K556	D514-K556 VanDerWaalsContact OD1-CE 3.31Å; D514-K556 WeakPolarHBondContact OD1-CE 3.36Å; D514-K556 IonicContact OD1-NZ 2.64Å; D514-K556 PolarHBondContact OD1-NZ 2.7Å; D514-K556 IonicContact OD2-NZ 3.39Å
515	I	61.6	Low	54.1	Low	89 Å²	89	102.1 Å²	102.1	46%	0.456	58%	0.575	S	S	.	*			trans	-98.9	111.4	-176.3	-41.9	176.1	0	0	0	108.6	G513 K556 R561	G513-I515 PolarHBondContact O-N 3.45Å; I515-K556 WeakPolarHBondContact O-CD 3.46Å; I515-K556 WeakPolarHBondContact O-CE 3.31Å; I515-K556 WeakPolarHBondContact O-CG 3.33Å; I515-R561 VanDerWaalsContact CG2-CZ 3.49Å; I515-R561 VanDerWaalsContact CG2-NH1 3.33Å
516	Q	60.8	Low	55.8	Low	153 Å²	153	95 Å²	95	72%	0.715	56%	0.557	S	S	*	*			trans	-54.8	144.6	176.9	-74.9	178.5	-25.2	0	0	111.9
517	P	72	Confident	57.8	Low	31 Å²	31	97 Å²	97	20%	0.201	55%	0.547	C	S	.	.			trans	-76.2	137.9	170.9	6.5	11.6	0	0	0	108.7	H520 D552 L555	P517-H520 PolarHBondContact O-CE1 2.89Å; P517-H520 VanDerWaalsContact O-CE1 3.31Å; P517-D552 WeakPolarHBondContact CB-OD1 3.31Å; P517-D552 WeakPolarHBondContact CG-OD1 3.44Å; P517-L555 HydrophobicContact CB-CB 3.67Å
518	V	69	Low	59.6	Low	26 Å²	26	93.8 Å²	93.8	16%	0.158	53%	0.53	C	S	.	.			trans	-120.7	133	-170.6	179.8	0	0	0	0	109.2	H560 R561 Y564 L572	V518-H560 PolarHBondContact O-CD2 2.86Å; V518-H560 PolarHBondContact O-NE2 3.31Å; V518-R561 HydrophobicContact CB-CG 4.42Å; V518-R561 HydrophobicContact CG2-CG 4.35Å; V518-Y564 HydrophobicContact CG1-CD1 3.64Å; V518-Y564 HydrophobicContact CG1-CD2 4.18Å; V518-Y564 HydrophobicContact CG1-CE1 3.59Å; V518-Y564 HydrophobicContact CG1-CE2 4.18Å; V518-Y564 HydrophobicContact CG1-CG 3.94Å; V518-L572 HydrophobicContact CG1-CD1 3.6Å; V518-L572 HydrophobicContact CG2-CD2 4.39Å
519	G	68.8	Low	61.1	Low	6 Å²	6	94.2 Å²	94.2	6%	0.062	53%	0.532	C	S	.	.			trans	86.2	35.4	172.2	0	0	0	0	0	115.7	D521 Y522	G519-D521 PolarHBondContact O-N 2.86Å; G519-Y522 PolarHBondContact O-N 3.24Å; G519-Y522 VanDerWaalsContact O-N 3.13Å
520	H	67.4	Low	62.3	Low	89 Å²	89	96.2 Å²	96.2	41%	0.412	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-50.3	-37	175.2	-65.2	98.2	0	0	0	113	P517 Y522 V523 L555	P517-H520 PolarHBondContact O-CE1 2.89Å; P517-H520 VanDerWaalsContact O-CE1 3.31Å; H520-Y522 PolarHBondContact O-N 3.47Å; H520-Y522 VanDerWaalsContact O-N 3.12Å; H520-V523 PolarHBondContact O-N 3.47Å; H520-L555 HydrophobicContact CB-CD1 4.45Å; H520-L555 WeakPolarHBondContact CD2-CD1 3.26Å
521	D	69.3	Low	63.7	Low	139 Å²	139	94.6 Å²	94.6	74%	0.743	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-65.4	-14.7	-175.7	-32.2	-69.7	0	0	0	113.2	G519	G519-D521 PolarHBondContact O-N 2.86Å
522	Y	70.9	Confident	65.3	Low	86 Å²	86	98.4 Å²	98.4	34%	0.337	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-100.2	12.9	177.5	-58.3	-91	0	0	0	113.1	G519 H520 K539 L540 Y564 V568	G519-Y522 PolarHBondContact O-N 3.24Å; G519-Y522 VanDerWaalsContact O-N 3.13Å; H520-Y522 PolarHBondContact O-N 3.47Å; H520-Y522 VanDerWaalsContact O-N 3.12Å; Y522-K539 PolarHBondContact O-N 3.33Å; Y522-L540 HydrophobicContact CD1-CD1 4.3Å; Y522-L540 HydrophobicContact CD1-CD2 4.06Å; Y522-L540 HydrophobicContact CD1-CG 4.18Å; Y522-L540 HydrophobicContact CD2-CD1 4.05Å; Y522-L540 HydrophobicContact CG-CD1 3.76Å; Y522-L540 HydrophobicContact CG-CD2 4.35Å; Y522-L540 HydrophobicContact CG-CG 3.99Å; Y522-Y564 AromaticContact CD2-CE2 3.82Å; Y522-Y564 HydrophobicContact CD2-CE2 3.82Å; Y522-Y564 AromaticContact CE2-CE2 3.77Å; Y522-Y564 HydrophobicContact CE2-CE2 3.77Å; Y522-V568 HydrophobicContact CE1-CG2 4.22Å; Y522-V568 HydrophobicContact CE2-CG1 3.92Å; Y522-V568 HydrophobicContact CE2-CG2 4.37Å; Y522-V568 WeakPolarHBondContact OH-CG1 3.3Å
523	V	76.3	Confident	66.7	Low	10 Å²	10	91.6 Å²	91.6	6%	0.061	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	100.5	174.4	-172.7	0	0	0	0	110.6	H520 F536 H537 C538 K551 L555	H520-V523 PolarHBondContact O-N 3.47Å; V523-F536 HydrophobicContact CG1-CB 3.89Å; V523-H537 CarbonylContact C-O 3.57Å; V523-H537 WeakPolarHBondContact CA-O 3.49Å; V523-C538 HydrophobicContact CG2-CB 4.07Å; V523-K551 HydrophobicContact CB-CD 4.42Å; V523-K551 HydrophobicContact CG1-CD 3.77Å; V523-K551 HydrophobicContact CG1-CG 4.09Å; V523-L555 HydrophobicContact CG2-CD1 4.31Å; V523-L555 HydrophobicContact CG2-CD2 3.72Å; V523-L555 HydrophobicContact CG2-CG 4.31Å
524	E	76.2	Confident	68	Low	91 Å²	91	91.5 Å²	91.5	43%	0.425	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.2	179.3	-66.5	178.7	133	0	0	111.7	F536 H537 K539	E524-F536 CarbonylContact O-C 3.59Å; E524-F536 VanDerWaalsContact O-CA 3.29Å; E524-F536 WeakPolarHBondContact O-CA 3.37Å; E524-H537 PolarHBondContact N-O 2.74Å; E524-H537 PolarHBondContact O-N 2.84Å; E524-K539 VanDerWaalsContact CD-CE 3.49Å; E524-K539 HydrophobicContact CG-CD 4.41Å; E524-K539 IonicContact OE1-NZ 3.83Å; E524-K539 PolarHBondContact OE1-NZ 2.99Å; E524-K539 WeakPolarHBondContact OE2-CD 3.4Å; E524-K539 WeakPolarHBondContact OE2-CE 3.47Å; E524-K539 IonicContact OE2-NZ 3.71Å; E524-K539 PolarHBondContact OE2-NZ 3.35Å; E524-K539 VanDerWaalsContact OE2-NZ 3.09Å
525	E	77.6	Confident	69.2	Low	81 Å²	81	91.4 Å²	91.4	38%	0.379	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	101.6	-178.8	-45.3	-159.8	146.3	0	0	109.4	R527 V533 F536 K551	E525-R527 PolarHBondContact O-N 3.47Å; E525-R527 IonicContact OE2-NH2 2.65Å; E525-V533 HydrophobicContact CB-CG1 4.08Å; E525-V533 HydrophobicContact CB-CG2 4.21Å; E525-F536 HydrophobicContact CB-CD1 4.32Å; E525-F536 HydrophobicContact CB-CE1 4.36Å; E525-F536 HydrophobicContact CG-CD1 3.92Å; E525-F536 HydrophobicContact CG-CE1 3.98Å; E525-F536 WeakPolarHBondContact OE1-CE1 3.4Å; E525-K551 IonicContact OE1-NZ 3.48Å; E525-K551 PolarHBondContact OE1-NZ 2.65Å
526	V	74.2	Confident	70.1	Confident	76 Å²	76	87.8 Å²	87.8	46%	0.461	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	119.2	178	-173.5	0	0	0	0	108.4	I534 R535	V526-I534 HydrophobicContact CG1-CD1 4.32Å; V526-I534 PolarHBondContact O-N 3.14Å; V526-R535 WeakPolarHBondContact CB-O 3.22Å; V526-R535 PolarHBondContact N-O 3.32Å; V526-R535 PolarHBondContact O-N 3Å
527	R	72.4	Confident	70.9	Confident	153 Å²	153	83.6 Å²	83.6	58%	0.577	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	148	178.2	-66.5	174.7	-174.7	-166.5	0.9	110.3	E525 G531 K532 V533	E525-R527 PolarHBondContact O-N 3.47Å; E525-R527 IonicContact OE2-NH2 2.65Å; R527-G531 WeakPolarHBondContact CD-O 3.47Å; R527-K532 CarbonylContact C-O 3.4Å; R527-K532 VanDerWaalsContact CA-O 3.27Å; R527-K532 WeakPolarHBondContact CA-O 3.48Å; R527-V533 HydrophobicContact CG-CB 4.36Å; R527-V533 HydrophobicContact CG-CG2 3.67Å
528	N	70.5	Confident	71.5	Confident	94 Å²	94	82.1 Å²	82.1	50%	0.503	40%	0.404	S	S	.	.			trans	-78.6	169.8	165.1	-104	-3	0	0	0	110.1	D530 G531 K532 I534	N528-D530 PolarHBondContact O-N 3.47Å; N528-G531 WeakPolarHBondContact O-CA 3.36Å; N528-G531 PolarHBondContact O-N 3.25Å; N528-K532 PolarHBondContact N-O 2.86Å; N528-I534 HydrophobicContact CB-CD1 4.01Å; N528-I534 HydrophobicContact CB-CG1 4Å; N528-I534 VanDerWaalsContact CG-CD1 3.47Å; N528-I534 WeakPolarHBondContact OD1-CD1 3.4Å
529	E	62	Low	71.9	Confident	205 Å²	205	86.2 Å²	86.2	96%	0.958	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.1	-178.6	-61.5	178.4	164.4	0	0	112.5	G531	E529-G531 PolarHBondContact O-N 2.96Å; E529-G531 VanDerWaalsContact O-N 3.08Å
530	D	59.8	Low	72.4	Confident	137 Å²	137	86.5 Å²	86.5	73%	0.733	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	16.1	169.2	-53.1	-64.1	0	0	0	114.8	N528 K532	N528-D530 PolarHBondContact O-N 3.47Å; D530-K532 PolarHBondContact O-N 3.46Å
531	G	62.7	Low	72.8	Confident	46 Å²	46	82.6 Å²	82.6	47%	0.474	40%	0.402	S	S	.	.	S	Bend	trans	71.6	-8.2	176.7	0	0	0	0	0	116.8	R527 N528 E529	R527-G531 WeakPolarHBondContact CD-O 3.47Å; N528-G531 WeakPolarHBondContact O-CA 3.36Å; N528-G531 PolarHBondContact O-N 3.25Å; E529-G531 PolarHBondContact O-N 2.96Å; E529-G531 VanDerWaalsContact O-N 3.08Å
532	K	68.3	Low	73.3	Confident	158 Å²	158	82.6 Å²	82.6	69%	0.687	40%	0.398	S	S	*	.			trans	-76.5	133.3	-179.3	-67.8	171	-175.7	165.9	0	111.8	R527 N528 D530	R527-K532 CarbonylContact C-O 3.4Å; R527-K532 VanDerWaalsContact CA-O 3.27Å; R527-K532 WeakPolarHBondContact CA-O 3.48Å; N528-K532 PolarHBondContact N-O 2.86Å; D530-K532 PolarHBondContact O-N 3.46Å
533	V	69.2	Low	73.7	Confident	57 Å²	57	80.2 Å²	80.2	35%	0.345	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	129.7	174.4	-179.1	0	0	0	0	109.8	E525 R527 F536	E525-V533 HydrophobicContact CB-CG1 4.08Å; E525-V533 HydrophobicContact CB-CG2 4.21Å; R527-V533 HydrophobicContact CG-CB 4.36Å; R527-V533 HydrophobicContact CG-CG2 3.67Å; V533-F536 HydrophobicContact CG1-CD1 4.34Å; V533-F536 HydrophobicContact CG1-CE1 3.73Å; V533-F536 HydrophobicContact CG1-CE2 4.39Å; V533-F536 HydrophobicContact CG1-CZ 3.75Å
534	I	68.8	Low	73.7	Confident	63 Å²	63	83.1 Å²	83.1	32%	0.323	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-35.5	-177.5	-15.8	153.2	0	0	0	111.9	V526 N528 N546	V526-I534 HydrophobicContact CG1-CD1 4.32Å; V526-I534 PolarHBondContact O-N 3.14Å; N528-I534 HydrophobicContact CB-CD1 4.01Å; N528-I534 HydrophobicContact CB-CG1 4Å; N528-I534 VanDerWaalsContact CG-CD1 3.47Å; N528-I534 WeakPolarHBondContact OD1-CD1 3.4Å; I534-N546 PolarHBondContact O-ND2 3.01Å; I534-N546 PolarHBondContact O-OD1 3.38Å
535	R	75.9	Confident	73.9	Confident	129 Å²	129	80.9 Å²	80.9	49%	0.487	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	141.1	-172.6	-160.8	173.2	-68.8	157.3	0.7	111.9	V526 F545 N546	V526-R535 WeakPolarHBondContact CB-O 3.22Å; V526-R535 PolarHBondContact N-O 3.32Å; V526-R535 PolarHBondContact O-N 3Å; R535-F545 VanDerWaalsContact CG-O 3.25Å; R535-F545 WeakPolarHBondContact CG-O 3.5Å; R535-N546 PolarHBondContact NE-OD1 3.28Å; R535-N546 PolarHBondContact NH2-OD1 2.85Å
536	F	80.3	Confident	73.8	Confident	14 Å²	14	81 Å²	81	6%	0.061	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140.9	173.8	-55.1	-78	0	0	0	110.1	V523 E524 E525 V533 S544 F545 P548 K551	V523-F536 HydrophobicContact CG1-CB 3.89Å; E524-F536 CarbonylContact O-C 3.59Å; E524-F536 VanDerWaalsContact O-CA 3.29Å; E524-F536 WeakPolarHBondContact O-CA 3.37Å; E525-F536 HydrophobicContact CB-CD1 4.32Å; E525-F536 HydrophobicContact CB-CE1 4.36Å; E525-F536 HydrophobicContact CG-CD1 3.92Å; E525-F536 HydrophobicContact CG-CE1 3.98Å; E525-F536 WeakPolarHBondContact OE1-CE1 3.4Å; V533-F536 HydrophobicContact CG1-CD1 4.34Å; V533-F536 HydrophobicContact CG1-CE1 3.73Å; V533-F536 HydrophobicContact CG1-CE2 4.39Å; V533-F536 HydrophobicContact CG1-CZ 3.75Å; F536-S544 CarbonylContact O-C 3.53Å; F536-S544 WeakPolarHBondContact O-CA 3.46Å; F536-F545 PolarHBondContact N-O 3.28Å; F536-F545 PolarHBondContact O-N 3.07Å; F536-P548 HydrophobicContact CE2-CB 4.26Å; F536-P548 HydrophobicContact CE2-CG 3.88Å; F536-P548 HydrophobicContact CZ-CB 4.28Å; F536-P548 HydrophobicContact CZ-CG 3.94Å; F536-K551 HydrophobicContact CB-CB 4.38Å; F536-K551 HydrophobicContact CB-CD 4.18Å; F536-K551 HydrophobicContact CD1-CD 3.42Å; F536-K551 VanDerWaalsContact CD1-CD 3.42Å; F536-K551 HydrophobicContact CD2-CB 4.28Å; F536-K551 HydrophobicContact CD2-CD 4.46Å; F536-K551 HydrophobicContact CE1-CD 3.87Å; F536-K551 HydrophobicContact CG-CB 4.17Å; F536-K551 HydrophobicContact CG-CD 3.75Å
537	H	77.3	Confident	74.1	Confident	64 Å²	64	82 Å²	82	30%	0.296	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.1	174.9	-175.8	77.4	0	0	0	112.5	V523 E524 C543	V523-H537 CarbonylContact C-O 3.57Å; V523-H537 WeakPolarHBondContact CA-O 3.49Å; E524-H537 PolarHBondContact N-O 2.74Å; E524-H537 PolarHBondContact O-N 2.84Å; H537-C543 PolarHBondContact ND1-O 2.71Å
538	C	84.4	Confident	74.3	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	104.3	-176.4	176.1	0	0	0	0	111.8	V523 L540 C541 E542 C543 F545 H554 H560	V523-C538 HydrophobicContact CG2-CB 4.07Å; C538-L540 VanDerWaalsContact C-N 3.25Å; C538-L540 PolarHBondContact O-N 3.43Å; C538-C541 PolarHBondContact O-N 3.1Å; C538-E542 WeakPolarHBondContact O-CA 3.41Å; C538-E542 PolarHBondContact O-N 3.03Å; C538-C543 PolarHBondContact N-O 3.18Å; C538-F545 HydrophobicContact CB-CE2 4.24Å; C538-H554 PolarHBondContact SG-NE2 3.41Å; C538-H560 PolarHBondContact SG-CE1 2.76Å; C538-H560 PolarHBondContact SG-ND1 2.78Å; C538-H560 VanDerWaalsContact SG-ND1 3.42Å
539	K	77.3	Confident	74.7	Confident	113 Å²	113	80.2 Å²	80.2	49%	0.491	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.7	-177.9	-82.3	174.9	152.4	161.8	0	114.4	Y522 E524	Y522-K539 PolarHBondContact O-N 3.33Å; E524-K539 VanDerWaalsContact CD-CE 3.49Å; E524-K539 HydrophobicContact CG-CD 4.41Å; E524-K539 IonicContact OE1-NZ 3.83Å; E524-K539 PolarHBondContact OE1-NZ 2.99Å; E524-K539 WeakPolarHBondContact OE2-CD 3.4Å; E524-K539 WeakPolarHBondContact OE2-CE 3.47Å; E524-K539 IonicContact OE2-NZ 3.71Å; E524-K539 PolarHBondContact OE2-NZ 3.35Å; E524-K539 VanDerWaalsContact OE2-NZ 3.09Å
540	L	79.1	Confident	75.6	Confident	12 Å²	12	72 Å²	72	6%	0.063	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-26.7	-179.3	-61.9	176.6	0	0	0	113.4	Y522 C538 Q563 Y564 K567 V568	Y522-L540 HydrophobicContact CD1-CD1 4.3Å; Y522-L540 HydrophobicContact CD1-CD2 4.06Å; Y522-L540 HydrophobicContact CD1-CG 4.18Å; Y522-L540 HydrophobicContact CD2-CD1 4.05Å; Y522-L540 HydrophobicContact CG-CD1 3.76Å; Y522-L540 HydrophobicContact CG-CD2 4.35Å; Y522-L540 HydrophobicContact CG-CG 3.99Å; C538-L540 VanDerWaalsContact C-N 3.25Å; C538-L540 PolarHBondContact O-N 3.43Å; L540-Q563 PolarHBondContact O-NE2 3.29Å; L540-Y564 HydrophobicContact CD1-CD2 3.42Å; L540-Y564 VanDerWaalsContact CD1-CD2 3.42Å; L540-Y564 HydrophobicContact CD1-CE2 4.11Å; L540-Y564 HydrophobicContact CD1-CG 4.29Å; L540-K567 HydrophobicContact CD2-CB 4.17Å; L540-K567 HydrophobicContact CD2-CD 4.07Å; L540-K567 PolarHBondContact O-NZ 2.89Å; L540-V568 HydrophobicContact CD1-CG2 3.79Å; L540-V568 HydrophobicContact CD2-CG2 3.53Å; L540-V568 HydrophobicContact CG-CG2 4.32Å
541	C	76.6	Confident	76.5	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.041	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-6.7	-174.6	-67.5	0	0	0	0	114.4	C538 C543 H554 H560 Q563	C538-C541 PolarHBondContact O-N 3.1Å; C541-C543 VanDerWaalsContact C-N 3.31Å; C541-C543 PolarHBondContact O-N 2.98Å; C541-C543 PolarHBondContact O-SG 2.87Å; C541-H554 WeakPolarHBondContact CB-NE2 3.47Å; C541-H554 PolarHBondContact SG-NE2 3.43Å; C541-H560 PolarHBondContact SG-ND1 2.88Å; C541-H560 VanDerWaalsContact SG-ND1 3.42Å; C541-Q563 PolarHBondContact SG-OE1 3.01Å
542	E	79.1	Confident	77.3	Confident	139 Å²	139	67.4 Å²	67.4	65%	0.65	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	43.6	-178.4	-63.2	135.7	-123.7	0	0	112	C538 K567	C538-E542 WeakPolarHBondContact O-CA 3.41Å; C538-E542 PolarHBondContact O-N 3.03Å; E542-K567 IonicContact OE1-NZ 3.52Å; E542-K567 PolarHBondContact OE1-NZ 3.1Å
543	C	79.1	Confident	77.9	Confident	36 Å²	36	65.8 Å²	65.8	24%	0.243	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.7	-176.2	-63.1	0	0	0	0	110.9	H537 C538 C541 F545	H537-C543 PolarHBondContact ND1-O 2.71Å; C538-C543 PolarHBondContact N-O 3.18Å; C541-C543 VanDerWaalsContact C-N 3.31Å; C541-C543 PolarHBondContact O-N 2.98Å; C541-C543 PolarHBondContact O-SG 2.87Å; C543-F545 HydrophobicContact CB-CE1 4.17Å; C543-F545 HydrophobicContact CB-CE2 3.7Å; C543-F545 HydrophobicContact CB-CZ 3.32Å
544	S	76.8	Confident	78.6	Confident	71 Å²	71	64.5 Å²	64.5	50%	0.497	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.2	173.7	58.3	0	0	0	0	112.2	F536	F536-S544 CarbonylContact O-C 3.53Å; F536-S544 WeakPolarHBondContact O-CA 3.46Å
545	F	79.8	Confident	79.2	Confident	45 Å²	45	61.5 Å²	61.5	20%	0.197	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.5	-173.9	-49.8	-76.4	0	0	0	109.7	R535 F536 C538 C543 A550 H554	R535-F545 VanDerWaalsContact CG-O 3.25Å; R535-F545 WeakPolarHBondContact CG-O 3.5Å; F536-F545 PolarHBondContact N-O 3.28Å; F536-F545 PolarHBondContact O-N 3.07Å; C538-F545 HydrophobicContact CB-CE2 4.24Å; C543-F545 HydrophobicContact CB-CE1 4.17Å; C543-F545 HydrophobicContact CB-CE2 3.7Å; C543-F545 HydrophobicContact CB-CZ 3.32Å; F545-A550 HydrophobicContact CB-CB 4.06Å; F545-A550 HydrophobicContact CD1-CB 4.35Å; F545-A550 HydrophobicContact CG-CB 4.44Å; F545-H554 HydrophobicContact CE1-CB 4.39Å; F545-H554 HydrophobicContact CE2-CB 3.95Å; F545-H554 AromaticContact CE2-CD2 3.8Å; F545-H554 AromaticContact CE2-CG 3.59Å; F545-H554 AromaticContact CE2-ND1 3.86Å; F545-H554 HydrophobicContact CZ-CB 3.84Å; F545-H554 AromaticContact CZ-CE1 3.78Å; F545-H554 AromaticContact CZ-CG 3.44Å; F545-H554 VanDerWaalsContact CZ-CG 3.44Å; F545-H554 AromaticContact CZ-ND1 3.28Å; F545-H554 VanDerWaalsContact CZ-ND1 3.28Å; F545-H554 WeakPolarHBondContact CZ-ND1 3.33Å
546	N	76.9	Confident	79.5	Confident	82 Å²	82	58.3 Å²	58.3	44%	0.439	31%	0.307	S	S	.	.	S	Bend	trans	-87.1	-20.8	-178.7	-127.9	83.2	0	0	0	113	I534 R535	I534-N546 PolarHBondContact O-ND2 3.01Å; I534-N546 PolarHBondContact O-OD1 3.38Å; R535-N546 PolarHBondContact NE-OD1 3.28Å; R535-N546 PolarHBondContact NH2-OD1 2.85Å
547	D	79.8	Confident	79.4	Confident	98 Å²	98	58.7 Å²	58.7	52%	0.524	32%	0.315	S	S	.	.	S	Bend	trans	-113.9	141.1	-169.8	-47.1	-67.1	0	0	0	113.2	N549 A550 K551	D547-N549 VanDerWaalsContact C-N 3.31Å; D547-N549 PolarHBondContact O-N 3.04Å; D547-A550 HydrophobicContact CB-CB 4.16Å; D547-A550 WeakPolarHBondContact O-CB 3.28Å; D547-A550 PolarHBondContact O-N 3.07Å; D547-A550 VanDerWaalsContact O-N 3.11Å; D547-K551 PolarHBondContact O-N 2.97Å; D547-K551 VanDerWaalsContact O-N 3.15Å
548	P	78	Confident	79.2	Confident	92 Å²	92	62.7 Å²	62.7	60%	0.597	33%	0.328	S	S	*	.	H	α-helix	trans	-60.7	-36.2	177.2	-23.6	33	0	0	0	113.8	F536 A550 K551 D552	F536-P548 HydrophobicContact CE2-CB 4.26Å; F536-P548 HydrophobicContact CE2-CG 3.88Å; F536-P548 HydrophobicContact CZ-CB 4.28Å; F536-P548 HydrophobicContact CZ-CG 3.94Å; P548-A550 VanDerWaalsContact C-N 3.32Å; P548-A550 PolarHBondContact O-N 2.79Å; P548-K551 WeakPolarHBondContact O-CB 3.42Å; P548-K551 PolarHBondContact O-N 2.74Å; P548-D552 PolarHBondContact O-N 3.09Å; P548-D552 VanDerWaalsContact O-N 3.13Å
549	N	77.1	Confident	78.7	Confident	118 Å²	118	70.2 Å²	70.2	63%	0.631	36%	0.356	S	S	*	.	H	α-helix	trans	-65.9	-35.8	176.7	-168.5	-1.6	0	0	0	111.5	D547 D552 M553	D547-N549 VanDerWaalsContact C-N 3.31Å; D547-N549 PolarHBondContact O-N 3.04Å; N549-D552 PolarHBondContact O-N 3.26Å; N549-M553 WeakPolarHBondContact O-CB 3.32Å; N549-M553 WeakPolarHBondContact O-CG 3.49Å; N549-M553 PolarHBondContact O-N 2.72Å
550	A	81.6	Confident	78.8	Confident	32 Å²	32	64.9 Å²	64.9	26%	0.264	33%	0.333	S	S	.	.	H	α-helix	trans	-68.4	-33.6	174.2	0	0	0	0	0	112.4	F545 D547 P548 H554	F545-A550 HydrophobicContact CB-CB 4.06Å; F545-A550 HydrophobicContact CD1-CB 4.35Å; F545-A550 HydrophobicContact CG-CB 4.44Å; D547-A550 HydrophobicContact CB-CB 4.16Å; D547-A550 WeakPolarHBondContact O-CB 3.28Å; D547-A550 PolarHBondContact O-N 3.07Å; D547-A550 VanDerWaalsContact O-N 3.11Å; P548-A550 VanDerWaalsContact C-N 3.32Å; P548-A550 PolarHBondContact O-N 2.79Å; A550-H554 VanDerWaalsContact O-CB 3.23Å; A550-H554 WeakPolarHBondContact O-CB 3.09Å; A550-H554 PolarHBondContact O-N 2.85Å
551	K	79.6	Confident	78.6	Confident	29 Å²	29	65.8 Å²	65.8	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-59.8	-50.5	170	164.7	171.4	172.2	168.2	0	111	V523 E525 F536 D547 P548 H554 L555	V523-K551 HydrophobicContact CB-CD 4.42Å; V523-K551 HydrophobicContact CG1-CD 3.77Å; V523-K551 HydrophobicContact CG1-CG 4.09Å; E525-K551 IonicContact OE1-NZ 3.48Å; E525-K551 PolarHBondContact OE1-NZ 2.65Å; F536-K551 HydrophobicContact CB-CB 4.38Å; F536-K551 HydrophobicContact CB-CD 4.18Å; F536-K551 HydrophobicContact CD1-CD 3.42Å; F536-K551 VanDerWaalsContact CD1-CD 3.42Å; F536-K551 HydrophobicContact CD2-CB 4.28Å; F536-K551 HydrophobicContact CD2-CD 4.46Å; F536-K551 HydrophobicContact CE1-CD 3.87Å; F536-K551 HydrophobicContact CG-CB 4.17Å; F536-K551 HydrophobicContact CG-CD 3.75Å; D547-K551 PolarHBondContact O-N 2.97Å; D547-K551 VanDerWaalsContact O-N 3.15Å; P548-K551 WeakPolarHBondContact O-CB 3.42Å; P548-K551 PolarHBondContact O-N 2.74Å; K551-H554 PolarHBondContact O-N 3.47Å; K551-L555 HydrophobicContact CG-CD1 4.34Å; K551-L555 WeakPolarHBondContact O-CG 3.4Å; K551-L555 PolarHBondContact O-N 3.1Å; K551-L555 VanDerWaalsContact O-N 3.09Å
552	D	78.9	Confident	78.6	Confident	58 Å²	58	69 Å²	69	31%	0.31	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-50.6	178.5	-174.5	61.1	0	0	0	112.5	P517 P548 N549 H554 L555 K556	P517-D552 WeakPolarHBondContact CB-OD1 3.31Å; P517-D552 WeakPolarHBondContact CG-OD1 3.44Å; P548-D552 PolarHBondContact O-N 3.09Å; P548-D552 VanDerWaalsContact O-N 3.13Å; N549-D552 PolarHBondContact O-N 3.26Å; D552-H554 PolarHBondContact O-N 3.41Å; D552-H554 VanDerWaalsContact O-N 3.14Å; D552-L555 PolarHBondContact O-N 3.46Å; D552-L555 VanDerWaalsContact O-N 3.09Å; D552-K556 VanDerWaalsContact O-CB 3.26Å; D552-K556 WeakPolarHBondContact O-CB 3.36Å; D552-K556 PolarHBondContact O-N 3.01Å
553	M	80.3	Confident	78.4	Confident	124 Å²	124	64.4 Å²	64.4	61%	0.611	33%	0.33	S	S	*	.	H	α-helix	trans	-55.7	-33.3	176.2	-74.9	-120.6	70.8	0	0	112.9	N549 G557	N549-M553 WeakPolarHBondContact O-CB 3.32Å; N549-M553 WeakPolarHBondContact O-CG 3.49Å; N549-M553 PolarHBondContact O-N 2.72Å; M553-G557 PolarHBondContact O-N 2.75Å; M553-G557 VanDerWaalsContact O-N 3.15Å
554	H	84.5	Confident	78.3	Confident	30 Å²	30	64 Å²	64	14%	0.139	32%	0.324	C	S	.	.	H	α-helix	trans	-69.6	-49.5	174.6	178.3	77.5	0	0	0	112.5	C538 C541 F545 A550 K551 D552 K556 G557 H560	C538-H554 PolarHBondContact SG-NE2 3.41Å; C541-H554 WeakPolarHBondContact CB-NE2 3.47Å; C541-H554 PolarHBondContact SG-NE2 3.43Å; F545-H554 HydrophobicContact CE1-CB 4.39Å; F545-H554 HydrophobicContact CE2-CB 3.95Å; F545-H554 AromaticContact CE2-CD2 3.8Å; F545-H554 AromaticContact CE2-CG 3.59Å; F545-H554 AromaticContact CE2-ND1 3.86Å; F545-H554 HydrophobicContact CZ-CB 3.84Å; F545-H554 AromaticContact CZ-CE1 3.78Å; F545-H554 AromaticContact CZ-CG 3.44Å; F545-H554 VanDerWaalsContact CZ-CG 3.44Å; F545-H554 AromaticContact CZ-ND1 3.28Å; F545-H554 VanDerWaalsContact CZ-ND1 3.28Å; F545-H554 WeakPolarHBondContact CZ-ND1 3.33Å; A550-H554 VanDerWaalsContact O-CB 3.23Å; A550-H554 WeakPolarHBondContact O-CB 3.09Å; A550-H554 PolarHBondContact O-N 2.85Å; K551-H554 PolarHBondContact O-N 3.47Å; D552-H554 PolarHBondContact O-N 3.41Å; D552-H554 VanDerWaalsContact O-N 3.14Å; H554-K556 VanDerWaalsContact C-N 3.28Å; H554-K556 PolarHBondContact O-N 2.85Å; H554-G557 WeakPolarHBondContact O-CA 3.41Å; H554-G557 PolarHBondContact O-N 3.47Å; H554-H560 AromaticContact CD2-ND1 3.48Å; H554-H560 PolarHBondContact CD2-ND1 3.27Å; H554-H560 AromaticContact NE2-CG 3.89Å; H554-H560 AromaticContact NE2-ND1 3.14Å; H554-H560 PolarHBondContact NE2-ND1 2.92Å; H554-H560 VanDerWaalsContact NE2-ND1 3.14Å; H554-H560 WeakPolarHBondContact O-CB 3.37Å
555	L	82	Confident	78.3	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-36.1	177.4	-66.7	177.2	0	0	0	111.8	P517 H520 V523 K551 D552 G557 H560	P517-L555 HydrophobicContact CB-CB 3.67Å; H520-L555 HydrophobicContact CB-CD1 4.45Å; H520-L555 WeakPolarHBondContact CD2-CD1 3.26Å; V523-L555 HydrophobicContact CG2-CD1 4.31Å; V523-L555 HydrophobicContact CG2-CD2 3.72Å; V523-L555 HydrophobicContact CG2-CG 4.31Å; K551-L555 HydrophobicContact CG-CD1 4.34Å; K551-L555 WeakPolarHBondContact O-CG 3.4Å; K551-L555 PolarHBondContact O-N 3.1Å; K551-L555 VanDerWaalsContact O-N 3.09Å; D552-L555 PolarHBondContact O-N 3.46Å; D552-L555 VanDerWaalsContact O-N 3.09Å; L555-G557 PolarHBondContact O-N 3.22Å; L555-H560 VanDerWaalsContact CD2-CE1 3.46Å; L555-H560 WeakPolarHBondContact CD2-CE1 3.09Å; L555-H560 WeakPolarHBondContact CD2-NE2 3.33Å
556	K	80.6	Confident	78.2	Confident	62 Å²	62	70.8 Å²	70.8	27%	0.27	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.2	172.3	-158	151.3	179.4	159.2	0	112.9	D514 I515 D552 H554 R561	D514-K556 VanDerWaalsContact OD1-CE 3.31Å; D514-K556 WeakPolarHBondContact OD1-CE 3.36Å; D514-K556 IonicContact OD1-NZ 2.64Å; D514-K556 PolarHBondContact OD1-NZ 2.7Å; D514-K556 IonicContact OD2-NZ 3.39Å; I515-K556 WeakPolarHBondContact O-CD 3.46Å; I515-K556 WeakPolarHBondContact O-CE 3.31Å; I515-K556 WeakPolarHBondContact O-CG 3.33Å; D552-K556 VanDerWaalsContact O-CB 3.26Å; D552-K556 WeakPolarHBondContact O-CB 3.36Å; D552-K556 PolarHBondContact O-N 3.01Å; H554-K556 VanDerWaalsContact C-N 3.28Å; H554-K556 PolarHBondContact O-N 2.85Å; K556-R561 VanDerWaalsContact CA-NH1 3.31Å; K556-R561 PolarHBondContact O-NH1 2.85Å; K556-R561 PolarHBondContact O-NH2 2.82Å
557	G	78.8	Confident	78	Confident	22 Å²	22	72.1 Å²	72.1	23%	0.227	35%	0.346	C	S	.	.	S	Bend	trans	-81.3	142.4	-180	0	0	0	0	0	114.6	M553 H554 L555 R559 H560 R561	M553-G557 PolarHBondContact O-N 2.75Å; M553-G557 VanDerWaalsContact O-N 3.15Å; H554-G557 WeakPolarHBondContact O-CA 3.41Å; H554-G557 PolarHBondContact O-N 3.47Å; L555-G557 PolarHBondContact O-N 3.22Å; G557-R559 VanDerWaalsContact C-N 3.28Å; G557-R559 PolarHBondContact O-N 2.83Å; G557-H560 PolarHBondContact O-N 3.19Å; G557-R561 PolarHBondContact O-N 3.32Å; G557-R561 VanDerWaalsContact O-N 3.12Å
558	R	72.8	Confident	77.4	Confident	148 Å²	148	69.6 Å²	69.6	56%	0.558	33%	0.334	S	S	*	.	H	α-helix	trans	-59.7	-34.7	179.4	-170.6	-178.2	-176.4	-153.2	1.6	113.2	L562	R558-L562 HydrophobicContact CG-CD1 4.02Å; R558-L562 WeakPolarHBondContact O-CB 3.37Å; R558-L562 VanDerWaalsContact O-CG 3.27Å; R558-L562 WeakPolarHBondContact O-CG 3.38Å; R558-L562 PolarHBondContact O-N 2.94Å; R558-L562 VanDerWaalsContact O-N 3.14Å
559	R	74	Confident	76.7	Confident	158 Å²	158	68.3 Å²	68.3	60%	0.596	32%	0.322	S	S	*	.	H	α-helix	trans	-66.4	-44.6	178.4	-169.5	177.9	-174.2	-108.4	8.6	111	G557 L562 Q563	G557-R559 VanDerWaalsContact C-N 3.28Å; G557-R559 PolarHBondContact O-N 2.83Å; R559-L562 PolarHBondContact O-N 2.89Å; R559-Q563 PolarHBondContact O-N 2.98Å
560	H	79.9	Confident	76	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-55.4	176.5	-171.4	90.8	0	0	0	111.4	V518 C538 C541 H554 L555 G557 L562 Q563 Y564	V518-H560 PolarHBondContact O-CD2 2.86Å; V518-H560 PolarHBondContact O-NE2 3.31Å; C538-H560 PolarHBondContact SG-CE1 2.76Å; C538-H560 PolarHBondContact SG-ND1 2.78Å; C538-H560 VanDerWaalsContact SG-ND1 3.42Å; C541-H560 PolarHBondContact SG-ND1 2.88Å; C541-H560 VanDerWaalsContact SG-ND1 3.42Å; H554-H560 AromaticContact CD2-ND1 3.48Å; H554-H560 PolarHBondContact CD2-ND1 3.27Å; H554-H560 AromaticContact NE2-CG 3.89Å; H554-H560 AromaticContact NE2-ND1 3.14Å; H554-H560 PolarHBondContact NE2-ND1 2.92Å; H554-H560 VanDerWaalsContact NE2-ND1 3.14Å; H554-H560 WeakPolarHBondContact O-CB 3.37Å; L555-H560 VanDerWaalsContact CD2-CE1 3.46Å; L555-H560 WeakPolarHBondContact CD2-CE1 3.09Å; L555-H560 WeakPolarHBondContact CD2-NE2 3.33Å; G557-H560 PolarHBondContact O-N 3.19Å; H560-L562 PolarHBondContact O-N 2.8Å; H560-L562 VanDerWaalsContact O-N 3.15Å; H560-Q563 CarbonylContact O-C 3.55Å; H560-Q563 PolarHBondContact O-N 3.26Å; H560-Y564 PolarHBondContact O-N 3.19Å
561	R	75.3	Confident	74.9	Confident	30 Å²	30	73.7 Å²	73.7	11%	0.113	35%	0.347	C	S	.	.	H	α-helix	trans	-56.9	-33.2	179.1	-76.8	-167.5	-68.2	-88.8	-10.7	113.9	I515 V518 K556 G557 K565 V574	I515-R561 VanDerWaalsContact CG2-CZ 3.49Å; I515-R561 VanDerWaalsContact CG2-NH1 3.33Å; V518-R561 HydrophobicContact CB-CG 4.42Å; V518-R561 HydrophobicContact CG2-CG 4.35Å; K556-R561 VanDerWaalsContact CA-NH1 3.31Å; K556-R561 PolarHBondContact O-NH1 2.85Å; K556-R561 PolarHBondContact O-NH2 2.82Å; G557-R561 PolarHBondContact O-N 3.32Å; G557-R561 VanDerWaalsContact O-N 3.12Å; R561-K565 WeakPolarHBondContact O-CB 3.46Å; R561-K565 PolarHBondContact O-N 2.88Å; R561-V574 HydrophobicContact CB-CG2 4.22Å
562	L	76	Confident	74.1	Confident	73 Å²	73	74.3 Å²	74.3	38%	0.382	35%	0.351	S	S	.	.	H	α-helix	trans	-72.9	-36.4	174.2	-73.1	171.8	0	0	0	113	R558 R559 H560 K566 V574	R558-L562 HydrophobicContact CG-CD1 4.02Å; R558-L562 WeakPolarHBondContact O-CB 3.37Å; R558-L562 VanDerWaalsContact O-CG 3.27Å; R558-L562 WeakPolarHBondContact O-CG 3.38Å; R558-L562 PolarHBondContact O-N 2.94Å; R558-L562 VanDerWaalsContact O-N 3.14Å; R559-L562 PolarHBondContact O-N 2.89Å; H560-L562 PolarHBondContact O-N 2.8Å; H560-L562 VanDerWaalsContact O-N 3.15Å; L562-K566 WeakPolarHBondContact O-CB 3.28Å; L562-K566 PolarHBondContact O-N 2.9Å; L562-K566 VanDerWaalsContact O-N 3.12Å; L562-V574 HydrophobicContact CD2-CG1 3.92Å; L562-V574 HydrophobicContact CG-CG1 4.4Å
563	Q	74.8	Confident	73	Confident	44 Å²	44	77.4 Å²	77.4	21%	0.206	37%	0.374	C	S	.	.	H	α-helix	trans	-71.6	-38.2	173.2	-72.2	-179.6	-88.4	0	0	111.5	L540 C541 R559 H560 K566 K567	L540-Q563 PolarHBondContact O-NE2 3.29Å; C541-Q563 PolarHBondContact SG-OE1 3.01Å; R559-Q563 PolarHBondContact O-N 2.98Å; H560-Q563 CarbonylContact O-C 3.55Å; H560-Q563 PolarHBondContact O-N 3.26Å; Q563-K566 PolarHBondContact O-N 2.73Å; Q563-K567 VanDerWaalsContact O-CB 3.29Å; Q563-K567 WeakPolarHBondContact O-CB 3.44Å; Q563-K567 PolarHBondContact O-N 2.71Å
564	Y	77.5	Confident	71.9	Confident	28 Å²	28	72.8 Å²	72.8	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-49.1	172.2	-167.6	-81.4	0	0	0	111.7	V518 Y522 L540 H560 K566 K567 V568 N569 L572	V518-Y564 HydrophobicContact CG1-CD1 3.64Å; V518-Y564 HydrophobicContact CG1-CD2 4.18Å; V518-Y564 HydrophobicContact CG1-CE1 3.59Å; V518-Y564 HydrophobicContact CG1-CE2 4.18Å; V518-Y564 HydrophobicContact CG1-CG 3.94Å; Y522-Y564 AromaticContact CD2-CE2 3.82Å; Y522-Y564 HydrophobicContact CD2-CE2 3.82Å; Y522-Y564 AromaticContact CE2-CE2 3.77Å; Y522-Y564 HydrophobicContact CE2-CE2 3.77Å; L540-Y564 HydrophobicContact CD1-CD2 3.42Å; L540-Y564 VanDerWaalsContact CD1-CD2 3.42Å; L540-Y564 HydrophobicContact CD1-CE2 4.11Å; L540-Y564 HydrophobicContact CD1-CG 4.29Å; H560-Y564 PolarHBondContact O-N 3.19Å; Y564-K566 PolarHBondContact O-N 3.02Å; Y564-K567 PolarHBondContact O-N 3.32Å; Y564-V568 HydrophobicContact CD1-CB 4.21Å; Y564-V568 HydrophobicContact CD2-CB 4.2Å; Y564-V568 HydrophobicContact CD2-CG2 4.2Å; Y564-V568 HydrophobicContact CE1-CB 4.08Å; Y564-V568 HydrophobicContact CE1-CG1 4.01Å; Y564-V568 HydrophobicContact CE2-CB 4.02Å; Y564-V568 HydrophobicContact CE2-CG1 3.85Å; Y564-V568 HydrophobicContact CE2-CG2 4.2Å; Y564-V568 HydrophobicContact CG-CB 4.27Å; Y564-V568 WeakPolarHBondContact O-CA 3.33Å; Y564-V568 WeakPolarHBondContact O-CB 3.32Å; Y564-V568 PolarHBondContact O-N 2.82Å; Y564-N569 HydrophobicContact CD1-CB 4.49Å; Y564-N569 HydrophobicContact CE1-CB 3.89Å; Y564-N569 PolarHBondContact O-N 2.9Å; Y564-N569 VanDerWaalsContact O-N 3.17Å; Y564-L572 HydrophobicContact CD1-CD1 3.77Å; Y564-L572 HydrophobicContact CE1-CD1 3.64Å
565	K	76.8	Confident	70.4	Confident	66 Å²	66	78.1 Å²	78.1	29%	0.287	38%	0.378	S	S	.	.	H	α-helix	trans	-59.7	-33.8	175.5	-172.2	-177.6	176.8	67.3	0	112.5	R561 N569 P570 E571 L572 V574	R561-K565 WeakPolarHBondContact O-CB 3.46Å; R561-K565 PolarHBondContact O-N 2.88Å; K565-N569 WeakPolarHBondContact CA-O 3.21Å; K565-P570 PolarHBondContact NZ-O 2.82Å; K565-P570 WeakPolarHBondContact O-CA 3.32Å; K565-E571 PolarHBondContact NZ-O 3.44Å; K565-L572 WeakPolarHBondContact CD-O 3.23Å; K565-L572 WeakPolarHBondContact CE-O 3.39Å; K565-L572 PolarHBondContact NZ-O 3.48Å; K565-V574 HydrophobicContact CD-CB 4.38Å; K565-V574 HydrophobicContact CD-CG2 4.2Å
566	K	77.4	Confident	69.3	Low	191 Å²	191	84.8 Å²	84.8	83%	0.83	41%	0.412	S	S	*	.	H	α-helix	trans	-83.6	-34.1	179.8	-171.1	177.5	178	-173.3	0	114.2	L562 Q563 Y564	L562-K566 WeakPolarHBondContact O-CB 3.28Å; L562-K566 PolarHBondContact O-N 2.9Å; L562-K566 VanDerWaalsContact O-N 3.12Å; Q563-K566 PolarHBondContact O-N 2.73Å; Y564-K566 PolarHBondContact O-N 3.02Å
567	K	72.2	Confident	67.9	Low	110 Å²	110	89.2 Å²	89.2	48%	0.478	43%	0.431	S	S	.	.	H	α-helix	trans	-100.3	-25	-173.6	-72.3	-176.1	170.7	-179.8	0	114.2	L540 E542 Q563 Y564	L540-K567 HydrophobicContact CD2-CB 4.17Å; L540-K567 HydrophobicContact CD2-CD 4.07Å; L540-K567 PolarHBondContact O-NZ 2.89Å; E542-K567 IonicContact OE1-NZ 3.52Å; E542-K567 PolarHBondContact OE1-NZ 3.1Å; Q563-K567 VanDerWaalsContact O-CB 3.29Å; Q563-K567 WeakPolarHBondContact O-CB 3.44Å; Q563-K567 PolarHBondContact O-N 2.71Å; Y564-K567 PolarHBondContact O-N 3.32Å
568	V	68	Low	66.7	Low	45 Å²	45	92.9 Å²	92.9	27%	0.273	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-53.6	-166.1	-175.9	0	0	0	0	113.7	Y522 L540 Y564	Y522-V568 HydrophobicContact CE1-CG2 4.22Å; Y522-V568 HydrophobicContact CE2-CG1 3.92Å; Y522-V568 HydrophobicContact CE2-CG2 4.37Å; Y522-V568 WeakPolarHBondContact OH-CG1 3.3Å; L540-V568 HydrophobicContact CD1-CG2 3.79Å; L540-V568 HydrophobicContact CD2-CG2 3.53Å; L540-V568 HydrophobicContact CG-CG2 4.32Å; Y564-V568 HydrophobicContact CD1-CB 4.21Å; Y564-V568 HydrophobicContact CD2-CB 4.2Å; Y564-V568 HydrophobicContact CD2-CG2 4.2Å; Y564-V568 HydrophobicContact CE1-CB 4.08Å; Y564-V568 HydrophobicContact CE1-CG1 4.01Å; Y564-V568 HydrophobicContact CE2-CB 4.02Å; Y564-V568 HydrophobicContact CE2-CG1 3.85Å; Y564-V568 HydrophobicContact CE2-CG2 4.2Å; Y564-V568 HydrophobicContact CG-CB 4.27Å; Y564-V568 WeakPolarHBondContact O-CA 3.33Å; Y564-V568 WeakPolarHBondContact O-CB 3.32Å; Y564-V568 PolarHBondContact O-N 2.82Å
569	N	62.7	Low	66.3	Low	66 Å²	66	89.8 Å²	89.8	35%	0.353	45%	0.452	S	S	.	.			trans	-141.8	105.1	-176.7	-168.7	-27	0	0	0	112.3	Y564 K565 E571	Y564-N569 HydrophobicContact CD1-CB 4.49Å; Y564-N569 HydrophobicContact CE1-CB 3.89Å; Y564-N569 PolarHBondContact O-N 2.9Å; Y564-N569 VanDerWaalsContact O-N 3.17Å; K565-N569 WeakPolarHBondContact CA-O 3.21Å; N569-E571 VanDerWaalsContact C-N 3.35Å; N569-E571 PolarHBondContact O-N 3.03Å; N569-E571 PolarHBondContact OD1-N 3.32Å
570	P	62.5	Low	66	Low	98 Å²	98	88.3 Å²	88.3	64%	0.636	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-18.9	-171.9	30.5	-35.9	0	0	0	114.5	K565 L572	K565-P570 PolarHBondContact NZ-O 2.82Å; K565-P570 WeakPolarHBondContact O-CA 3.32Å; P570-L572 VanDerWaalsContact C-N 3.29Å; P570-L572 PolarHBondContact O-N 2.63Å
571	E	58.4	Low	65.6	Low	165 Å²	165	98.6 Å²	98.6	77%	0.771	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-29.6	-178.9	-68.7	-89.8	100.8	0	0	112.1	K565 N569 P573	K565-E571 PolarHBondContact NZ-O 3.44Å; N569-E571 VanDerWaalsContact C-N 3.35Å; N569-E571 PolarHBondContact O-N 3.03Å; N569-E571 PolarHBondContact OD1-N 3.32Å; E571-P573 WeakPolarHBondContact O-CD 3.41Å
572	L	62.2	Low	65.4	Low	42 Å²	42	99.7 Å²	99.7	22%	0.22	51%	0.51	C	S	.	.			trans	-57.3	119	-161.1	-138.5	151.5	0	0	0	114	V518 Y564 K565 P570 V574	V518-L572 HydrophobicContact CG1-CD1 3.6Å; V518-L572 HydrophobicContact CG2-CD2 4.39Å; Y564-L572 HydrophobicContact CD1-CD1 3.77Å; Y564-L572 HydrophobicContact CE1-CD1 3.64Å; K565-L572 WeakPolarHBondContact CD-O 3.23Å; K565-L572 WeakPolarHBondContact CE-O 3.39Å; K565-L572 PolarHBondContact NZ-O 3.48Å; P570-L572 VanDerWaalsContact C-N 3.29Å; P570-L572 PolarHBondContact O-N 2.63Å; L572-V574 PolarHBondContact O-N 2.84Å; L572-V574 VanDerWaalsContact O-N 3.14Å
573	P	56	Low	65.4	Low	123 Å²	123	103.9 Å²	103.9	80%	0.799	52%	0.521	S	S	*	.			trans	-67.2	111.8	-175	-23.9	35	0	0	0	113.1	E571	E571-P573 WeakPolarHBondContact O-CD 3.41Å
574	V	57	Low	65.6	Low	26 Å²	26	109.3 Å²	109.3	16%	0.158	54%	0.544	C	S	.	.			trans	-123	105.4	172.8	-179.2	0	0	0	0	108.2	R561 L562 K565 L572 I576	R561-V574 HydrophobicContact CB-CG2 4.22Å; L562-V574 HydrophobicContact CD2-CG1 3.92Å; L562-V574 HydrophobicContact CG-CG1 4.4Å; K565-V574 HydrophobicContact CD-CB 4.38Å; K565-V574 HydrophobicContact CD-CG2 4.2Å; L572-V574 PolarHBondContact O-N 2.84Å; L572-V574 VanDerWaalsContact O-N 3.14Å; V574-I576 PolarHBondContact O-N 3.15Å
575	E	53.3	Low	65.8	Low	143 Å²	143	112.9 Å²	112.9	67%	0.668	56%	0.564	S	S	*	*			trans	-55.3	112.1	-179.7	-74.5	-162.1	135	0	0	112	K577	E575-K577 PolarHBondContact O-N 3.45Å; E575-K577 WeakPolarHBondContact OE2-CE 3.44Å; E575-K577 IonicContact OE2-NZ 2.86Å; E575-K577 PolarHBondContact OE2-NZ 3.49Å
576	I	59.2	Low	65.7	Low	139 Å²	139	116.6 Å²	116.6	71%	0.713	58%	0.583	S	S	*	*			trans	-80.6	76	165	-52.2	179.8	0	0	0	107.4	V574 P578	V574-I576 PolarHBondContact O-N 3.15Å; I576-P578 WeakPolarHBondContact O-CD 3.09Å
577	K	51.1	Low	66	Low	156 Å²	156	112.4 Å²	112.4	68%	0.678	57%	0.566	S	S	*	*			trans	-50.8	115	175.3	-89.9	176.9	171.9	149.9	0	109.5	E575	E575-K577 PolarHBondContact O-N 3.45Å; E575-K577 WeakPolarHBondContact OE2-CE 3.44Å; E575-K577 IonicContact OE2-NZ 2.86Å; E575-K577 PolarHBondContact OE2-NZ 3.49Å
578	P	54.5	Low	66.5	Low	99 Å²	99	110.6 Å²	110.6	64%	0.643	57%	0.567	S	S	*	*			trans	-67.6	146.6	-171.9	25.9	-34	0	0	0	110.5	I576 N580	I576-P578 WeakPolarHBondContact O-CD 3.09Å; P578-N580 PolarHBondContact O-N 2.95Å
579	S	63.3	Low	67.5	Low	82 Å²	82	115.4 Å²	115.4	57%	0.573	59%	0.585	S	S	*	*			trans	-51.8	135.6	-173.8	177.6	0	0	0	0	112.4	R581 A582 R583	S579-R581 PolarHBondContact O-N 2.85Å; S579-A582 WeakPolarHBondContact O-CA 3.25Å; S579-A582 WeakPolarHBondContact O-CB 3.49Å; S579-A582 PolarHBondContact O-N 3.4Å; S579-R583 PolarHBondContact O-N 3.2Å
580	N	68.5	Low	68.6	Low	127 Å²	127	116.6 Å²	116.6	68%	0.679	59%	0.59	S	S	*	*	H	α-helix	trans	-50.3	-30.6	177.2	-76.5	-50.7	0	0	0	113.1	P578 K584	P578-N580 PolarHBondContact O-N 2.95Å; N580-K584 VanDerWaalsContact O-CB 3.28Å; N580-K584 WeakPolarHBondContact O-CB 3.33Å; N580-K584 PolarHBondContact O-N 3.06Å
581	R	70.1	Confident	69.8	Low	218 Å²	218	119.4 Å²	119.4	82%	0.823	59%	0.593	S	S	*	*	H	α-helix	trans	-66	-37.9	175.5	-167.4	177.7	-174.5	-176.7	2.2	112.7	S579 L585	S579-R581 PolarHBondContact O-N 2.85Å; R581-L585 WeakPolarHBondContact O-CB 3.39Å; R581-L585 PolarHBondContact O-N 3.08Å
582	A	71.9	Confident	71.2	Confident	53 Å²	53	118.1 Å²	118.1	44%	0.438	58%	0.584	S	S	.	*	H	α-helix	trans	-71.5	-46.7	176.5	0	0	0	0	0	111.1	S579 K584 L585 Q586	S579-A582 WeakPolarHBondContact O-CA 3.25Å; S579-A582 WeakPolarHBondContact O-CB 3.49Å; S579-A582 PolarHBondContact O-N 3.4Å; A582-K584 PolarHBondContact O-N 2.71Å; A582-L585 PolarHBondContact O-N 2.78Å; A582-L585 VanDerWaalsContact O-N 3.13Å; A582-Q586 PolarHBondContact O-N 3.37Å
583	R	76.1	Confident	72.2	Confident	161 Å²	161	122.3 Å²	122.3	61%	0.608	60%	0.603	S	S	*	*	H	α-helix	trans	-56.4	-48.9	176.4	-160.9	-176.3	87.7	173.1	5.2	111.4	S579 L585 Q586 E587	S579-R583 PolarHBondContact O-N 3.2Å; R583-L585 VanDerWaalsContact C-N 3.29Å; R583-L585 PolarHBondContact O-N 3.19Å; R583-Q586 PolarHBondContact O-N 2.73Å; R583-E587 WeakPolarHBondContact O-CB 3.47Å; R583-E587 PolarHBondContact O-N 3.15Å
584	K	79.4	Confident	73.6	Confident	158 Å²	158	123.1 Å²	123.1	69%	0.687	59%	0.594	S	S	*	*	H	α-helix	trans	-64.4	-29.5	179	-164.1	167.5	-173	171.1	0	113.2	N580 A582 S588	N580-K584 VanDerWaalsContact O-CB 3.28Å; N580-K584 WeakPolarHBondContact O-CB 3.33Å; N580-K584 PolarHBondContact O-N 3.06Å; A582-K584 PolarHBondContact O-N 2.71Å; K584-S588 VanDerWaalsContact O-CB 3.23Å; K584-S588 WeakPolarHBondContact O-CB 3.49Å; K584-S588 PolarHBondContact O-N 2.82Å
585	L	80.4	Confident	74.9	Confident	102 Å²	102	127.9 Å²	127.9	53%	0.534	61%	0.614	S	S	.	*	H	α-helix	trans	-73.7	-40.8	173.4	-177.6	62.7	0	0	0	112.1	R581 A582 R583 S588 K589	R581-L585 WeakPolarHBondContact O-CB 3.39Å; R581-L585 PolarHBondContact O-N 3.08Å; A582-L585 PolarHBondContact O-N 2.78Å; A582-L585 VanDerWaalsContact O-N 3.13Å; R583-L585 VanDerWaalsContact C-N 3.29Å; R583-L585 PolarHBondContact O-N 3.19Å; L585-S588 PolarHBondContact O-N 3.16Å; L585-K589 WeakPolarHBondContact O-CG 3.42Å; L585-K589 PolarHBondContact O-N 3.23Å
586	Q	75.3	Confident	76.6	Confident	145 Å²	145	128 Å²	128	68%	0.678	61%	0.613	S	S	*	*	H	α-helix	trans	-67.8	-41.8	176.7	-170.1	172.4	3.1	0	0	111.5	A582 R583 K589 L590	A582-Q586 PolarHBondContact O-N 3.37Å; R583-Q586 PolarHBondContact O-N 2.73Å; Q586-K589 WeakPolarHBondContact O-CB 3.27Å; Q586-K589 PolarHBondContact O-N 2.94Å; Q586-L590 PolarHBondContact O-N 3.41Å
587	E	84.2	Confident	78	Confident	103 Å²	103	124.1 Å²	124.1	48%	0.481	60%	0.601	S	S	.	*	H	α-helix	trans	-60.5	-43.9	172.1	-168.4	-169.6	149.7	0	0	111.7	R583 L590 K591	R583-E587 WeakPolarHBondContact O-CB 3.47Å; R583-E587 PolarHBondContact O-N 3.15Å; E587-L590 PolarHBondContact O-N 3.1Å; E587-K591 WeakPolarHBondContact O-CB 3.44Å; E587-K591 PolarHBondContact O-N 3.37Å
588	S	82.1	Confident	79.9	Confident	71 Å²	71	120.8 Å²	120.8	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-62.2	-42	174.1	-178	0	0	0	0	112.5	K584 L585 K591 K592	K584-S588 VanDerWaalsContact O-CB 3.23Å; K584-S588 WeakPolarHBondContact O-CB 3.49Å; K584-S588 PolarHBondContact O-N 2.82Å; L585-S588 PolarHBondContact O-N 3.16Å; S588-K591 PolarHBondContact O-N 3.05Å; S588-K592 WeakPolarHBondContact O-CB 3.49Å; S588-K592 PolarHBondContact O-N 3.45Å
589	K	88.6	Confident	81.4	Confident	147 Å²	147	120.8 Å²	120.8	64%	0.639	59%	0.588	S	S	*	*	H	α-helix	trans	-59.7	-47.4	172.2	-76.7	179.1	177	-176.6	0	111.3	L585 Q586 K592 Q593	L585-K589 WeakPolarHBondContact O-CG 3.42Å; L585-K589 PolarHBondContact O-N 3.23Å; Q586-K589 WeakPolarHBondContact O-CB 3.27Å; Q586-K589 PolarHBondContact O-N 2.94Å; K589-K592 PolarHBondContact O-N 3.31Å; K589-Q593 WeakPolarHBondContact O-CB 3.44Å; K589-Q593 PolarHBondContact O-N 3.34Å
590	L	86.6	Confident	82.5	Confident	91 Å²	91	123 Å²	123	48%	0.476	59%	0.587	S	S	.	*	H	α-helix	trans	-62.9	-42.9	178.7	-171.4	71.8	0	0	0	111.9	Q586 E587 K592 Q593 K594	Q586-L590 PolarHBondContact O-N 3.41Å; E587-L590 PolarHBondContact O-N 3.1Å; L590-K592 PolarHBondContact O-N 3.03Å; L590-Q593 WeakPolarHBondContact O-CB 3.45Å; L590-Q593 PolarHBondContact O-N 2.84Å; L590-K594 PolarHBondContact O-N 3.38Å
591	K	87.4	Confident	83.6	Confident	157 Å²	157	125 Å²	125	68%	0.683	59%	0.585	S	S	*	*	H	α-helix	trans	-63.9	-40.9	177.4	-159.7	166.3	-172.2	168.5	0	111.4	E587 S588 K594 Q595	E587-K591 WeakPolarHBondContact O-CB 3.44Å; E587-K591 PolarHBondContact O-N 3.37Å; S588-K591 PolarHBondContact O-N 3.05Å; K591-K594 PolarHBondContact O-N 3.05Å; K591-Q595 WeakPolarHBondContact O-CB 3.38Å; K591-Q595 PolarHBondContact O-N 2.93Å
592	K	87.4	Confident	84.3	Confident	137 Å²	137	119.8 Å²	119.8	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-69.6	-30.7	174.3	-161.9	167.1	-171.2	170.7	0	112.8	S588 K589 L590 K596	S588-K592 WeakPolarHBondContact O-CB 3.49Å; S588-K592 PolarHBondContact O-N 3.45Å; K589-K592 PolarHBondContact O-N 3.31Å; L590-K592 PolarHBondContact O-N 3.03Å; K592-K596 WeakPolarHBondContact O-CG 3.5Å; K592-K596 PolarHBondContact O-N 3.01Å
593	Q	84.1	Confident	84.8	Confident	130 Å²	130	125.1 Å²	125.1	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-69.7	-47.3	172.2	-171.7	-178.8	15.6	0	0	111.4	K589 L590 Q595 K596 A597	K589-Q593 WeakPolarHBondContact O-CB 3.44Å; K589-Q593 PolarHBondContact O-N 3.34Å; L590-Q593 WeakPolarHBondContact O-CB 3.45Å; L590-Q593 PolarHBondContact O-N 2.84Å; Q593-Q595 VanDerWaalsContact C-N 3.34Å; Q593-Q595 PolarHBondContact O-N 3.04Å; Q593-K596 PolarHBondContact O-N 2.87Å; Q593-A597 PolarHBondContact O-N 3.1Å
594	K	85.1	Confident	85.3	Confident	140 Å²	140	120.5 Å²	120.5	61%	0.609	56%	0.564	S	S	*	*	H	α-helix	trans	-58.5	-43.7	173.5	-73.5	-172.3	176	-172.1	0	111.5	L590 K591 K596 A597 V598	L590-K594 PolarHBondContact O-N 3.38Å; K591-K594 PolarHBondContact O-N 3.05Å; K594-K596 PolarHBondContact O-N 3.27Å; K594-A597 WeakPolarHBondContact O-CB 3.01Å; K594-A597 PolarHBondContact O-N 3.4Å; K594-A597 VanDerWaalsContact O-N 3.17Å; K594-V598 WeakPolarHBondContact O-CG2 3.39Å; K594-V598 PolarHBondContact O-N 2.98Å
595	Q	84.7	Confident	85.6	Confident	127 Å²	127	116 Å²	116	59%	0.593	55%	0.547	S	S	*	.	H	α-helix	trans	-61.7	-42.7	175.5	-167.7	179.6	24.3	0	0	112.5	K591 Q593 A597 V598 L599	K591-Q595 WeakPolarHBondContact O-CB 3.38Å; K591-Q595 PolarHBondContact O-N 2.93Å; Q593-Q595 VanDerWaalsContact C-N 3.34Å; Q593-Q595 PolarHBondContact O-N 3.04Å; Q595-A597 VanDerWaalsContact C-N 3.34Å; Q595-A597 PolarHBondContact O-N 3.33Å; Q595-V598 PolarHBondContact O-N 3.41Å; Q595-L599 HydrophobicContact CG-CD1 4.45Å; Q595-L599 WeakPolarHBondContact O-CG 3.46Å; Q595-L599 PolarHBondContact O-N 3.13Å; Q595-L599 VanDerWaalsContact O-N 3.08Å
596	K	88.1	Confident	85.4	Confident	146 Å²	146	116.8 Å²	116.8	64%	0.635	55%	0.548	S	S	*	.	H	α-helix	trans	-63.2	-37.3	172.8	-80.5	-174.4	172.4	-168.2	0	112.8	K592 Q593 K594 K600	K592-K596 WeakPolarHBondContact O-CG 3.5Å; K592-K596 PolarHBondContact O-N 3.01Å; Q593-K596 PolarHBondContact O-N 2.87Å; K594-K596 PolarHBondContact O-N 3.27Å; K596-K600 WeakPolarHBondContact O-CB 3.36Å; K596-K600 PolarHBondContact O-N 2.73Å
597	A	89.3	Confident	85.6	Confident	57 Å²	57	115.5 Å²	115.5	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-42.1	177.7	0	0	0	0	0	111.8	Q593 K594 Q595 K600 R601	Q593-A597 PolarHBondContact O-N 3.1Å; K594-A597 WeakPolarHBondContact O-CB 3.01Å; K594-A597 PolarHBondContact O-N 3.4Å; K594-A597 VanDerWaalsContact O-N 3.17Å; Q595-A597 VanDerWaalsContact C-N 3.34Å; Q595-A597 PolarHBondContact O-N 3.33Å; A597-K600 PolarHBondContact O-N 2.94Å; A597-R601 WeakPolarHBondContact O-CB 2.91Å; A597-R601 PolarHBondContact O-N 3.19Å
598	V	90.6	Very high	85.8	Confident	86 Å²	86	117.1 Å²	117.1	52%	0.521	54%	0.544	S	S	.	.	H	α-helix	trans	-61.8	-46.4	173.9	172.9	0	0	0	0	111.3	K594 Q595 K600 R601 Q602	K594-V598 WeakPolarHBondContact O-CG2 3.39Å; K594-V598 PolarHBondContact O-N 2.98Å; Q595-V598 PolarHBondContact O-N 3.41Å; V598-K600 VanDerWaalsContact C-N 3.31Å; V598-K600 PolarHBondContact O-N 3.49Å; V598-R601 PolarHBondContact O-N 2.77Å; V598-Q602 PolarHBondContact O-N 3.21Å
599	L	85.2	Confident	85.9	Confident	98 Å²	98	121 Å²	121	51%	0.513	55%	0.548	S	S	.	.	H	α-helix	trans	-65.2	-32	176.9	-70.2	168.9	0	0	0	113.1	Q595 R603	Q595-L599 HydrophobicContact CG-CD1 4.45Å; Q595-L599 WeakPolarHBondContact O-CG 3.46Å; Q595-L599 PolarHBondContact O-N 3.13Å; Q595-L599 VanDerWaalsContact O-N 3.08Å; L599-R603 PolarHBondContact O-N 3.17Å
600	K	87.3	Confident	85.7	Confident	128 Å²	128	119.8 Å²	119.8	56%	0.557	54%	0.544	S	S	*	.	H	α-helix	trans	-67.8	-44.2	171.6	-178.9	173.1	-177.6	-77.2	0	110.9	K596 A597 V598 R603 E604	K596-K600 WeakPolarHBondContact O-CB 3.36Å; K596-K600 PolarHBondContact O-N 2.73Å; A597-K600 PolarHBondContact O-N 2.94Å; V598-K600 VanDerWaalsContact C-N 3.31Å; V598-K600 PolarHBondContact O-N 3.49Å; K600-R603 PolarHBondContact O-N 3.15Å; K600-E604 VanDerWaalsContact CE-OE1 3.26Å; K600-E604 WeakPolarHBondContact CE-OE1 3.11Å; K600-E604 WeakPolarHBondContact CG-OE1 3.04Å; K600-E604 IonicContact NZ-OE1 2.69Å; K600-E604 PolarHBondContact NZ-OE1 3.39Å; K600-E604 WeakPolarHBondContact O-CG 3.07Å; K600-E604 PolarHBondContact O-N 3.01Å
601	R	90.8	Very high	85.1	Confident	171 Å²	171	121.6 Å²	121.6	65%	0.645	55%	0.552	S	S	*	*	H	α-helix	trans	-63.1	-48	178	-155.5	-172.9	-173.9	165.8	5.8	111.4	A597 V598 R603 E604 D605	A597-R601 WeakPolarHBondContact O-CB 2.91Å; A597-R601 PolarHBondContact O-N 3.19Å; V598-R601 PolarHBondContact O-N 2.77Å; R601-R603 VanDerWaalsContact C-N 3.31Å; R601-R603 PolarHBondContact O-N 2.7Å; R601-E604 CarbonylContact O-C 3.59Å; R601-E604 WeakPolarHBondContact O-CB 3.48Å; R601-E604 PolarHBondContact O-N 3.47Å; R601-D605 WeakPolarHBondContact CG-OD2 3.07Å; R601-D605 WeakPolarHBondContact O-CB 3.48Å; R601-D605 PolarHBondContact O-N 3.25Å
602	Q	86.2	Confident	85.1	Confident	108 Å²	108	120 Å²	120	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-53.5	-46.2	173.9	-77.3	-179.2	-40.2	0	0	112.1	V598 E604 D605 E606	V598-Q602 PolarHBondContact O-N 3.21Å; Q602-E604 PolarHBondContact O-N 3.38Å; Q602-D605 PolarHBondContact O-N 2.83Å; Q602-E606 WeakPolarHBondContact O-CB 3.45Å; Q602-E606 VanDerWaalsContact O-CG 3.28Å; Q602-E606 WeakPolarHBondContact O-CG 3.31Å; Q602-E606 PolarHBondContact O-N 3.01Å
603	R	82.1	Confident	84.2	Confident	164 Å²	164	116.7 Å²	116.7	62%	0.619	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-38	176.3	-176	-179.2	-62.1	172.3	1.1	113.5	L599 K600 R601 D605 Q607	L599-R603 PolarHBondContact O-N 3.17Å; K600-R603 PolarHBondContact O-N 3.15Å; R601-R603 VanDerWaalsContact C-N 3.31Å; R601-R603 PolarHBondContact O-N 2.7Å; R603-D605 VanDerWaalsContact C-N 3.32Å; R603-Q607 WeakPolarHBondContact O-CB 3.4Å; R603-Q607 WeakPolarHBondContact O-CG 3.49Å; R603-Q607 PolarHBondContact O-N 3.06Å
604	E	86.2	Confident	83.9	Confident	65 Å²	65	117.7 Å²	117.7	30%	0.304	53%	0.533	S	S	.	.	H	α-helix	trans	-67.4	-36.5	175.2	-76	170.1	-164.7	0	0	111.5	K600 R601 Q602 Q607 R608	K600-E604 VanDerWaalsContact CE-OE1 3.26Å; K600-E604 WeakPolarHBondContact CE-OE1 3.11Å; K600-E604 WeakPolarHBondContact CG-OE1 3.04Å; K600-E604 IonicContact NZ-OE1 2.69Å; K600-E604 PolarHBondContact NZ-OE1 3.39Å; K600-E604 WeakPolarHBondContact O-CG 3.07Å; K600-E604 PolarHBondContact O-N 3.01Å; R601-E604 CarbonylContact O-C 3.59Å; R601-E604 WeakPolarHBondContact O-CB 3.48Å; R601-E604 PolarHBondContact O-N 3.47Å; Q602-E604 PolarHBondContact O-N 3.38Å; E604-Q607 PolarHBondContact O-N 2.89Å; E604-R608 WeakPolarHBondContact O-CG 3.33Å; E604-R608 PolarHBondContact O-N 3.41Å; E604-R608 IonicContact OE2-NH2 2.67Å
605	D	85.1	Confident	83.5	Confident	62 Å²	62	118.5 Å²	118.5	33%	0.332	53%	0.532	S	S	.	.	H	α-helix	trans	-78.4	-33.5	-179.3	-58.8	-19.3	0	0	0	111.2	R601 Q602 R603 Q607 R608 W609	R601-D605 WeakPolarHBondContact CG-OD2 3.07Å; R601-D605 WeakPolarHBondContact O-CB 3.48Å; R601-D605 PolarHBondContact O-N 3.25Å; Q602-D605 PolarHBondContact O-N 2.83Å; R603-D605 VanDerWaalsContact C-N 3.32Å; D605-Q607 VanDerWaalsContact C-N 3.33Å; D605-R608 PolarHBondContact O-N 3.1Å; D605-R608 IonicContact OD1-CZ 3.54Å; D605-R608 VanDerWaalsContact OD1-CZ 3.31Å; D605-R608 IonicContact OD1-NE 2.85Å; D605-R608 PolarHBondContact OD1-NE 2.86Å; D605-R608 IonicContact OD1-NH2 3.18Å; D605-R608 PolarHBondContact OD1-NH2 2.83Å; D605-W609 VanDerWaalsContact O-CB 3.29Å; D605-W609 WeakPolarHBondContact O-CB 3.45Å; D605-W609 PolarHBondContact O-N 3.36Å
606	E	76.1	Confident	83.1	Confident	119 Å²	119	118.9 Å²	118.9	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-58.4	-42.6	163.1	-75.8	169.3	169.7	0	0	111.4	Q602 W609 H610	Q602-E606 WeakPolarHBondContact O-CB 3.45Å; Q602-E606 VanDerWaalsContact O-CG 3.28Å; Q602-E606 WeakPolarHBondContact O-CG 3.31Å; Q602-E606 PolarHBondContact O-N 3.01Å; E606-W609 PolarHBondContact O-N 3.33Å; E606-H610 WeakPolarHBondContact O-CB 3.46Å; E606-H610 PolarHBondContact O-CD2 3.48Å; E606-H610 VanDerWaalsContact O-CD2 3.24Å; E606-H610 PolarHBondContact O-N 3.45Å
607	Q	80.4	Confident	82.6	Confident	119 Å²	119	118 Å²	118	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-71.7	-36.6	178.3	-75.5	174.7	12.2	0	0	112.8	R603 E604 D605 M611	R603-Q607 WeakPolarHBondContact O-CB 3.4Å; R603-Q607 WeakPolarHBondContact O-CG 3.49Å; R603-Q607 PolarHBondContact O-N 3.06Å; E604-Q607 PolarHBondContact O-N 2.89Å; D605-Q607 VanDerWaalsContact C-N 3.33Å; Q607-M611 WeakPolarHBondContact O-CB 3.34Å; Q607-M611 PolarHBondContact O-N 3.07Å; Q607-M611 VanDerWaalsContact O-N 3.1Å
608	R	87.8	Confident	81.8	Confident	137 Å²	137	119.9 Å²	119.9	52%	0.517	53%	0.526	S	S	.	.	H	α-helix	trans	-59.2	-54.1	168.1	-75.6	179.7	-119.2	-91.9	-4.5	109.7	E604 D605 H610 M611 E612	E604-R608 WeakPolarHBondContact O-CG 3.33Å; E604-R608 PolarHBondContact O-N 3.41Å; E604-R608 IonicContact OE2-NH2 2.67Å; D605-R608 PolarHBondContact O-N 3.1Å; D605-R608 IonicContact OD1-CZ 3.54Å; D605-R608 VanDerWaalsContact OD1-CZ 3.31Å; D605-R608 IonicContact OD1-NE 2.85Å; D605-R608 PolarHBondContact OD1-NE 2.86Å; D605-R608 IonicContact OD1-NH2 3.18Å; D605-R608 PolarHBondContact OD1-NH2 2.83Å; R608-H610 VanDerWaalsContact C-N 3.33Å; R608-H610 PolarHBondContact O-N 3.14Å; R608-M611 CarbonylContact O-C 3.52Å; R608-M611 WeakPolarHBondContact O-CA 3.48Å; R608-M611 WeakPolarHBondContact O-CB 3.45Å; R608-M611 PolarHBondContact O-N 3.03Å; R608-E612 WeakPolarHBondContact O-CB 3.38Å; R608-E612 PolarHBondContact O-N 2.98Å
609	W	83.9	Confident	81.1	Confident	152 Å²	152	119.9 Å²	119.9	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-58.3	-41.6	-179.6	-174.8	83.5	0	0	0	112.5	D605 E606 M611 E612 M613	D605-W609 VanDerWaalsContact O-CB 3.29Å; D605-W609 WeakPolarHBondContact O-CB 3.45Å; D605-W609 PolarHBondContact O-N 3.36Å; E606-W609 PolarHBondContact O-N 3.33Å; W609-M611 VanDerWaalsContact C-N 3.32Å; W609-M611 PolarHBondContact O-N 2.94Å; W609-E612 PolarHBondContact O-N 2.83Å; W609-M613 HydrophobicContact CD2-CG 3.79Å; W609-M613 VanDerWaalsContact CE2-CG 3.48Å; W609-M613 HydrophobicContact CE3-CG 4.09Å; W609-M613 HydrophobicContact CG-CG 4.41Å; W609-M613 HydrophobicContact CH2-CG 3.86Å; W609-M613 HydrophobicContact CZ2-CG 3.54Å; W609-M613 HydrophobicContact CZ2-SD 3.86Å; W609-M613 HydrophobicContact CZ3-CG 4.12Å; W609-M613 VanDerWaalsContact O-CB 3.28Å; W609-M613 WeakPolarHBondContact O-CB 3.21Å; W609-M613 VanDerWaalsContact O-CG 3.27Å; W609-M613 WeakPolarHBondContact O-CG 3.46Å; W609-M613 PolarHBondContact O-N 3.25Å
610	H	85.9	Confident	80.4	Confident	121 Å²	121	118.8 Å²	118.8	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-65.6	-29.5	173.4	-85.6	-60.1	0	0	0	114.2	E606 R608 R614	E606-H610 WeakPolarHBondContact O-CB 3.46Å; E606-H610 PolarHBondContact O-CD2 3.48Å; E606-H610 VanDerWaalsContact O-CD2 3.24Å; E606-H610 PolarHBondContact O-N 3.45Å; R608-H610 VanDerWaalsContact C-N 3.33Å; R608-H610 PolarHBondContact O-N 3.14Å; H610-R614 PolarHBondContact O-N 3.19Å
611	M	74.2	Confident	79.9	Confident	129 Å²	129	118.6 Å²	118.6	64%	0.635	51%	0.513	S	S	*	.	H	α-helix	trans	-80.1	-36.8	175.1	-170.6	176.2	-63.8	0	0	111.9	Q607 R608 W609 R614 R615	Q607-M611 WeakPolarHBondContact O-CB 3.34Å; Q607-M611 PolarHBondContact O-N 3.07Å; Q607-M611 VanDerWaalsContact O-N 3.1Å; R608-M611 CarbonylContact O-C 3.52Å; R608-M611 WeakPolarHBondContact O-CA 3.48Å; R608-M611 WeakPolarHBondContact O-CB 3.45Å; R608-M611 PolarHBondContact O-N 3.03Å; W609-M611 VanDerWaalsContact C-N 3.32Å; W609-M611 PolarHBondContact O-N 2.94Å; M611-R614 PolarHBondContact O-N 3.33Å; M611-R615 PolarHBondContact O-N 3.24Å
612	E	87.3	Confident	79	Confident	125 Å²	125	118 Å²	118	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-67.5	-45.7	175.7	-163.3	113	-107.6	0	0	111.1	R608 W609 R614 R615 Y616	R608-E612 WeakPolarHBondContact O-CB 3.38Å; R608-E612 PolarHBondContact O-N 2.98Å; W609-E612 PolarHBondContact O-N 2.83Å; E612-R614 VanDerWaalsContact C-N 3.32Å; E612-R614 PolarHBondContact O-N 3.07Å; E612-R615 CarbonylContact O-C 3.51Å; E612-R615 WeakPolarHBondContact O-CB 3.42Å; E612-R615 PolarHBondContact O-N 2.89Å; E612-Y616 WeakPolarHBondContact O-CB 3.44Å; E612-Y616 PolarHBondContact O-N 3.01Å
613	M	68.9	Low	78.4	Confident	66 Å²	66	119 Å²	119	33%	0.325	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-40.4	172.7	-76.7	-58.9	-51.8	0	0	111.8	W609 Y616 E617	W609-M613 HydrophobicContact CD2-CG 3.79Å; W609-M613 VanDerWaalsContact CE2-CG 3.48Å; W609-M613 HydrophobicContact CE3-CG 4.09Å; W609-M613 HydrophobicContact CG-CG 4.41Å; W609-M613 HydrophobicContact CH2-CG 3.86Å; W609-M613 HydrophobicContact CZ2-CG 3.54Å; W609-M613 HydrophobicContact CZ2-SD 3.86Å; W609-M613 HydrophobicContact CZ3-CG 4.12Å; W609-M613 VanDerWaalsContact O-CB 3.28Å; W609-M613 WeakPolarHBondContact O-CB 3.21Å; W609-M613 VanDerWaalsContact O-CG 3.27Å; W609-M613 WeakPolarHBondContact O-CG 3.46Å; W609-M613 PolarHBondContact O-N 3.25Å; M613-Y616 PolarHBondContact O-N 2.93Å; M613-E617 WeakPolarHBondContact O-CG 3.47Å; M613-E617 PolarHBondContact O-N 2.94Å
614	R	77.3	Confident	77.8	Confident	152 Å²	152	118.2 Å²	118.2	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-43.6	173.8	-176.6	178.5	-59	149.3	8.7	111.7	H610 M611 E612 Y616 E617 E618	H610-R614 PolarHBondContact O-N 3.19Å; M611-R614 PolarHBondContact O-N 3.33Å; E612-R614 VanDerWaalsContact C-N 3.32Å; E612-R614 PolarHBondContact O-N 3.07Å; R614-Y616 VanDerWaalsContact C-N 3.31Å; R614-Y616 PolarHBondContact O-N 3.21Å; R614-E617 PolarHBondContact O-N 2.95Å; R614-E618 WeakPolarHBondContact CD-OE1 3.16Å; R614-E618 HydrophobicContact CG-CG 4.29Å; R614-E618 VanDerWaalsContact CG-OE1 3.28Å; R614-E618 WeakPolarHBondContact CG-OE1 3.26Å; R614-E618 WeakPolarHBondContact O-CB 3.48Å; R614-E618 VanDerWaalsContact O-CG 3.32Å; R614-E618 WeakPolarHBondContact O-CG 3.47Å; R614-E618 PolarHBondContact O-N 3.37Å
615	R	77.2	Confident	76.8	Confident	157 Å²	157	118.1 Å²	118.1	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-59.8	-41.6	173.1	-85.7	-179.1	163.7	-177.1	-7.9	111.9	M611 E612 E618 D619	M611-R615 PolarHBondContact O-N 3.24Å; E612-R615 CarbonylContact O-C 3.51Å; E612-R615 WeakPolarHBondContact O-CB 3.42Å; E612-R615 PolarHBondContact O-N 2.89Å; R615-E618 CarbonylContact O-C 3.53Å; R615-E618 PolarHBondContact O-N 3.21Å; R615-D619 VanDerWaalsContact O-CB 3.31Å; R615-D619 WeakPolarHBondContact O-CB 3.25Å; R615-D619 VanDerWaalsContact O-CG 3.28Å; R615-D619 PolarHBondContact O-N 2.86Å
616	Y	75.9	Confident	76.1	Confident	134 Å²	134	120.9 Å²	120.9	53%	0.525	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-37.7	178.1	-168.3	-92.9	0	0	0	112.2	E612 M613 R614 M620	E612-Y616 WeakPolarHBondContact O-CB 3.44Å; E612-Y616 PolarHBondContact O-N 3.01Å; M613-Y616 PolarHBondContact O-N 2.93Å; R614-Y616 VanDerWaalsContact C-N 3.31Å; R614-Y616 PolarHBondContact O-N 3.21Å; Y616-M620 HydrophobicContact CD1-CG 4.09Å; Y616-M620 HydrophobicContact CE1-CG 3.81Å; Y616-M620 HydrophobicContact CE1-SD 4.47Å; Y616-M620 WeakPolarHBondContact O-CB 3.21Å; Y616-M620 WeakPolarHBondContact O-CG 3.43Å; Y616-M620 PolarHBondContact O-N 3.13Å
617	E	77.9	Confident	75.3	Confident	127 Å²	127	122.1 Å²	122.1	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-65.8	-42.2	170.5	-73.8	178.6	160.4	0	0	112.1	M613 R614 Y621	M613-E617 WeakPolarHBondContact O-CG 3.47Å; M613-E617 PolarHBondContact O-N 2.94Å; R614-E617 PolarHBondContact O-N 2.95Å; E617-Y621 VanDerWaalsContact O-CB 3.27Å; E617-Y621 WeakPolarHBondContact O-CB 3.33Å; E617-Y621 PolarHBondContact O-N 3.07Å
618	E	71.8	Confident	74.3	Confident	97 Å²	97	120.7 Å²	120.7	45%	0.453	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-43.6	175.9	-74.7	169.8	-173.8	0	0	111.5	R614 R615 Y621 W622	R614-E618 WeakPolarHBondContact CD-OE1 3.16Å; R614-E618 HydrophobicContact CG-CG 4.29Å; R614-E618 VanDerWaalsContact CG-OE1 3.28Å; R614-E618 WeakPolarHBondContact CG-OE1 3.26Å; R614-E618 WeakPolarHBondContact O-CB 3.48Å; R614-E618 VanDerWaalsContact O-CG 3.32Å; R614-E618 WeakPolarHBondContact O-CG 3.47Å; R614-E618 PolarHBondContact O-N 3.37Å; R615-E618 CarbonylContact O-C 3.53Å; R615-E618 PolarHBondContact O-N 3.21Å; E618-Y621 WeakPolarHBondContact O-CB 3.35Å; E618-Y621 PolarHBondContact O-N 3.21Å; E618-W622 WeakPolarHBondContact O-CB 3.43Å; E618-W622 PolarHBondContact O-N 3.3Å
619	D	75.8	Confident	72.8	Confident	86 Å²	86	121 Å²	121	46%	0.46	53%	0.525	S	S	.	.	H	α-helix	trans	-68.8	-33.8	176.8	-75.5	-1.7	0	0	0	112.7	R615 R623	R615-D619 VanDerWaalsContact O-CB 3.31Å; R615-D619 WeakPolarHBondContact O-CB 3.25Å; R615-D619 VanDerWaalsContact O-CG 3.28Å; R615-D619 PolarHBondContact O-N 2.86Å; D619-R623 WeakPolarHBondContact O-CB 3.3Å; D619-R623 PolarHBondContact O-N 3.07Å; D619-R623 PolarHBondContact O-NE 2.95Å
620	M	70.1	Confident	71.2	Confident	76 Å²	76	120.8 Å²	120.8	37%	0.374	53%	0.532	S	S	.	.	H	α-helix	trans	-73.5	-32.9	172.4	-77.7	-76.5	-72.9	0	0	111.7	Y616 R624	Y616-M620 HydrophobicContact CD1-CG 4.09Å; Y616-M620 HydrophobicContact CE1-CG 3.81Å; Y616-M620 HydrophobicContact CE1-SD 4.47Å; Y616-M620 WeakPolarHBondContact O-CB 3.21Å; Y616-M620 WeakPolarHBondContact O-CG 3.43Å; Y616-M620 PolarHBondContact O-N 3.13Å; M620-R624 WeakPolarHBondContact O-CB 3.39Å; M620-R624 PolarHBondContact O-N 3.13Å; M620-R624 VanDerWaalsContact O-N 3.12Å
621	Y	77.7	Confident	69.4	Low	123 Å²	123	122 Å²	122	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-68.2	-47.3	171.1	172.8	-105.4	0	0	0	111.1	E617 E618 R624 M625	E617-Y621 VanDerWaalsContact O-CB 3.27Å; E617-Y621 WeakPolarHBondContact O-CB 3.33Å; E617-Y621 PolarHBondContact O-N 3.07Å; E618-Y621 WeakPolarHBondContact O-CB 3.35Å; E618-Y621 PolarHBondContact O-N 3.21Å; Y621-R624 PolarHBondContact O-N 2.98Å; Y621-M625 HydrophobicContact CD1-CG 4.34Å; Y621-M625 HydrophobicContact CD2-CG 4.24Å; Y621-M625 HydrophobicContact CE1-CG 3.91Å; Y621-M625 HydrophobicContact CE2-CG 3.77Å; Y621-M625 HydrophobicContact CE2-SD 3.98Å; Y621-M625 WeakPolarHBondContact O-CB 3.06Å; Y621-M625 VanDerWaalsContact O-CG 3.32Å; Y621-M625 WeakPolarHBondContact O-CG 3.39Å; Y621-M625 PolarHBondContact O-N 2.97Å
622	W	71.1	Confident	68.1	Low	158 Å²	158	122 Å²	122	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-43.8	177.8	-77.8	116.8	0	0	0	112.7	E618 R624 M625 E626	E618-W622 WeakPolarHBondContact O-CB 3.43Å; E618-W622 PolarHBondContact O-N 3.3Å; W622-R624 VanDerWaalsContact C-N 3.33Å; W622-R624 PolarHBondContact O-N 3.3Å; W622-M625 HydrophobicContact CE3-CB 4.33Å; W622-M625 CarbonylContact O-C 3.54Å; W622-M625 WeakPolarHBondContact O-CB 3.34Å; W622-M625 PolarHBondContact O-N 2.84Å; W622-M625 VanDerWaalsContact O-N 3.11Å; W622-E626 PolarHBondContact O-N 3.21Å
623	R	73.8	Confident	66.7	Low	131 Å²	131	117.8 Å²	117.8	49%	0.494	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-38.3	172.6	-89.6	177.3	-77.5	174.4	-10.4	113	D619 E626 E627	D619-R623 WeakPolarHBondContact O-CB 3.3Å; D619-R623 PolarHBondContact O-N 3.07Å; D619-R623 PolarHBondContact O-NE 2.95Å; R623-E626 PolarHBondContact O-N 3.4Å; R623-E627 VanDerWaalsContact O-CB 3.25Å; R623-E627 WeakPolarHBondContact O-CB 3.43Å; R623-E627 PolarHBondContact O-N 3.49Å
624	R	69.4	Low	65.8	Low	146 Å²	146	122.1 Å²	122.1	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-65.9	-38.6	172.7	-178.2	174.6	-64.3	138.3	7.7	112	M620 Y621 W622 E627 E628	M620-R624 WeakPolarHBondContact O-CB 3.39Å; M620-R624 PolarHBondContact O-N 3.13Å; M620-R624 VanDerWaalsContact O-N 3.12Å; Y621-R624 PolarHBondContact O-N 2.98Å; W622-R624 VanDerWaalsContact C-N 3.33Å; W622-R624 PolarHBondContact O-N 3.3Å; R624-E627 PolarHBondContact O-N 3.05Å; R624-E628 WeakPolarHBondContact O-CB 3.39Å; R624-E628 PolarHBondContact O-N 3.21Å
625	M	64.8	Low	64.2	Low	63 Å²	63	119.2 Å²	119.2	31%	0.31	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-37.4	176	-74.6	-64.6	-54.5	0	0	112	Y621 W622 Q629	Y621-M625 HydrophobicContact CD1-CG 4.34Å; Y621-M625 HydrophobicContact CD2-CG 4.24Å; Y621-M625 HydrophobicContact CE1-CG 3.91Å; Y621-M625 HydrophobicContact CE2-CG 3.77Å; Y621-M625 HydrophobicContact CE2-SD 3.98Å; Y621-M625 WeakPolarHBondContact O-CB 3.06Å; Y621-M625 VanDerWaalsContact O-CG 3.32Å; Y621-M625 WeakPolarHBondContact O-CG 3.39Å; Y621-M625 PolarHBondContact O-N 2.97Å; W622-M625 HydrophobicContact CE3-CB 4.33Å; W622-M625 CarbonylContact O-C 3.54Å; W622-M625 WeakPolarHBondContact O-CB 3.34Å; W622-M625 PolarHBondContact O-N 2.84Å; W622-M625 VanDerWaalsContact O-N 3.11Å; M625-Q629 WeakPolarHBondContact O-CB 3.39Å; M625-Q629 PolarHBondContact O-N 3.06Å
626	E	70.4	Confident	62.8	Low	121 Å²	121	121 Å²	121	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-68.5	-43.5	171.8	-77.4	-176.3	138	0	0	111.7	W622 R623 Q629 M630	W622-E626 PolarHBondContact O-N 3.21Å; R623-E626 PolarHBondContact O-N 3.4Å; E626-Q629 PolarHBondContact O-N 3.28Å; E626-Q629 VanDerWaalsContact O-N 3.13Å; E626-M630 WeakPolarHBondContact O-CB 3.25Å; E626-M630 WeakPolarHBondContact O-CG 3.4Å; E626-M630 PolarHBondContact O-N 3.04Å
627	E	60.5	Low	61.6	Low	145 Å²	145	125.6 Å²	125.6	68%	0.678	55%	0.551	S	S	*	*	H	α-helix	trans	-62.2	-43.7	176.7	-171.8	173.3	-138.7	0	0	111.4	R623 R624 Y631	R623-E627 VanDerWaalsContact O-CB 3.25Å; R623-E627 WeakPolarHBondContact O-CB 3.43Å; R623-E627 PolarHBondContact O-N 3.49Å; R624-E627 PolarHBondContact O-N 3.05Å; E627-Y631 VanDerWaalsContact O-CB 3.28Å; E627-Y631 WeakPolarHBondContact O-CB 3.44Å; E627-Y631 PolarHBondContact O-N 2.95Å
628	E	58.6	Low	60.3	Low	89 Å²	89	130.2 Å²	130.2	42%	0.416	56%	0.563	S	S	.	*	H	α-helix	trans	-63.9	-41.5	168.9	-87.2	-158.6	78.8	0	0	112.3	R624 M630 Y631 W632	R624-E628 WeakPolarHBondContact O-CB 3.39Å; R624-E628 PolarHBondContact O-N 3.21Å; E628-M630 PolarHBondContact O-N 3.44Å; E628-Y631 PolarHBondContact O-N 3.1Å; E628-W632 WeakPolarHBondContact O-CB 3.38Å; E628-W632 PolarHBondContact O-N 2.67Å; E628-W632 PolarHBondContact OE1-NE1 3.46Å
629	Q	55.3	Low	58.6	Low	144 Å²	144	132.3 Å²	132.3	67%	0.673	58%	0.575	S	S	*	*	H	α-helix	trans	-68.9	-35.2	-177.6	-172.5	170.7	113.4	0	0	112.4	M625 E626 G633	M625-Q629 WeakPolarHBondContact O-CB 3.39Å; M625-Q629 PolarHBondContact O-N 3.06Å; E626-Q629 PolarHBondContact O-N 3.28Å; E626-Q629 VanDerWaalsContact O-N 3.13Å; Q629-G633 WeakPolarHBondContact O-CA 3.13Å; Q629-G633 PolarHBondContact O-N 3.46Å
630	M	51.4	Low	57	Low	146 Å²	146	133.4 Å²	133.4	72%	0.719	59%	0.586	S	S	*	*	H	α-helix	trans	-62.1	-51.9	168.5	-69.7	-80	-172.3	0	0	110.3	E626 E628 G633 E634	E626-M630 WeakPolarHBondContact O-CB 3.25Å; E626-M630 WeakPolarHBondContact O-CG 3.4Å; E626-M630 PolarHBondContact O-N 3.04Å; E628-M630 PolarHBondContact O-N 3.44Å; M630-G633 PolarHBondContact O-N 3.37Å; M630-E634 PolarHBondContact O-N 2.74Å
631	Y	48	Very low	56.3	Low	147 Å²	147	135.2 Å²	135.2	58%	0.576	60%	0.604	S	S	*	*	H	α-helix	trans	-58.3	-50.7	180	-178.2	-106.2	0	0	0	112.7	E627 E628 G633 E634 Q635	E627-Y631 VanDerWaalsContact O-CB 3.28Å; E627-Y631 WeakPolarHBondContact O-CB 3.44Å; E627-Y631 PolarHBondContact O-N 2.95Å; E628-Y631 PolarHBondContact O-N 3.1Å; Y631-G633 VanDerWaalsContact C-N 3.35Å; Y631-G633 PolarHBondContact O-N 2.86Å; Y631-E634 PolarHBondContact O-N 3.39Å; Y631-Q635 WeakPolarHBondContact O-CG 3.38Å; Y631-Q635 PolarHBondContact O-N 3.02Å
632	W	46.8	Very low	54.7	Low	129 Å²	129	134.8 Å²	134.8	49%	0.489	62%	0.616	S	S	.	*	H	α-helix	trans	-67.9	-32.1	175.7	-73.2	116.3	0	0	0	112.8	E628 R636	E628-W632 WeakPolarHBondContact O-CB 3.38Å; E628-W632 PolarHBondContact O-N 2.67Å; E628-W632 PolarHBondContact OE1-NE1 3.46Å; W632-R636 VanDerWaalsContact O-CG 3.3Å; W632-R636 WeakPolarHBondContact O-CG 3.49Å; W632-R636 PolarHBondContact O-N 2.85Å; W632-R636 VanDerWaalsContact O-N 3.1Å
633	G	57.4	Low	53.2	Low	37 Å²	37	132.7 Å²	132.7	38%	0.381	62%	0.623	S	S	.	*	H	α-helix	trans	-67	-42.6	176.3	0	0	0	0	0	112.6	Q629 M630 Y631	Q629-G633 WeakPolarHBondContact O-CA 3.13Å; Q629-G633 PolarHBondContact O-N 3.46Å; M630-G633 PolarHBondContact O-N 3.37Å; Y631-G633 VanDerWaalsContact C-N 3.35Å; Y631-G633 PolarHBondContact O-N 2.86Å
634	E	50.2	Low	52	Low	157 Å²	157	132.7 Å²	132.7	73%	0.734	64%	0.64	S	S	*	*	H	α-helix	trans	-71.9	-40.5	176.7	-166.5	165.4	-138.2	0	0	111.7	M630 Y631 R636 R637	M630-E634 PolarHBondContact O-N 2.74Å; Y631-E634 PolarHBondContact O-N 3.39Å; E634-R636 VanDerWaalsContact C-N 3.35Å; E634-R636 PolarHBondContact O-N 2.7Å; E634-R637 PolarHBondContact O-N 3.4Å
635	Q	44.6	Very low	50.8	Low	91 Å²	91	131.3 Å²	131.3	43%	0.425	65%	0.65	S	S	.	*	H	α-helix	trans	-60	-39.1	173.5	-78.1	-165.6	-86.8	0	0	113.3	Y631 R637 R638	Y631-Q635 WeakPolarHBondContact O-CG 3.38Å; Y631-Q635 PolarHBondContact O-N 3.02Å; Q635-R637 PolarHBondContact O-N 3.27Å; Q635-R637 VanDerWaalsContact O-N 3.15Å; Q635-R638 PolarHBondContact O-N 3Å; Q635-R638 VanDerWaalsContact O-N 3.15Å
636	R	46.7	Very low	50.1	Low	193 Å²	193	133.1 Å²	133.1	73%	0.728	67%	0.666	S	S	*	*	H	α-helix	trans	-61.9	-22.7	-177.6	-83.1	177.1	-170.7	-93.4	1.2	113.9	W632 E634 R638	W632-R636 VanDerWaalsContact O-CG 3.3Å; W632-R636 WeakPolarHBondContact O-CG 3.49Å; W632-R636 PolarHBondContact O-N 2.85Å; W632-R636 VanDerWaalsContact O-N 3.1Å; E634-R636 VanDerWaalsContact C-N 3.35Å; E634-R636 PolarHBondContact O-N 2.7Å; R636-R638 VanDerWaalsContact C-N 3.3Å; R636-R638 PolarHBondContact O-N 3.1Å
637	R	51.7	Low	48.7	Very low	231 Å²	231	135.5 Å²	135.5	87%	0.872	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-0	177.9	-66.2	-166.9	-179.2	-150.4	3.3	114.6	E634 Q635	E634-R637 PolarHBondContact O-N 3.4Å; Q635-R637 PolarHBondContact O-N 3.27Å; Q635-R637 VanDerWaalsContact O-N 3.15Å
638	R	49.2	Very low	47.6	Very low	224 Å²	224	136 Å²	136	85%	0.845	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	24.1	-174.3	-65.8	-167	-179.7	-159.9	4.1	116.2	Q635 R636	Q635-R638 PolarHBondContact O-N 3Å; Q635-R638 VanDerWaalsContact O-N 3.15Å; R636-R638 VanDerWaalsContact C-N 3.3Å; R636-R638 PolarHBondContact O-N 3.1Å
639	M	37.3	Very low	46.6	Very low	142 Å²	142	137.3 Å²	137.3	70%	0.7	71%	0.706	S	S	*	*			trans	-53.9	137.9	177	-84.8	-70.8	-167.4	0	0	112.9
640	P	41.6	Very low	45.8	Very low	108 Å²	108	142 Å²	142	70%	0.701	72%	0.717	S	S	*	*				-128	163.7	89.3	38.5	-32.4	0	0	0	114.4	P642	P640-P642 WeakPolarHBondContact O-CD 3.35Å
641	P	56.3	Low	45.1	Very low	114 Å²	114	140.9 Å²	140.9	74%	0.74	72%	0.721	S	S	*	*			trans	-90.7	130.4	-166.5	33.7	-35	0	0	0	115.8
642	P	43	Very low	44.5	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	73%	0.73	S	S	*	*			trans	-107.5	166.6	163.9	3.8	19.5	0	0	0	113.1	P640	P640-P642 WeakPolarHBondContact O-CD 3.35Å
643	P	41.2	Very low	43.9	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	75%	0.745	S	S	*	*			trans	-80.7	166.7	-173.9	33.5	-37.5	0	0	0	114.5	P645	P643-P645 VanDerWaalsContact O-CD 3.29Å; P643-P645 WeakPolarHBondContact O-CD 3.3Å
644	P	48.6	Very low	42.9	Very low	131 Å²	131	142.5 Å²	142.5	85%	0.851	76%	0.761	S	S	*	*			trans	-91.5	125.2	-175	34	-34.1	0	0	0	115.6
645	P	43.7	Very low	42.4	Very low	117 Å²	117	141.1 Å²	141.1	76%	0.76	76%	0.763	S	S	*	*			trans	-115.5	172	158.1	39.1	-29.8	0	0	0	112.3	P643	P643-P645 VanDerWaalsContact O-CD 3.29Å; P643-P645 WeakPolarHBondContact O-CD 3.3Å
646	P	49.7	Very low	42	Very low	102 Å²	102	142 Å²	142	66%	0.662	78%	0.776	S	S	*	*			trans	-104.5	161.7	-138.7	38.3	-38.4	0	0	0	117.6
647	L	41.1	Very low	42	Very low	171 Å²	171	138.8 Å²	138.8	90%	0.895	78%	0.78	S	S	*	*			trans	-117.4	114	158	-66.5	170.6	0	0	0	107.7
648	M	38.3	Very low	41.7	Very low	154 Å²	154	135.4 Å²	135.4	76%	0.759	78%	0.779	S	S	*	*				61.8	84.6	57.3	-62.8	-67	111.8	0	0	113.1	R650	M648-R650 PolarHBondContact O-N 3.35Å
649	S	36.5	Very low	41.4	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	78%	0.779	S	S	*	*			trans	-59.9	128	171.7	-52	0	0	0	0	111.6	P651	S649-P651 VanDerWaalsContact O-CD 3.25Å; S649-P651 WeakPolarHBondContact O-CD 3.4Å
650	R	39.3	Very low	41.5	Very low	243 Å²	243	133.2 Å²	133.2	92%	0.917	79%	0.785	S	S	*	*			trans	-74.9	114.3	176.2	-170.8	-178	-173	-165.5	3.5	110.4	M648	M648-R650 PolarHBondContact O-N 3.35Å
651	P	35.5	Very low	41.2	Very low	122 Å²	122	133.8 Å²	133.8	79%	0.792	79%	0.791	S	S	*	*			trans	-79.4	146.2	-177.3	-13.4	30.8	0	0	0	112.9	S649	S649-P651 VanDerWaalsContact O-CD 3.25Å; S649-P651 WeakPolarHBondContact O-CD 3.4Å
652	G	35.8	Very low	40.5	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	80%	0.795	S	S	*	*			trans	93	80.2	152.9	0	0	0	0	0	118.3
653	M	33.6	Very low	40.7	Very low	163 Å²	163	139.2 Å²	139.2	80%	0.803	80%	0.796	S	S	*	*			trans	-156.4	125.6	138.8	-103.8	-53	-63.7	0	0	109.6
654	P	36.8	Very low	41.2	Very low	109 Å²	109	144.7 Å²	144.7	71%	0.708	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-79.9	122.3	178.8	30.4	-33.2	0	0	0	111.8
655	V	39	Very low	41.8	Very low	128 Å²	128	144.2 Å²	144.2	78%	0.776	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-87.1	133	171.1	-178.8	0	0	0	0	109.5
656	P	37.4	Very low	43.2	Very low	109 Å²	109	143.5 Å²	143.5	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-62.9	128.9	178.7	-24.6	35	0	0	0	113.2	L658	P656-L658 VanDerWaalsContact C-N 3.28Å; P656-L658 PolarHBondContact O-N 3.21Å
657	P	46.4	Very low	44.9	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	77%	0.772	S	S	*	*	S	Bend	trans	-85.4	54.2	-171.2	35.9	-38.4	0	0	0	113.2
658	L	46	Very low	47.2	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	74%	0.743	S	S	*	*			trans	-137.1	30.6	-178.9	-78.7	-178.1	0	0	0	115.3	P656	P656-L658 VanDerWaalsContact C-N 3.28Å; P656-L658 PolarHBondContact O-N 3.21Å
659	L	42.2	Very low	49.7	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	71%	0.71	S	S	*	*	S	Bend	trans	-123.5	123	152.6	-71	175.8	0	0	0	108.4	C661	L659-C661 PolarHBondContact O-N 2.89Å
660	N	38.7	Very low	52.4	Low	156 Å²	156	122.3 Å²	122.3	83%	0.834	67%	0.673	S	S	*	*			trans	-53.5	141.2	165	-75.4	-13.1	0	0	0	108.3	V662	N660-V662 PolarHBondContact O-N 3.26Å
661	C	36.8	Very low	55	Low	121 Å²	121	114.2 Å²	114.2	82%	0.818	64%	0.643	S	S	*	*			trans	-46.6	119	172.2	-57.1	0	0	0	0	109	L659 R663	L659-C661 PolarHBondContact O-N 2.89Å; C661-R663 PolarHBondContact O-N 3.37Å
662	V	40.9	Very low	57.8	Low	135 Å²	135	108.9 Å²	108.9	82%	0.818	61%	0.607	S	S	*	*			trans	-65.5	92.1	171.9	178.8	0	0	0	0	105.7	N660 R664	N660-V662 PolarHBondContact O-N 3.26Å; V662-R664 PolarHBondContact O-N 2.89Å
663	R	47.8	Very low	60.7	Low	207 Å²	207	105.3 Å²	105.3	78%	0.781	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-53.1	119	174.4	-68.5	-171.1	-176.3	-173.9	2.1	106	C661	C661-R663 PolarHBondContact O-N 3.37Å
664	R	51.8	Low	63.6	Low	228 Å²	228	101.1 Å²	101.1	86%	0.86	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-48.9	129.1	162.5	-91.6	-176.4	168.9	170.6	-3.4	106	V662 D666	V662-R664 PolarHBondContact O-N 2.89Å; R664-D666 PolarHBondContact O-N 3.45Å; R664-D666 VanDerWaalsContact O-N 3.08Å
665	P	60.4	Low	66.4	Low	122 Å²	122	97 Å²	97	79%	0.792	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-52.7	122	177.9	-27.2	35	0	0	0	109	S667	P665-S667 PolarHBondContact O-N 2.85Å
666	D	72.3	Confident	69.1	Low	101 Å²	101	91.6 Å²	91.6	54%	0.54	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-51.9	128.7	-173.1	-54.9	-66.7	0	0	0	109.3	R664 D670 R671	R664-D666 PolarHBondContact O-N 3.45Å; R664-D666 VanDerWaalsContact O-N 3.08Å; D666-D670 HydrophobicContact CB-CB 4.16Å; D666-R671 HydrophobicContact CB-CG 4.12Å
667	S	86.7	Confident	71.9	Confident	44 Å²	44	88.2 Å²	88.2	31%	0.308	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-63.6	167.4	-172.7	72.9	0	0	0	0	111.3	P665 D669 D670 R671	P665-S667 PolarHBondContact O-N 2.85Å; S667-D669 PolarHBondContact O-N 3.14Å; S667-D669 PolarHBondContact OG-N 3.45Å; S667-D670 WeakPolarHBondContact CB-OD2 3.39Å; S667-D670 PolarHBondContact N-OD2 3.47Å; S667-D670 PolarHBondContact O-N 3.21Å; S667-D670 PolarHBondContact OG-N 3.42Å; S667-D670 PolarHBondContact OG-OD2 2.72Å; S667-R671 WeakPolarHBondContact O-CG 3.47Å; S667-R671 PolarHBondContact O-N 3.15Å; S667-R671 VanDerWaalsContact O-N 3.1Å
668	A	88.3	Confident	74.2	Confident	33 Å²	33	85.6 Å²	85.6	27%	0.273	45%	0.45	S	S	.	.	H	α-helix	trans	-55.6	-36.2	172.7	0	0	0	0	0	111.2	H672	A668-H672 PolarHBondContact O-N 2.87Å; A668-H672 PolarHBondContact O-ND1 3Å
669	D	91.1	Very high	76.6	Confident	12 Å²	12	81.7 Å²	81.7	6%	0.064	43%	0.433	C	S	.	.	H	α-helix	trans	-77.6	-43.3	-176.8	-51.9	-20.3	0	0	0	110.8	S667 R671 H672 I673 R927 I984	S667-D669 PolarHBondContact O-N 3.14Å; S667-D669 PolarHBondContact OG-N 3.45Å; D669-R671 VanDerWaalsContact C-N 3.32Å; D669-R671 PolarHBondContact O-N 2.83Å; D669-H672 PolarHBondContact O-N 3.27Å; D669-I673 WeakPolarHBondContact O-CG1 3.38Å; D669-I673 PolarHBondContact O-N 2.85Å; D669-R927 IonicContact OD2-CZ 3.16Å; D669-R927 IonicContact OD2-NH2 3.27Å; D669-R927 PolarHBondContact OD2-NH2 3.15Å; D669-I984 HydrophobicContact CB-CD1 4.12Å
670	D	94.1	Very high	79.1	Confident	11 Å²	11	74.7 Å²	74.7	6%	0.059	40%	0.396	C	S	.	.	H	α-helix	trans	-54.8	-46	173.9	-64.4	-53.7	0	0	0	111.6	D666 S667 H672 I673 M674 S921 P922 G923	D666-D670 HydrophobicContact CB-CB 4.16Å; S667-D670 WeakPolarHBondContact CB-OD2 3.39Å; S667-D670 PolarHBondContact N-OD2 3.47Å; S667-D670 PolarHBondContact O-N 3.21Å; S667-D670 PolarHBondContact OG-N 3.42Å; S667-D670 PolarHBondContact OG-OD2 2.72Å; D670-H672 PolarHBondContact O-N 3.09Å; D670-I673 PolarHBondContact O-N 3.44Å; D670-M674 WeakPolarHBondContact O-CB 3.46Å; D670-M674 VanDerWaalsContact O-CG 3.32Å; D670-M674 WeakPolarHBondContact O-CG 3.48Å; D670-M674 PolarHBondContact O-N 2.67Å; D670-S921 WeakPolarHBondContact OD1-CB 3.44Å; D670-S921 PolarHBondContact OD1-OG 3.19Å; D670-S921 PolarHBondContact OD2-OG 3.47Å; D670-P922 WeakPolarHBondContact OD1-CD 3.32Å; D670-G923 WeakPolarHBondContact OD1-CA 3.37Å; D670-G923 PolarHBondContact OD1-N 2.64Å
671	R	93.7	Very high	81.8	Confident	74 Å²	74	71.5 Å²	71.5	28%	0.279	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-40.4	179.9	-69	-170.2	-52.6	129.1	13.4	112.4	D666 S667 D669 A675 L993 P994	D666-R671 HydrophobicContact CB-CG 4.12Å; S667-R671 WeakPolarHBondContact O-CG 3.47Å; S667-R671 PolarHBondContact O-N 3.15Å; S667-R671 VanDerWaalsContact O-N 3.1Å; D669-R671 VanDerWaalsContact C-N 3.32Å; D669-R671 PolarHBondContact O-N 2.83Å; R671-A675 VanDerWaalsContact O-CB 3.25Å; R671-A675 WeakPolarHBondContact O-CB 3.43Å; R671-A675 PolarHBondContact O-N 3.06Å; R671-L993 HydrophobicContact CB-CD1 4.11Å; R671-L993 WeakPolarHBondContact O-CD1 3.16Å; R671-P994 PolarHBondContact NH1-O 3.22Å; R671-P994 VanDerWaalsContact NH1-O 3.12Å
672	H	94.8	Very high	84.6	Confident	9 Å²	9	66.2 Å²	66.2	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-43.5	177	-73.7	98.2	0	0	0	111.5	A668 D669 D670 A675 K676 I984 L988 M990 L993	A668-H672 PolarHBondContact O-N 2.87Å; A668-H672 PolarHBondContact O-ND1 3Å; D669-H672 PolarHBondContact O-N 3.27Å; D670-H672 PolarHBondContact O-N 3.09Å; H672-A675 PolarHBondContact O-N 3.37Å; H672-K676 WeakPolarHBondContact O-CB 3.45Å; H672-K676 PolarHBondContact O-N 3.01Å; H672-I984 HydrophobicContact CB-CG2 3.84Å; H672-L988 HydrophobicContact CB-CD1 3.81Å; H672-M990 HydrophobicContact CB-SD 4.22Å; H672-L993 HydrophobicContact CB-CD1 4.43Å; H672-L993 PolarHBondContact NE2-N 2.89Å
673	I	95.8	Very high	87.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-42.9	178.4	-68	172.8	0	0	0	111.3	D669 D670 K676 H677 I882 V886 P922 M926 I984 L988	D669-I673 WeakPolarHBondContact O-CG1 3.38Å; D669-I673 PolarHBondContact O-N 2.85Å; D670-I673 PolarHBondContact O-N 3.44Å; I673-K676 PolarHBondContact O-N 3.34Å; I673-H677 WeakPolarHBondContact O-CB 3.46Å; I673-H677 PolarHBondContact O-N 3.44Å; I673-I882 HydrophobicContact CG2-CG2 4.15Å; I673-V886 HydrophobicContact CG2-CG2 4.31Å; I673-P922 HydrophobicContact CB-CB 4.33Å; I673-P922 VanDerWaalsContact CD1-O 3.27Å; I673-P922 WeakPolarHBondContact CD1-O 3.47Å; I673-P922 HydrophobicContact CG2-CB 3.73Å; I673-M926 HydrophobicContact CD1-CB 3.44Å; I673-M926 VanDerWaalsContact CD1-CB 3.44Å; I673-M926 HydrophobicContact CD1-CG 3.84Å; I673-I984 HydrophobicContact CD1-CD1 3.88Å; I673-I984 HydrophobicContact CG1-CD1 3.9Å; I673-L988 HydrophobicContact CG1-CD1 4.13Å
674	M	95.8	Very high	89.2	Confident	75 Å²	75	57.3 Å²	57.3	37%	0.369	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-37.3	177.3	-70.3	-55	-57.3	0	0	112.4	D670 S678 I882 P922	D670-M674 WeakPolarHBondContact O-CB 3.46Å; D670-M674 VanDerWaalsContact O-CG 3.32Å; D670-M674 WeakPolarHBondContact O-CG 3.48Å; D670-M674 PolarHBondContact O-N 2.67Å; M674-S678 PolarHBondContact O-N 3.03Å; M674-S678 PolarHBondContact O-OG 2.98Å; M674-I882 HydrophobicContact CE-CD1 4.49Å; M674-I882 HydrophobicContact SD-CD1 4.03Å; M674-I882 HydrophobicContact SD-CG2 4.17Å; M674-P922 HydrophobicContact CG-CG 4.42Å; M674-P922 HydrophobicContact SD-CB 4.45Å; M674-P922 HydrophobicContact SD-CG 3.9Å
675	A	95.1	Very high	91	Very high	24 Å²	24	53.4 Å²	53.4	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-52	171.9	0	0	0	0	0	111	R671 H672 H677 S678 T679 M990 L993	R671-A675 VanDerWaalsContact O-CB 3.25Å; R671-A675 WeakPolarHBondContact O-CB 3.43Å; R671-A675 PolarHBondContact O-N 3.06Å; H672-A675 PolarHBondContact O-N 3.37Å; A675-H677 VanDerWaalsContact C-N 3.34Å; A675-H677 PolarHBondContact O-N 3.41Å; A675-S678 PolarHBondContact O-N 2.97Å; A675-S678 PolarHBondContact O-OG 2.79Å; A675-T679 PolarHBondContact O-N 3.32Å; A675-M990 HydrophobicContact CB-CE 4.04Å; A675-L993 HydrophobicContact CB-CD1 3.81Å; A675-L993 HydrophobicContact CB-CD2 4.2Å
676	K	95.5	Very high	92.5	Very high	14 Å²	14	48.4 Å²	48.4	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-55.9	-48.2	176.1	-179.3	64.4	-179.1	-176	0	111.5	H672 I673 S678 T679 I680 V886 D889 L988 M990	H672-K676 WeakPolarHBondContact O-CB 3.45Å; H672-K676 PolarHBondContact O-N 3.01Å; I673-K676 PolarHBondContact O-N 3.34Å; K676-S678 VanDerWaalsContact C-N 3.3Å; K676-S678 PolarHBondContact O-N 3.13Å; K676-T679 WeakPolarHBondContact CA-OG1 3.32Å; K676-T679 PolarHBondContact O-N 3.36Å; K676-T679 PolarHBondContact O-OG1 2.73Å; K676-I680 HydrophobicContact CD-CG2 4.11Å; K676-I680 WeakPolarHBondContact O-CG1 3.35Å; K676-I680 PolarHBondContact O-N 3.3Å; K676-V886 HydrophobicContact CG-CG1 4.35Å; K676-D889 WeakPolarHBondContact CE-OD1 3.48Å; K676-D889 WeakPolarHBondContact CE-OD2 3.46Å; K676-D889 IonicContact NZ-OD1 3.28Å; K676-D889 PolarHBondContact NZ-OD1 3.17Å; K676-D889 IonicContact NZ-OD2 3.93Å; K676-D889 PolarHBondContact NZ-OD2 3.13Å; K676-L988 HydrophobicContact CB-CB 4.37Å; K676-L988 HydrophobicContact CB-CD1 4.2Å; K676-L988 HydrophobicContact CB-CD2 4.48Å; K676-L988 HydrophobicContact CD-CB 4.32Å; K676-L988 WeakPolarHBondContact CD-O 3.3Å; K676-L988 WeakPolarHBondContact CE-O 3.05Å; K676-L988 HydrophobicContact CG-CB 4.12Å; K676-L988 HydrophobicContact CG-CD2 4.19Å; K676-L988 PolarHBondContact NZ-O 3.03Å; K676-M990 HydrophobicContact CB-SD 4.05Å
677	H	96.3	Very high	93.5	Very high	38 Å²	38	44.8 Å²	44.8	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-54.3	-41.9	175	177.9	-97.2	0	0	0	112.4	I673 A675 I680 Y681 I882 R885 V886	I673-H677 WeakPolarHBondContact O-CB 3.46Å; I673-H677 PolarHBondContact O-N 3.44Å; A675-H677 VanDerWaalsContact C-N 3.34Å; A675-H677 PolarHBondContact O-N 3.41Å; H677-I680 WeakPolarHBondContact O-CG1 3.25Å; H677-Y681 WeakPolarHBondContact O-CB 3.42Å; H677-Y681 PolarHBondContact O-N 2.87Å; H677-I882 HydrophobicContact CB-CG2 4.21Å; H677-R885 PolarHBondContact NE2-NH1 3.4Å; H677-V886 HydrophobicContact CB-CG2 4.09Å
678	S	95.1	Very high	93.7	Very high	70 Å²	70	47.8 Å²	47.8	49%	0.49	25%	0.247	S	C	.	.	H	α-helix	trans	-68.1	-32.6	174.4	67.2	0	0	0	0	114.1	M674 A675 K676	M674-S678 PolarHBondContact O-N 3.03Å; M674-S678 PolarHBondContact O-OG 2.98Å; A675-S678 PolarHBondContact O-N 2.97Å; A675-S678 PolarHBondContact O-OG 2.79Å; K676-S678 VanDerWaalsContact C-N 3.3Å; K676-S678 PolarHBondContact O-N 3.13Å
679	T	94.8	Very high	93.9	Very high	78 Å²	78	46.6 Å²	46.6	48%	0.479	24%	0.236	S	C	.	.	H	α-helix	trans	-73	-34.9	176.6	58.5	0	0	0	0	113.1	A675 K676 R751	A675-T679 PolarHBondContact O-N 3.32Å; K676-T679 WeakPolarHBondContact CA-OG1 3.32Å; K676-T679 PolarHBondContact O-N 3.36Å; K676-T679 PolarHBondContact O-OG1 2.73Å; T679-R751 PolarHBondContact O-NE 3.24Å; T679-R751 PolarHBondContact O-NH2 2.96Å
680	I	96.1	Very high	94	Very high	16 Å²	16	46.5 Å²	46.5	8%	0.082	24%	0.236	C	C	.	.	H	α-helix	trans	-88.7	-6.9	178.9	70.1	-178.8	0	0	0	113.3	K676 H677 L750 R751 R885 V886 D889	K676-I680 HydrophobicContact CD-CG2 4.11Å; K676-I680 WeakPolarHBondContact O-CG1 3.35Å; K676-I680 PolarHBondContact O-N 3.3Å; H677-I680 WeakPolarHBondContact O-CG1 3.25Å; I680-L750 HydrophobicContact CB-CD2 4.17Å; I680-L750 HydrophobicContact CD1-CD2 3.83Å; I680-L750 HydrophobicContact CG1-CD2 3.85Å; I680-L750 CarbonylContact O-C 3.59Å; I680-L750 WeakPolarHBondContact O-CA 3.45Å; I680-R751 PolarHBondContact O-N 3.09Å; I680-R885 HydrophobicContact CD1-CB 4.43Å; I680-R885 WeakPolarHBondContact CD1-O 3.09Å; I680-V886 HydrophobicContact CD1-CB 4.45Å; I680-V886 HydrophobicContact CD1-CG2 3.89Å; I680-D889 HydrophobicContact CD1-CB 3.82Å; I680-D889 HydrophobicContact CG2-CB 4.06Å; I680-D889 WeakPolarHBondContact CG2-OD1 3.4Å
681	Y	95.4	Very high	93.9	Very high	90 Å²	90	51 Å²	51	35%	0.353	26%	0.257	S	S	.	.	S	Bend	trans	-66.6	137.4	175.4	-164.3	-110.7	0	0	0	109.8	H677 L687 R751	H677-Y681 WeakPolarHBondContact O-CB 3.42Å; H677-Y681 PolarHBondContact O-N 2.87Å; Y681-L687 HydrophobicContact CE1-CD1 3.9Å; Y681-R751 PolarHBondContact O-NE 2.94Å; Y681-R751 PolarHBondContact O-NH2 3.24Å
682	P	93.9	Very high	93.8	Very high	9 Å²	9	52 Å²	52	6%	0.058	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-54.6	147.6	175.6	-22	30.8	0	0	0	111.7	E686 L687 L749	P682-E686 WeakPolarHBondContact CA-OE2 2.86Å; P682-E686 HydrophobicContact CB-CB 4.3Å; P682-L687 HydrophobicContact CB-CD2 3.76Å; P682-L687 HydrophobicContact CB-CG 3.96Å; P682-L687 HydrophobicContact CG-CD2 3.99Å; P682-L749 WeakPolarHBondContact CD-O 3.29Å; P682-L749 HydrophobicContact CG-CB 3.83Å
683	V	93.8	Very high	93.7	Very high	52 Å²	52	51.7 Å²	51.7	32%	0.315	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-69.7	149.3	171.8	-173.4	0	0	0	0	108.7	E685 E686 L687	V683-E685 HydrophobicContact CG1-CB 4.27Å; V683-E685 HydrophobicContact CG1-CG 4.43Å; V683-E685 PolarHBondContact O-N 3.46Å; V683-E686 HydrophobicContact CB-CG 4.17Å; V683-E686 PolarHBondContact N-OE2 2.79Å; V683-E686 WeakPolarHBondContact O-CA 3.46Å; V683-E686 WeakPolarHBondContact O-CB 3.42Å; V683-E686 PolarHBondContact O-N 3.21Å; V683-L687 PolarHBondContact O-N 3.23Å
684	E	91.8	Very high	93.6	Very high	104 Å²	104	51.8 Å²	51.8	49%	0.486	26%	0.26	S	S	.	.	H	α-helix	trans	-55.4	-35.7	178.8	-178.3	59	-152.7	0	0	112.1	E686 L687 Q688	E684-E686 PolarHBondContact O-N 2.84Å; E684-L687 PolarHBondContact O-N 3.31Å; E684-Q688 WeakPolarHBondContact O-CB 3.13Å; E684-Q688 VanDerWaalsContact O-CG 3.28Å; E684-Q688 WeakPolarHBondContact O-CG 3.4Å; E684-Q688 PolarHBondContact O-N 3.17Å; E684-Q688 PolarHBondContact OE1-NE2 3.43Å
685	E	91.2	Very high	93.4	Very high	145 Å²	145	49.7 Å²	49.7	68%	0.678	25%	0.253	S	S	*	.	H	α-helix	trans	-60.1	-41.5	171.9	-65.5	165.1	-172	0	0	112.9	V683 Q688 A689	V683-E685 HydrophobicContact CG1-CB 4.27Å; V683-E685 HydrophobicContact CG1-CG 4.43Å; V683-E685 PolarHBondContact O-N 3.46Å; E685-Q688 PolarHBondContact O-N 3.09Å; E685-A689 WeakPolarHBondContact O-CB 3.25Å; E685-A689 PolarHBondContact O-N 3.01Å
686	E	91.5	Very high	93.3	Very high	17 Å²	17	49.7 Å²	49.7	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-41.4	175.8	-60.8	178.1	124.3	0	0	110.8	P682 V683 E684 Q688 A689 V690 G752 R754	P682-E686 WeakPolarHBondContact CA-OE2 2.86Å; P682-E686 HydrophobicContact CB-CB 4.3Å; V683-E686 HydrophobicContact CB-CG 4.17Å; V683-E686 PolarHBondContact N-OE2 2.79Å; V683-E686 WeakPolarHBondContact O-CA 3.46Å; V683-E686 WeakPolarHBondContact O-CB 3.42Å; V683-E686 PolarHBondContact O-N 3.21Å; E684-E686 PolarHBondContact O-N 2.84Å; E686-Q688 VanDerWaalsContact C-N 3.33Å; E686-Q688 PolarHBondContact O-N 3.35Å; E686-A689 PolarHBondContact O-N 3.24Å; E686-V690 WeakPolarHBondContact O-CB 3.44Å; E686-V690 WeakPolarHBondContact O-CG2 3.45Å; E686-V690 PolarHBondContact O-N 2.91Å; E686-G752 PolarHBondContact OE1-N 3.01Å; E686-R754 IonicContact OE1-CZ 3.52Å; E686-R754 IonicContact OE1-NH1 2.71Å; E686-R754 PolarHBondContact OE1-NH1 3.27Å; E686-R754 IonicContact OE1-NH2 3.4Å; E686-R754 PolarHBondContact OE1-NH2 2.97Å
687	L	92.3	Very high	93.2	Very high	26 Å²	26	49.1 Å²	49.1	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-40.2	175.6	-64.8	177.2	0	0	0	111.8	Y681 P682 V683 E684 Q691 L749	Y681-L687 HydrophobicContact CE1-CD1 3.9Å; P682-L687 HydrophobicContact CB-CD2 3.76Å; P682-L687 HydrophobicContact CB-CG 3.96Å; P682-L687 HydrophobicContact CG-CD2 3.99Å; V683-L687 PolarHBondContact O-N 3.23Å; E684-L687 PolarHBondContact O-N 3.31Å; L687-Q691 WeakPolarHBondContact O-CB 3.48Å; L687-Q691 PolarHBondContact O-N 3.05Å; L687-L749 HydrophobicContact CD2-CD1 4.47Å
688	Q	92.3	Very high	93.1	Very high	107 Å²	107	47.8 Å²	47.8	50%	0.5	24%	0.24	S	C	.	.	H	α-helix	trans	-70.6	-39	176.2	-71	177.6	19.6	0	0	111.8	E684 E685 E686 Q691 R692	E684-Q688 WeakPolarHBondContact O-CB 3.13Å; E684-Q688 VanDerWaalsContact O-CG 3.28Å; E684-Q688 WeakPolarHBondContact O-CG 3.4Å; E684-Q688 PolarHBondContact O-N 3.17Å; E684-Q688 PolarHBondContact OE1-NE2 3.43Å; E685-Q688 PolarHBondContact O-N 3.09Å; E686-Q688 VanDerWaalsContact C-N 3.33Å; E686-Q688 PolarHBondContact O-N 3.35Å; Q688-Q691 PolarHBondContact O-N 2.86Å; Q688-R692 WeakPolarHBondContact O-CB 3.32Å; Q688-R692 WeakPolarHBondContact O-CG 3.48Å; Q688-R692 PolarHBondContact O-N 3.37Å
689	A	91.4	Very high	93	Very high	7 Å²	7	49.8 Å²	49.8	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-48.8	172.4	0	0	0	0	0	111.6	E685 E686 Q691 R692 I693 P809 M811	E685-A689 WeakPolarHBondContact O-CB 3.25Å; E685-A689 PolarHBondContact O-N 3.01Å; E686-A689 PolarHBondContact O-N 3.24Å; A689-Q691 PolarHBondContact O-N 2.84Å; A689-R692 PolarHBondContact O-N 3.41Å; A689-I693 WeakPolarHBondContact O-CG2 3.42Å; A689-I693 PolarHBondContact O-N 2.83Å; A689-P809 HydrophobicContact CB-CG 4.12Å; A689-M811 HydrophobicContact CB-CG 3.95Å
690	V	92.9	Very high	92.9	Very high	10 Å²	10	46.1 Å²	46.1	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-57.6	-46.2	174.1	168.1	0	0	0	0	111.2	E686 R692 I693 V694 L744 L749 V756 M811	E686-V690 WeakPolarHBondContact O-CB 3.44Å; E686-V690 WeakPolarHBondContact O-CG2 3.45Å; E686-V690 PolarHBondContact O-N 2.91Å; V690-R692 PolarHBondContact O-N 2.91Å; V690-I693 WeakPolarHBondContact O-CG2 3.14Å; V690-V694 HydrophobicContact CG1-CG2 4.32Å; V690-V694 VanDerWaalsContact O-CB 3.32Å; V690-V694 WeakPolarHBondContact O-CB 3.3Å; V690-V694 VanDerWaalsContact O-CG2 3.23Å; V690-V694 WeakPolarHBondContact O-CG2 3.16Å; V690-V694 PolarHBondContact O-N 2.71Å; V690-L744 HydrophobicContact CG1-CD1 3.78Å; V690-L749 HydrophobicContact CG1-CD1 4.21Å; V690-V756 HydrophobicContact CG1-CG2 4.1Å; V690-V756 HydrophobicContact CG2-CG2 4.19Å; V690-M811 HydrophobicContact CG2-SD 3.54Å; V690-M811 VanDerWaalsContact CG2-SD 3.54Å
691	Q	93	Very high	92.7	Very high	106 Å²	106	45.3 Å²	45.3	50%	0.495	21%	0.21	S	C	.	.	H	α-helix	trans	-69.1	-32.8	-178.9	-173.5	165.1	-40	0	0	112.8	L687 Q688 A689 S695	L687-Q691 WeakPolarHBondContact O-CB 3.48Å; L687-Q691 PolarHBondContact O-N 3.05Å; Q688-Q691 PolarHBondContact O-N 2.86Å; A689-Q691 PolarHBondContact O-N 2.84Å; Q691-S695 WeakPolarHBondContact O-CB 3.47Å; Q691-S695 PolarHBondContact O-N 3.12Å; Q691-S695 VanDerWaalsContact O-N 3.08Å
692	R	91.4	Very high	92.6	Very high	95 Å²	95	44.2 Å²	44.2	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-64.3	-59.4	171.7	-75.4	-170.2	-63.2	134.1	-5.6	111.2	Q688 A689 V690 V694 S695 H696 D788 Q807	Q688-R692 WeakPolarHBondContact O-CB 3.32Å; Q688-R692 WeakPolarHBondContact O-CG 3.48Å; Q688-R692 PolarHBondContact O-N 3.37Å; A689-R692 PolarHBondContact O-N 3.41Å; V690-R692 PolarHBondContact O-N 2.91Å; R692-V694 VanDerWaalsContact C-N 3.33Å; R692-V694 PolarHBondContact O-N 3.07Å; R692-S695 PolarHBondContact O-N 2.66Å; R692-S695 VanDerWaalsContact O-N 3.09Å; R692-H696 PolarHBondContact O-CD2 3.23Å; R692-H696 VanDerWaalsContact O-CD2 3.3Å; R692-H696 PolarHBondContact O-N 3.13Å; R692-D788 IonicContact NH1-OD2 3.82Å; R692-Q807 VanDerWaalsContact CZ-OE1 3.28Å
693	I	91.7	Very high	92.5	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-39.2	-175.9	-166.8	173.9	0	0	0	112.3	A689 V690 H696 S697 Y790 I803 M811 V813	A689-I693 WeakPolarHBondContact O-CG2 3.42Å; A689-I693 PolarHBondContact O-N 2.83Å; V690-I693 WeakPolarHBondContact O-CG2 3.14Å; I693-H696 PolarHBondContact O-N 3.11Å; I693-S697 VanDerWaalsContact O-CB 3.31Å; I693-S697 WeakPolarHBondContact O-CB 3.27Å; I693-S697 PolarHBondContact O-N 3.19Å; I693-S697 PolarHBondContact O-OG 2.96Å; I693-Y790 HydrophobicContact CD1-CD1 4.47Å; I693-Y790 HydrophobicContact CD1-CE1 4.02Å; I693-Y790 HydrophobicContact CG1-CE1 3.86Å; I693-I803 HydrophobicContact CD1-CG2 4.47Å; I693-M811 HydrophobicContact CD1-CB 3.83Å; I693-M811 HydrophobicContact CG2-CB 3.96Å; I693-M811 HydrophobicContact CG2-CG 4.33Å; I693-V813 HydrophobicContact CB-CG2 4.35Å; I693-V813 HydrophobicContact CD1-CB 4.39Å; I693-V813 HydrophobicContact CD1-CG2 3.85Å; I693-V813 HydrophobicContact CG1-CG2 3.83Å; I693-V813 HydrophobicContact CG2-CG2 3.71Å
694	V	93.7	Very high	92.4	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-64.6	-44.9	174.7	171.1	0	0	0	0	110.9	V690 R692 H696 S697 E698 L744 V756 L758 V813	V690-V694 HydrophobicContact CG1-CG2 4.32Å; V690-V694 VanDerWaalsContact O-CB 3.32Å; V690-V694 WeakPolarHBondContact O-CB 3.3Å; V690-V694 VanDerWaalsContact O-CG2 3.23Å; V690-V694 WeakPolarHBondContact O-CG2 3.16Å; V690-V694 PolarHBondContact O-N 2.71Å; R692-V694 VanDerWaalsContact C-N 3.33Å; R692-V694 PolarHBondContact O-N 3.07Å; V694-H696 VanDerWaalsContact C-N 3.34Å; V694-H696 PolarHBondContact O-N 2.71Å; V694-S697 PolarHBondContact O-N 3.07Å; V694-E698 HydrophobicContact CG1-CG 4.29Å; V694-E698 WeakPolarHBondContact O-CB 3.4Å; V694-E698 VanDerWaalsContact O-CG 3.31Å; V694-E698 WeakPolarHBondContact O-CG 3.18Å; V694-E698 PolarHBondContact O-N 3.48Å; V694-L744 HydrophobicContact CG1-CD2 4.21Å; V694-L744 HydrophobicContact CG2-CD2 3.92Å; V694-V756 HydrophobicContact CG2-CG1 3.73Å; V694-L758 HydrophobicContact CG1-CD2 4.32Å; V694-V813 HydrophobicContact CG2-CG2 4.33Å
695	S	93.2	Very high	92.3	Very high	31 Å²	31	39 Å²	39	22%	0.217	18%	0.18	C	C	.	.	H	α-helix	trans	-68.9	-30.6	179.5	-166.2	0	0	0	0	113.2	Q691 R692 R699	Q691-S695 WeakPolarHBondContact O-CB 3.47Å; Q691-S695 PolarHBondContact O-N 3.12Å; Q691-S695 VanDerWaalsContact O-N 3.08Å; R692-S695 PolarHBondContact O-N 2.66Å; R692-S695 VanDerWaalsContact O-N 3.09Å; S695-R699 VanDerWaalsContact O-CG 3.22Å; S695-R699 WeakPolarHBondContact O-CG 3.46Å; S695-R699 PolarHBondContact O-N 3.06Å; S695-R699 PolarHBondContact O-NE 3.19Å; S695-R699 PolarHBondContact OG-NE 3.39Å; S695-R699 PolarHBondContact OG-NH2 3.26Å
696	H	92.4	Very high	92.3	Very high	24 Å²	24	34 Å²	34	11%	0.111	16%	0.158	C	C	.	.	H	α-helix	trans	-71	-44.9	173.2	-65	-175	0	0	0	110.2	R692 I693 V694 E698 R699 A700 L782 Y790	R692-H696 PolarHBondContact O-CD2 3.23Å; R692-H696 VanDerWaalsContact O-CD2 3.3Å; R692-H696 PolarHBondContact O-N 3.13Å; I693-H696 PolarHBondContact O-N 3.11Å; V694-H696 VanDerWaalsContact C-N 3.34Å; V694-H696 PolarHBondContact O-N 2.71Å; H696-E698 PolarHBondContact O-N 3.36Å; H696-R699 PolarHBondContact O-N 3.1Å; H696-A700 VanDerWaalsContact O-CB 3.3Å; H696-A700 WeakPolarHBondContact O-CB 3.49Å; H696-A700 PolarHBondContact O-N 2.91Å; H696-L782 HydrophobicContact CB-CD2 4.21Å; H696-Y790 HydrophobicContact CB-CE2 4.48Å; H696-Y790 AromaticContact ND1-CE2 4Å; H696-Y790 AromaticContact ND1-CZ 3.94Å; H696-Y790 PolarHBondContact ND1-OH 2.75Å
697	S	92.9	Very high	92.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-46.3	175.8	-55.6	0	0	0	0	112.5	I693 V694 R699 A700 L701 I803	I693-S697 VanDerWaalsContact O-CB 3.31Å; I693-S697 WeakPolarHBondContact O-CB 3.27Å; I693-S697 PolarHBondContact O-N 3.19Å; I693-S697 PolarHBondContact O-OG 2.96Å; V694-S697 PolarHBondContact O-N 3.07Å; S697-R699 PolarHBondContact O-N 3.35Å; S697-A700 PolarHBondContact O-N 3.38Å; S697-L701 VanDerWaalsContact O-CB 3.3Å; S697-L701 WeakPolarHBondContact O-CB 3.44Å; S697-L701 VanDerWaalsContact O-CG 3.23Å; S697-L701 WeakPolarHBondContact O-CG 3.43Å; S697-L701 PolarHBondContact O-N 3.05Å; S697-I803 VanDerWaalsContact OG-CD1 3.31Å; S697-I803 WeakPolarHBondContact OG-CD1 3.43Å
698	E	93.7	Very high	91.9	Very high	10 Å²	10	34.1 Å²	34.1	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-38.9	179	-74.9	170.8	159.1	0	0	112.6	F7 V694 H696 K702 V738 R740	F7-E698 HydrophobicContact CD1-CB 4.04Å; F7-E698 HydrophobicContact CE1-CB 4.18Å; F7-E698 VanDerWaalsContact CE1-O 3.26Å; F7-E698 WeakPolarHBondContact CE1-O 3.41Å; F7-E698 HydrophobicContact CG-CB 4.31Å; V694-E698 HydrophobicContact CG1-CG 4.29Å; V694-E698 WeakPolarHBondContact O-CB 3.4Å; V694-E698 VanDerWaalsContact O-CG 3.31Å; V694-E698 WeakPolarHBondContact O-CG 3.18Å; V694-E698 PolarHBondContact O-N 3.48Å; H696-E698 PolarHBondContact O-N 3.36Å; E698-K702 PolarHBondContact O-N 2.79Å; E698-V738 HydrophobicContact CG-CG1 4.26Å; E698-R740 VanDerWaalsContact CD-NH2 3.27Å; E698-R740 IonicContact OE1-CZ 3.95Å; E698-R740 VanDerWaalsContact OE1-CZ 3.28Å; E698-R740 IonicContact OE1-NE 3.24Å; E698-R740 PolarHBondContact OE1-NE 2.9Å; E698-R740 IonicContact OE1-NH2 2.82Å; E698-R740 PolarHBondContact OE1-NH2 3.05Å; E698-R740 IonicContact OE2-CZ 2.75Å; E698-R740 IonicContact OE2-NE 2.85Å; E698-R740 IonicContact OE2-NH2 3.24Å; E698-R740 PolarHBondContact OE2-NH2 3.19Å
699	R	93	Very high	91.6	Very high	113 Å²	113	30.4 Å²	30.4	43%	0.426	15%	0.145	S	C	.	.	H	α-helix	trans	-73.4	-43.3	176.5	-67.4	176	-143.3	178.4	6.9	112.3	S695 H696 S697 K702 L703 F785	S695-R699 VanDerWaalsContact O-CG 3.22Å; S695-R699 WeakPolarHBondContact O-CG 3.46Å; S695-R699 PolarHBondContact O-N 3.06Å; S695-R699 PolarHBondContact O-NE 3.19Å; S695-R699 PolarHBondContact OG-NE 3.39Å; S695-R699 PolarHBondContact OG-NH2 3.26Å; H696-R699 PolarHBondContact O-N 3.1Å; S697-R699 PolarHBondContact O-N 3.35Å; R699-K702 WeakPolarHBondContact O-CB 3.43Å; R699-K702 PolarHBondContact O-N 3.32Å; R699-K702 VanDerWaalsContact O-N 3.14Å; R699-L703 PolarHBondContact O-N 3.09Å; R699-F785 HydrophobicContact CB-CD1 4.42Å; R699-F785 HydrophobicContact CB-CD2 4.06Å; R699-F785 HydrophobicContact CB-CE1 3.99Å; R699-F785 HydrophobicContact CB-CE2 3.6Å; R699-F785 HydrophobicContact CB-CG 4.46Å; R699-F785 HydrophobicContact CB-CZ 3.57Å; R699-F785 HydrophobicContact CG-CZ 4.49Å
700	A	93.3	Very high	91	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-43.8	177.4	0	0	0	0	0	111.2	H696 S697 K702 L703 V704 L778 E781 L782 F785	H696-A700 VanDerWaalsContact O-CB 3.3Å; H696-A700 WeakPolarHBondContact O-CB 3.49Å; H696-A700 PolarHBondContact O-N 2.91Å; S697-A700 PolarHBondContact O-N 3.38Å; A700-K702 PolarHBondContact O-N 2.83Å; A700-L703 PolarHBondContact O-N 2.96Å; A700-L703 VanDerWaalsContact O-N 3.15Å; A700-V704 WeakPolarHBondContact O-CG2 3.11Å; A700-V704 PolarHBondContact O-N 2.93Å; A700-L778 HydrophobicContact CB-CD1 3.8Å; A700-E781 HydrophobicContact CB-CB 3.99Å; A700-L782 HydrophobicContact CB-CD2 3.68Å; A700-L782 HydrophobicContact CB-CG 3.8Å; A700-F785 HydrophobicContact CB-CD2 4.37Å; A700-F785 HydrophobicContact CB-CE2 4.42Å
701	L	92.8	Very high	90	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-28.9	173.6	-72.5	169.5	0	0	0	112.9	F9 S697 S705 V738 L760 I774 L778 I815	F9-L701 HydrophobicContact CZ-CB 3.99Å; F9-L701 WeakPolarHBondContact CZ-O 3.4Å; S697-L701 VanDerWaalsContact O-CB 3.3Å; S697-L701 WeakPolarHBondContact O-CB 3.44Å; S697-L701 VanDerWaalsContact O-CG 3.23Å; S697-L701 WeakPolarHBondContact O-CG 3.43Å; S697-L701 PolarHBondContact O-N 3.05Å; L701-S705 PolarHBondContact O-N 2.76Å; L701-V738 HydrophobicContact CB-CG2 4Å; L701-V738 HydrophobicContact CD1-CG2 3.6Å; L701-V738 HydrophobicContact CG-CG2 4.45Å; L701-L760 HydrophobicContact CD2-CD2 4.3Å; L701-I774 HydrophobicContact CD2-CG2 4.19Å; L701-L778 HydrophobicContact CD2-CD1 3.96Å; L701-L778 HydrophobicContact CG-CD1 4.12Å; L701-I815 HydrophobicContact CD1-CD1 3.83Å; L701-I815 HydrophobicContact CD1-CG1 4.16Å; L701-I815 HydrophobicContact CD1-CG2 4.11Å; L701-I815 HydrophobicContact CD2-CD1 4.35Å; L701-I815 HydrophobicContact CG-CD1 4.37Å
702	K	92.1	Very high	88.4	Confident	66 Å²	66	40.4 Å²	40.4	29%	0.287	19%	0.192	S	C	.	.	H	α-helix	trans	-67	-50.5	170.6	-175	176.4	174.1	-178.6	0	111.5	F7 F9 E698 R699 A700 V704 S705 D706	F7-K702 HydrophobicContact CE1-CB 4.19Å; F9-K702 HydrophobicContact CD1-CB 3.84Å; F9-K702 HydrophobicContact CD1-CD 4.41Å; F9-K702 HydrophobicContact CD1-CG 3.82Å; F9-K702 VanDerWaalsContact CE1-CA 3.49Å; F9-K702 HydrophobicContact CE1-CB 3.58Å; F9-K702 HydrophobicContact CE1-CG 4.12Å; F9-K702 HydrophobicContact CZ-CB 4.34Å; E698-K702 PolarHBondContact O-N 2.79Å; R699-K702 WeakPolarHBondContact O-CB 3.43Å; R699-K702 PolarHBondContact O-N 3.32Å; R699-K702 VanDerWaalsContact O-N 3.14Å; A700-K702 PolarHBondContact O-N 2.83Å; K702-V704 VanDerWaalsContact C-N 3.29Å; K702-V704 PolarHBondContact O-N 3.34Å; K702-S705 CarbonylContact O-C 3.57Å; K702-S705 WeakPolarHBondContact O-CA 3.22Å; K702-S705 WeakPolarHBondContact O-CB 3.31Å; K702-S705 PolarHBondContact O-N 2.77Å; K702-D706 WeakPolarHBondContact CE-OD2 3.46Å; K702-D706 PolarHBondContact O-N 3.2Å
703	L	91.5	Very high	86.2	Confident	54 Å²	54	42.1 Å²	42.1	28%	0.283	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-36.8	177.4	-64.7	-171.5	0	0	0	112.1	R699 A700 S705 D706 S707 E781 F785	R699-L703 PolarHBondContact O-N 3.09Å; A700-L703 PolarHBondContact O-N 2.96Å; A700-L703 VanDerWaalsContact O-N 3.15Å; L703-S705 VanDerWaalsContact C-N 3.32Å; L703-S705 PolarHBondContact O-N 3.45Å; L703-D706 PolarHBondContact O-N 2.9Å; L703-S707 VanDerWaalsContact O-CB 3.25Å; L703-S707 WeakPolarHBondContact O-CB 3.27Å; L703-S707 PolarHBondContact O-N 3.18Å; L703-E781 HydrophobicContact CB-CB 4.07Å; L703-E781 HydrophobicContact CB-CG 3.85Å; L703-E781 WeakPolarHBondContact CB-OE2 3.35Å; L703-E781 HydrophobicContact CD1-CB 4.45Å; L703-E781 WeakPolarHBondContact CD1-OE2 3.45Å; L703-F785 HydrophobicContact CD1-CE2 3.59Å; L703-F785 HydrophobicContact CD1-CZ 3.54Å; L703-F785 HydrophobicContact CG-CE2 4.12Å; L703-F785 HydrophobicContact CG-CZ 4.02Å
704	V	91.8	Very high	83.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-40	170.6	176.2	0	0	0	0	111	A700 K702 L708 I774 Q777 L778 E781	A700-V704 WeakPolarHBondContact O-CG2 3.11Å; A700-V704 PolarHBondContact O-N 2.93Å; K702-V704 VanDerWaalsContact C-N 3.29Å; K702-V704 PolarHBondContact O-N 3.34Å; V704-L708 HydrophobicContact CG1-CD1 4.03Å; V704-L708 WeakPolarHBondContact O-CB 3.22Å; V704-L708 VanDerWaalsContact O-CG 3.23Å; V704-L708 WeakPolarHBondContact O-CG 3.46Å; V704-L708 PolarHBondContact O-N 2.74Å; V704-I774 HydrophobicContact CG1-CB 4.34Å; V704-I774 HydrophobicContact CG1-CG1 4.01Å; V704-I774 HydrophobicContact CG1-CG2 4.22Å; V704-Q777 HydrophobicContact CG1-CB 4.11Å; V704-Q777 HydrophobicContact CG2-CB 3.84Å; V704-L778 HydrophobicContact CG2-CB 4.42Å; V704-L778 HydrophobicContact CG2-CD1 4.24Å; V704-E781 HydrophobicContact CG2-CB 4.32Å; V704-E781 HydrophobicContact CG2-CG 3.68Å
705	S	91.1	Very high	81.4	Confident	1 Å²	1	52 Å²	52	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-69.3	-34.7	175.4	-174.2	0	0	0	0	113.9	F9 L701 K702 L703 L709 R733	F9-S705 VanDerWaalsContact CD2-CB 3.42Å; F9-S705 WeakPolarHBondContact CD2-OG 3.28Å; L701-S705 PolarHBondContact O-N 2.76Å; K702-S705 CarbonylContact O-C 3.57Å; K702-S705 WeakPolarHBondContact O-CA 3.22Å; K702-S705 WeakPolarHBondContact O-CB 3.31Å; K702-S705 PolarHBondContact O-N 2.77Å; L703-S705 VanDerWaalsContact C-N 3.32Å; L703-S705 PolarHBondContact O-N 3.45Å; S705-L709 PolarHBondContact O-N 2.68Å; S705-R733 PolarHBondContact O-NH1 3.03Å; S705-R733 WeakPolarHBondContact OG-CD 3.47Å; S705-R733 PolarHBondContact OG-NH1 2.74Å
706	D	90	Very high	78.8	Confident	40 Å²	40	56.8 Å²	56.8	21%	0.214	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-48.8	175.9	-64.3	-30.8	0	0	0	108.7	K702 L703 L708 L709 D710 R733	K702-D706 WeakPolarHBondContact CE-OD2 3.46Å; K702-D706 PolarHBondContact O-N 3.2Å; L703-D706 PolarHBondContact O-N 2.9Å; D706-L708 PolarHBondContact O-N 3.32Å; D706-L708 VanDerWaalsContact O-N 3.07Å; D706-L709 WeakPolarHBondContact O-CB 3.37Å; D706-L709 PolarHBondContact O-N 3.3Å; D706-D710 PolarHBondContact O-N 2.85Å; D706-D710 VanDerWaalsContact O-N 3.09Å; D706-R733 IonicContact OD1-CZ 2.72Å; D706-R733 IonicContact OD1-NH1 2.71Å; D706-R733 PolarHBondContact OD1-NH1 2.93Å; D706-R733 IonicContact OD1-NH2 3.87Å; D706-R733 PolarHBondContact OD1-NH2 3.09Å
707	S	88.8	Confident	76.5	Confident	32 Å²	32	60.8 Å²	60.8	22%	0.224	33%	0.333	C	S	.	.	H	α-helix	trans	-65.2	-10	174.2	-174	0	0	0	0	115.3	L703 K711 Q777	L703-S707 VanDerWaalsContact O-CB 3.25Å; L703-S707 WeakPolarHBondContact O-CB 3.27Å; L703-S707 PolarHBondContact O-N 3.18Å; S707-K711 VanDerWaalsContact O-CD 3.22Å; S707-K711 WeakPolarHBondContact O-CD 3.34Å; S707-K711 VanDerWaalsContact O-CE 3.32Å; S707-K711 WeakPolarHBondContact O-CE 3.32Å; S707-K711 WeakPolarHBondContact O-CG 3.37Å; S707-K711 PolarHBondContact O-NZ 3.45Å; S707-K711 PolarHBondContact OG-NZ 3.19Å; S707-Q777 PolarHBondContact OG-NE2 2.73Å
708	L	86.6	Confident	73.9	Confident	14 Å²	14	66.6 Å²	66.6	7%	0.073	37%	0.374	C	S	.	.	H	α-helix	trans	-90.7	-35.5	169.5	-78.4	169.3	0	0	0	111.7	V704 D706 K711 E712 M734 L735 L770 I774	V704-L708 HydrophobicContact CG1-CD1 4.03Å; V704-L708 WeakPolarHBondContact O-CB 3.22Å; V704-L708 VanDerWaalsContact O-CG 3.23Å; V704-L708 WeakPolarHBondContact O-CG 3.46Å; V704-L708 PolarHBondContact O-N 2.74Å; D706-L708 PolarHBondContact O-N 3.32Å; D706-L708 VanDerWaalsContact O-N 3.07Å; L708-K711 PolarHBondContact O-N 3.35Å; L708-E712 PolarHBondContact O-N 3.12Å; L708-E712 VanDerWaalsContact O-N 3.12Å; L708-M734 HydrophobicContact CB-SD 4.48Å; L708-M734 HydrophobicContact CD2-SD 4.47Å; L708-L735 HydrophobicContact CD1-CD1 3.93Å; L708-L735 HydrophobicContact CD1-CG 4.39Å; L708-L770 HydrophobicContact CD1-CD1 4.25Å; L708-I774 HydrophobicContact CD1-CG1 4.18Å
709	L	85.6	Confident	71.1	Confident	29 Å²	29	72.7 Å²	72.7	15%	0.152	41%	0.412	C	S	.	.	H	α-helix	trans	-60.3	-48.5	169.9	-80.9	174.8	0	0	0	110.9	S705 D706 K711 E712 E713 R733	S705-L709 PolarHBondContact O-N 2.68Å; D706-L709 WeakPolarHBondContact O-CB 3.37Å; D706-L709 PolarHBondContact O-N 3.3Å; L709-K711 PolarHBondContact O-N 2.98Å; L709-E712 PolarHBondContact O-N 3.42Å; L709-E713 PolarHBondContact O-N 3.35Å; L709-R733 HydrophobicContact CD1-CB 4.28Å; L709-R733 HydrophobicContact CD1-CG 3.93Å; L709-R733 VanDerWaalsContact CD1-CZ 3.41Å; L709-R733 HydrophobicContact CD2-CB 3.95Å; L709-R733 HydrophobicContact CD2-CG 4.15Å; L709-R733 HydrophobicContact CG-CB 4.34Å; L709-R733 HydrophobicContact CG-CG 4Å
710	D	79.1	Confident	68.6	Low	125 Å²	125	72.6 Å²	72.6	67%	0.668	44%	0.435	S	S	*	.	H	α-helix	trans	-61.5	-5.8	179.7	-55.9	-25.6	0	0	0	113.8	D706	D706-D710 PolarHBondContact O-N 2.85Å; D706-D710 VanDerWaalsContact O-N 3.09Å
711	K	72.4	Confident	65.8	Low	125 Å²	125	77.4 Å²	77.4	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-115.6	-15.1	176.5	-68.2	173.8	-170.6	148.5	0	114.2	S707 L708 L709	S707-K711 VanDerWaalsContact O-CD 3.22Å; S707-K711 WeakPolarHBondContact O-CD 3.34Å; S707-K711 VanDerWaalsContact O-CE 3.32Å; S707-K711 WeakPolarHBondContact O-CE 3.32Å; S707-K711 WeakPolarHBondContact O-CG 3.37Å; S707-K711 PolarHBondContact O-NZ 3.45Å; S707-K711 PolarHBondContact OG-NZ 3.19Å; L708-K711 PolarHBondContact O-N 3.35Å; L709-K711 PolarHBondContact O-N 2.98Å
712	E	59.9	Low	63.2	Low	83 Å²	83	87.3 Å²	87.3	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-83.3	-19.4	171.2	-77.3	-165.5	132	0	0	111.8	L708 L709 P714 M734	L708-E712 PolarHBondContact O-N 3.12Å; L708-E712 VanDerWaalsContact O-N 3.12Å; L709-E712 PolarHBondContact O-N 3.42Å; E712-P714 WeakPolarHBondContact O-CD 3.46Å; E712-P714 WeakPolarHBondContact O-CG 3.37Å; E712-M734 HydrophobicContact CG-CG 4.35Å; E712-M734 HydrophobicContact CG-SD 4.4Å; E712-M734 WeakPolarHBondContact OE1-CE 3.26Å; E712-M734 VanDerWaalsContact OE1-CG 3.31Å; E712-M734 WeakPolarHBondContact OE1-CG 3.18Å; E712-M734 WeakPolarHBondContact OE2-CG 3.44Å
713	E	44.3	Very low	60.2	Low	132 Å²	132	87.6 Å²	87.6	62%	0.617	54%	0.543	S	S	*	.	S	Bend	trans	-60.3	107.7	162.3	-73.1	-76.2	133.8	0	0	110.3	L709	L709-E713 PolarHBondContact O-N 3.35Å
714	P	44	Very low	57.2	Low	107 Å²	107	93.8 Å²	93.8	70%	0.695	57%	0.571	S	S	*	*			trans	-82.5	131.7	-177.3	-7.5	27	0	0	0	110.3	E712 V716	E712-P714 WeakPolarHBondContact O-CD 3.46Å; E712-P714 WeakPolarHBondContact O-CG 3.37Å; P714-V716 PolarHBondContact O-N 3.1Å
715	A	40.5	Very low	54.4	Low	106 Å²	106	99 Å²	99	88%	0.876	61%	0.614	S	S	*	*			trans	-64.9	107	172.2	0	0	0	0	0	110.9
716	V	39.2	Very low	51.6	Low	130 Å²	130	105 Å²	105	79%	0.788	65%	0.651	S	S	*	*			trans	-97.6	114	169.7	-176.3	0	0	0	0	108.8	P714	P714-V716 PolarHBondContact O-N 3.1Å
717	P	44.4	Very low	48.8	Very low	109 Å²	109	108.6 Å²	108.6	71%	0.708	68%	0.679	S	S	*	*			trans	-69	143.4	172.6	29.6	-33.7	0	0	0	110.4	T719	P717-T719 PolarHBondContact O-N 2.97Å
718	S	38.5	Very low	46.1	Very low	122 Å²	122	111.6 Å²	111.6	85%	0.853	71%	0.706	S	S	*	*			trans	-72.8	112.6	-170	55.3	0	0	0	0	114
719	T	35	Very low	43.5	Very low	139 Å²	139	119.6 Å²	119.6	85%	0.853	74%	0.743	S	S	*	*			trans	-134.7	129.8	156.2	50.6	0	0	0	0	109.2	P717	P717-T719 PolarHBondContact O-N 2.97Å
720	A	40.5	Very low	41.2	Very low	110 Å²	110	124.3 Å²	124.3	91%	0.909	77%	0.768	S	S	*	*			trans	-89	137.4	-167.6	0	0	0	0	0	114.1
721	A	34.5	Very low	39.8	Very low	102 Å²	102	121.6 Å²	121.6	84%	0.843	76%	0.757	S	S	*	*			trans	-152.3	136.7	154.5	0	0	0	0	0	107.8
722	E	36.4	Very low	39.3	Very low	207 Å²	207	119.5 Å²	119.5	97%	0.967	76%	0.764	S	S	*	*			trans	-88.8	139.5	-177.3	-59.7	-174	146.2	0	0	111.4
723	G	29	Very low	40.2	Very low	73 Å²	73	116.3 Å²	116.3	75%	0.753	75%	0.748	S	S	*	*			trans	-177.4	104	178.8	0	0	0	0	0	115.3
724	E	29.5	Very low	42.1	Very low	183 Å²	183	112.3 Å²	112.3	86%	0.855	73%	0.73	S	S	*	*			trans	41	96.4	152.6	-160.2	154.9	-134.6	0	0	119.4	T726	E724-T726 PolarHBondContact O-N 3.11Å
725	A	32.7	Very low	44.2	Very low	110 Å²	110	107.2 Å²	107.2	91%	0.909	70%	0.697	S	S	*	*			trans	-73.6	92.5	174.7	0	0	0	0	0	112.9
726	T	32.8	Very low	46.4	Very low	127 Å²	127	106.6 Å²	106.6	78%	0.779	67%	0.674	S	S	*	*			trans	-74.1	153.2	155.4	48.1	0	0	0	0	110.3	E724 A728	E724-T726 PolarHBondContact O-N 3.11Å; T726-A728 PolarHBondContact O-N 3.21Å
727	S	30	Very low	48.9	Very low	116 Å²	116	100.4 Å²	100.4	81%	0.811	64%	0.637	S	S	*	*			trans	-69.6	106	-170.9	53.9	0	0	0	0	112.2	E729	S727-E729 PolarHBondContact O-N 3.16Å
728	A	32.1	Very low	51.2	Low	94 Å²	94	95.2 Å²	95.2	78%	0.777	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.9	173.8	0	0	0	0	0	111	T726	T726-A728 PolarHBondContact O-N 3.21Å
729	E	33.3	Very low	53.9	Low	183 Å²	183	90.2 Å²	90.2	86%	0.855	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-65.1	137	164.5	-62.5	-164.4	142.1	0	0	108.9	S727	S727-E729 PolarHBondContact O-N 3.16Å
730	N	37	Very low	56.7	Low	127 Å²	127	86.3 Å²	86.3	68%	0.679	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-63.1	136.8	179.1	-75.1	-110.7	0	0	0	108.9	A732	N730-A732 PolarHBondContact O-N 2.95Å; N730-A732 VanDerWaalsContact O-N 3.1Å
731	P	50.4	Low	59.3	Low	68 Å²	68	81.2 Å²	81.2	44%	0.442	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-55.2	121.4	-179.7	20.6	-31.7	0	0	0	110.5	R733	P731-R733 PolarHBondContact O-N 2.93Å
732	A	61	Low	62	Low	82 Å²	82	76.7 Å²	76.7	68%	0.678	46%	0.457	S	S	*	.			trans	-74.4	88.4	-168.6	0	0	0	0	0	111.3	N730 M734	N730-A732 PolarHBondContact O-N 2.95Å; N730-A732 VanDerWaalsContact O-N 3.1Å; A732-M734 PolarHBondContact O-N 3.33Å
733	R	78.1	Confident	64.7	Low	15 Å²	15	68.1 Å²	68.1	6%	0.057	42%	0.417	C	S	.	.			trans	-26.9	115.6	-178.9	-175.7	-168.7	-84.2	-92.7	5	113.2	F9 T10 S705 D706 L709 P731 L735	F9-R733 PolarHBondContact O-NE 3.38Å; T10-R733 PolarHBondContact O-NH2 3.42Å; S705-R733 PolarHBondContact O-NH1 3.03Å; S705-R733 WeakPolarHBondContact OG-CD 3.47Å; S705-R733 PolarHBondContact OG-NH1 2.74Å; D706-R733 IonicContact OD1-CZ 2.72Å; D706-R733 IonicContact OD1-NH1 2.71Å; D706-R733 PolarHBondContact OD1-NH1 2.93Å; D706-R733 IonicContact OD1-NH2 3.87Å; D706-R733 PolarHBondContact OD1-NH2 3.09Å; L709-R733 HydrophobicContact CD1-CB 4.28Å; L709-R733 HydrophobicContact CD1-CG 3.93Å; L709-R733 VanDerWaalsContact CD1-CZ 3.41Å; L709-R733 HydrophobicContact CD2-CB 3.95Å; L709-R733 HydrophobicContact CD2-CG 4.15Å; L709-R733 HydrophobicContact CG-CB 4.34Å; L709-R733 HydrophobicContact CG-CG 4Å; P731-R733 PolarHBondContact O-N 2.93Å; R733-L735 WeakPolarHBondContact CD-O 3.31Å; R733-L735 WeakPolarHBondContact CG-O 3.37Å; R733-L735 PolarHBondContact O-N 3.47Å
734	M	84.7	Confident	67.8	Low	48 Å²	48	66 Å²	66	24%	0.236	39%	0.389	C	S	.	.	S	Bend	trans	-46.4	-38.7	-177.6	-58.1	-163.5	94.8	0	0	114.1	L708 E712 A732 T762 A763 L770	L708-M734 HydrophobicContact CB-SD 4.48Å; L708-M734 HydrophobicContact CD2-SD 4.47Å; E712-M734 HydrophobicContact CG-CG 4.35Å; E712-M734 HydrophobicContact CG-SD 4.4Å; E712-M734 WeakPolarHBondContact OE1-CE 3.26Å; E712-M734 VanDerWaalsContact OE1-CG 3.31Å; E712-M734 WeakPolarHBondContact OE1-CG 3.18Å; E712-M734 WeakPolarHBondContact OE2-CG 3.44Å; A732-M734 PolarHBondContact O-N 3.33Å; M734-T762 CarbonylContact O-C 3.56Å; M734-T762 WeakPolarHBondContact O-CA 3.41Å; M734-A763 PolarHBondContact O-N 3.39Å; M734-L770 HydrophobicContact CE-CD1 4.16Å; M734-L770 HydrophobicContact SD-CD1 4.01Å
735	L	88.9	Confident	70.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.7	-177.4	-49.3	-177.6	0	0	0	108.5	F9 L708 R733 L760 L761 T762 I774	F9-L735 HydrophobicContact CD2-CB 3.91Å; F9-L735 WeakPolarHBondContact CD2-O 3.5Å; F9-L735 HydrophobicContact CE2-CB 3.88Å; L708-L735 HydrophobicContact CD1-CD1 3.93Å; L708-L735 HydrophobicContact CD1-CG 4.39Å; R733-L735 WeakPolarHBondContact CD-O 3.31Å; R733-L735 WeakPolarHBondContact CG-O 3.37Å; R733-L735 PolarHBondContact O-N 3.47Å; L735-L760 HydrophobicContact CB-CD1 4.28Å; L735-L760 HydrophobicContact CD1-CD1 4.25Å; L735-L760 HydrophobicContact CD1-CD2 4.1Å; L735-L760 HydrophobicContact CD2-CD1 4.49Å; L735-L760 HydrophobicContact CD2-CD2 4.03Å; L735-L760 HydrophobicContact CD2-CG 4.24Å; L735-L761 CarbonylContact C-O 3.56Å; L735-T762 HydrophobicContact CD2-CG2 3.77Å; L735-I774 HydrophobicContact CD1-CD1 4.35Å; L735-I774 HydrophobicContact CD2-CD1 4.27Å
736	K	87.2	Confident	73.7	Confident	94 Å²	94	52.9 Å²	52.9	41%	0.409	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-31.9	-178.5	-71.7	170.8	171.2	159.9	0	111.8	F9 L761 A763	F9-K736 PolarHBondContact N-O 3.15Å; K736-L761 HydrophobicContact CB-CB 4.27Å; K736-L761 PolarHBondContact N-O 2.99Å; K736-A763 HydrophobicContact CD-CB 4.49Å; K736-A763 HydrophobicContact CG-CB 4.41Å; K736-A763 PolarHBondContact NZ-O 3.27Å
737	G	90.3	Very high	76.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.6	179.3	176.2	0	0	0	0	0	113.6	F7 L761	F7-G737 WeakPolarHBondContact O-CA 3.31Å; G737-L761 PolarHBondContact O-N 2.92Å
738	V	94.3	Very high	79.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139	177.6	177.4	0	0	0	0	110.1	F7 F9 E698 L701 L758 I759 L760	F7-V738 HydrophobicContact CB-CB 4.46Å; F7-V738 PolarHBondContact N-O 2.86Å; F7-V738 PolarHBondContact O-N 2.87Å; F9-V738 HydrophobicContact CE1-CG2 4.3Å; F9-V738 HydrophobicContact CE2-CG2 4.44Å; F9-V738 HydrophobicContact CZ-CG2 3.67Å; E698-V738 HydrophobicContact CG-CG1 4.26Å; L701-V738 HydrophobicContact CB-CG2 4Å; L701-V738 HydrophobicContact CD1-CG2 3.6Å; L701-V738 HydrophobicContact CG-CG2 4.45Å; V738-L758 HydrophobicContact CG1-CB 4.17Å; V738-L758 HydrophobicContact CG1-CD1 4.26Å; V738-L758 HydrophobicContact CG1-CD2 4.42Å; V738-I759 CarbonylContact C-O 3.45Å; V738-I759 WeakPolarHBondContact CA-O 3.36Å; V738-L760 HydrophobicContact CG2-CD1 3.81Å
739	M	93.9	Very high	82.6	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.079	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.2	175.5	-61.1	-143.2	61.1	0	0	110.5	N5 Y6 I759 L761 L864	N5-M739 WeakPolarHBondContact O-CA 3.39Å; N5-M739 WeakPolarHBondContact O-CE 3.27Å; Y6-M739 HydrophobicContact CD2-CE 3.85Å; Y6-M739 HydrophobicContact CD2-CG 3.83Å; Y6-M739 HydrophobicContact CD2-SD 3.74Å; Y6-M739 HydrophobicContact CE2-CG 4.35Å; Y6-M739 HydrophobicContact CE2-SD 4.27Å; Y6-M739 HydrophobicContact CG-CE 4.44Å; M739-I759 PolarHBondContact N-O 2.97Å; M739-I759 PolarHBondContact O-N 3.09Å; M739-L761 HydrophobicContact CG-CD1 3.89Å; M739-L761 HydrophobicContact CG-CG 4.43Å; M739-L761 HydrophobicContact SD-CD1 3.82Å; M739-L864 HydrophobicContact CB-CD1 3.79Å; M739-L864 HydrophobicContact CE-CD1 3.95Å; M739-L864 HydrophobicContact CG-CD1 4.21Å; M739-L864 HydrophobicContact SD-CD1 3.63Å; M739-L864 HydrophobicContact SD-CD2 4.07Å; M739-L864 HydrophobicContact SD-CG 4.43Å
740	R	94.9	Very high	85.5	Confident	58 Å²	58	30.7 Å²	30.7	22%	0.219	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.9	172	-62.6	176.8	-178.2	-174.1	-0.5	108.5	N5 E698 L744 A745 L758	N5-R740 HydrophobicContact CB-CB 4.49Å; N5-R740 PolarHBondContact O-N 3.05Å; N5-R740 VanDerWaalsContact O-N 3.14Å; E698-R740 VanDerWaalsContact CD-NH2 3.27Å; E698-R740 IonicContact OE1-CZ 3.95Å; E698-R740 VanDerWaalsContact OE1-CZ 3.28Å; E698-R740 IonicContact OE1-NE 3.24Å; E698-R740 PolarHBondContact OE1-NE 2.9Å; E698-R740 IonicContact OE1-NH2 2.82Å; E698-R740 PolarHBondContact OE1-NH2 3.05Å; E698-R740 IonicContact OE2-CZ 2.75Å; E698-R740 IonicContact OE2-NE 2.85Å; E698-R740 IonicContact OE2-NH2 3.24Å; E698-R740 PolarHBondContact OE2-NH2 3.19Å; R740-L744 HydrophobicContact CB-CD2 3.99Å; R740-L744 HydrophobicContact CG-CD2 3.82Å; R740-A745 VanDerWaalsContact C-CB 3.48Å; R740-A745 HydrophobicContact CB-CB 3.95Å; R740-A745 WeakPolarHBondContact O-CB 3.11Å; R740-L758 HydrophobicContact CB-CD2 4.35Å; R740-L758 HydrophobicContact CG-CD2 3.82Å
741	V	94	Very high	88.2	Confident	2 Å²	2	31 Å²	31	1%	0.012	17%	0.167	C	C	.	.			trans	-134.5	-158.6	175	-60.8	0	0	0	0	111.6	L744 A745 E757 I759 L864 A867	V741-L744 PolarHBondContact O-N 3.34Å; V741-A745 WeakPolarHBondContact O-CB 3.43Å; V741-A745 PolarHBondContact O-N 2.81Å; V741-E757 HydrophobicContact CG2-CB 3.67Å; V741-E757 PolarHBondContact N-O 3.34Å; V741-I759 HydrophobicContact CB-CD1 4.39Å; V741-I759 HydrophobicContact CG1-CB 4.49Å; V741-I759 HydrophobicContact CG1-CD1 3.71Å; V741-I759 HydrophobicContact CG1-CG1 4.06Å; V741-I759 HydrophobicContact CG2-CD1 3.94Å; V741-I759 HydrophobicContact CG2-CG1 3.81Å; V741-L864 HydrophobicContact CG1-CB 4.35Å; V741-L864 HydrophobicContact CG1-CD1 3.87Å; V741-A867 HydrophobicContact CB-CB 4.35Å; V741-A867 HydrophobicContact CG1-CB 4.25Å
742	G	91.8	Very high	90	Very high	8 Å²	8	29.7 Å²	29.7	8%	0.082	17%	0.166	C	C	.	.	H	α-helix	trans	55.8	-147	174.5	0	0	0	0	0	114.3	L744 K746 E757	G742-L744 VanDerWaalsContact C-N 3.27Å; G742-L744 PolarHBondContact O-N 3.43Å; G742-K746 WeakPolarHBondContact O-CD 3.45Å; G742-K746 WeakPolarHBondContact O-CG 3.15Å; G742-E757 WeakPolarHBondContact CA-OE2 3.49Å; G742-E757 PolarHBondContact N-OE2 2.98Å
743	I	93.4	Very high	91.5	Very high	26 Å²	26	26.9 Å²	26.9	13%	0.133	14%	0.14	C	C	.	.	H	α-helix	trans	-68.6	-22.4	177.7	59	-179.8	0	0	0	113.6	G747 L748 L749 D753	I743-G747 PolarHBondContact O-N 3.15Å; I743-L748 HydrophobicContact CB-CB 4.27Å; I743-L748 HydrophobicContact CG2-CB 4.31Å; I743-L748 PolarHBondContact O-N 3.48Å; I743-L749 HydrophobicContact CD1-CD2 3.8Å; I743-L749 HydrophobicContact CG1-CD2 3.85Å; I743-D753 HydrophobicContact CD1-CB 4.31Å; I743-D753 WeakPolarHBondContact CD1-OD2 3.27Å
744	L	93.3	Very high	92.1	Very high	28 Å²	28	30 Å²	30	15%	0.147	15%	0.152	C	C	.	.	H	α-helix	trans	-67.9	-58.1	177.7	177.4	72	0	0	0	111.2	V690 V694 R740 V741 G742 K746 G747 L749 V756 L758	V690-L744 HydrophobicContact CG1-CD1 3.78Å; V694-L744 HydrophobicContact CG1-CD2 4.21Å; V694-L744 HydrophobicContact CG2-CD2 3.92Å; R740-L744 HydrophobicContact CB-CD2 3.99Å; R740-L744 HydrophobicContact CG-CD2 3.82Å; V741-L744 PolarHBondContact O-N 3.34Å; G742-L744 VanDerWaalsContact C-N 3.27Å; G742-L744 PolarHBondContact O-N 3.43Å; L744-K746 VanDerWaalsContact C-N 3.28Å; L744-K746 PolarHBondContact O-N 2.9Å; L744-G747 PolarHBondContact O-N 3.17Å; L744-G747 VanDerWaalsContact O-N 3.1Å; L744-L749 HydrophobicContact CD1-CD1 4.22Å; L744-V756 HydrophobicContact CB-CG1 4.08Å; L744-V756 HydrophobicContact CD1-CG1 4.44Å; L744-V756 HydrophobicContact CD2-CG1 3.69Å; L744-V756 HydrophobicContact CG-CG1 4.27Å; L744-L758 HydrophobicContact CD2-CD2 4.06Å
745	A	92.6	Very high	92.4	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-67.2	-29.2	-174.1	0	0	0	0	0	113.7	N5 R740 V741 G747 A867	N5-A745 PolarHBondContact ND2-O 3.27Å; R740-A745 VanDerWaalsContact C-CB 3.48Å; R740-A745 HydrophobicContact CB-CB 3.95Å; R740-A745 WeakPolarHBondContact O-CB 3.11Å; V741-A745 WeakPolarHBondContact O-CB 3.43Å; V741-A745 PolarHBondContact O-N 2.81Å; A745-G747 VanDerWaalsContact C-N 3.34Å; A745-A867 HydrophobicContact CB-CB 4.17Å
746	K	93.6	Very high	92.7	Very high	16 Å²	16	31.7 Å²	31.7	7%	0.07	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-10	176.7	-57.9	176.8	-164.1	-174.8	0	112.9	G742 L744 L748 F870 E906	G742-K746 WeakPolarHBondContact O-CD 3.45Å; G742-K746 WeakPolarHBondContact O-CG 3.15Å; L744-K746 VanDerWaalsContact C-N 3.28Å; L744-K746 PolarHBondContact O-N 2.9Å; K746-L748 VanDerWaalsContact C-N 3.34Å; K746-L748 HydrophobicContact CB-CB 4.46Å; K746-L748 HydrophobicContact CB-CD1 3.8Å; K746-L748 HydrophobicContact CB-CG 3.79Å; K746-L748 HydrophobicContact CD-CD1 3.99Å; K746-F870 HydrophobicContact CB-CD1 3.64Å; K746-F870 HydrophobicContact CB-CD2 4.35Å; K746-F870 HydrophobicContact CB-CE1 3.74Å; K746-F870 HydrophobicContact CB-CE2 4.42Å; K746-F870 HydrophobicContact CB-CG 3.98Å; K746-F870 HydrophobicContact CB-CZ 4.14Å; K746-F870 HydrophobicContact CD-CB 4.26Å; K746-F870 HydrophobicContact CD-CD1 4.49Å; K746-F870 HydrophobicContact CD-CD2 3.92Å; K746-F870 HydrophobicContact CD-CE2 4.41Å; K746-F870 HydrophobicContact CD-CG 3.97Å; K746-F870 HydrophobicContact CG-CB 3.97Å; K746-F870 HydrophobicContact CG-CD1 3.82Å; K746-F870 HydrophobicContact CG-CD2 4.14Å; K746-F870 HydrophobicContact CG-CE1 4.39Å; K746-F870 HydrophobicContact CG-CG 3.7Å; K746-F870 VanDerWaalsContact O-CE1 3.25Å; K746-F870 WeakPolarHBondContact O-CE1 3.48Å; K746-E906 WeakPolarHBondContact CD-OE1 3.38Å; K746-E906 VanDerWaalsContact CD-OE2 3.32Å; K746-E906 WeakPolarHBondContact CD-OE2 3.35Å; K746-E906 WeakPolarHBondContact CE-OE2 3.47Å; K746-E906 IonicContact NZ-OE1 2.59Å; K746-E906 PolarHBondContact NZ-OE1 2.96Å; K746-E906 IonicContact NZ-OE2 2.81Å; K746-E906 PolarHBondContact NZ-OE2 2.79Å
747	G	92.2	Very high	93	Very high	28 Å²	28	31.1 Å²	31.1	29%	0.289	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	35.8	-174.9	0	0	0	0	0	113.4	I743 L744 A745 R885	I743-G747 PolarHBondContact O-N 3.15Å; L744-G747 PolarHBondContact O-N 3.17Å; L744-G747 VanDerWaalsContact O-N 3.1Å; A745-G747 VanDerWaalsContact C-N 3.34Å; G747-R885 VanDerWaalsContact O-CZ 3.26Å; G747-R885 PolarHBondContact O-NE 2.74Å; G747-R885 PolarHBondContact O-NH2 3.19Å
748	L	95.2	Very high	93.3	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	16%	0.161	C	C	.	.			trans	-103.8	13.6	-176.6	-65.3	178.4	0	0	0	113.9	I743 K746 F870 V881 I884 R885 R888 E906	I743-L748 HydrophobicContact CB-CB 4.27Å; I743-L748 HydrophobicContact CG2-CB 4.31Å; I743-L748 PolarHBondContact O-N 3.48Å; K746-L748 VanDerWaalsContact C-N 3.34Å; K746-L748 HydrophobicContact CB-CB 4.46Å; K746-L748 HydrophobicContact CB-CD1 3.8Å; K746-L748 HydrophobicContact CB-CG 3.79Å; K746-L748 HydrophobicContact CD-CD1 3.99Å; L748-F870 HydrophobicContact CD1-CE2 3.86Å; L748-F870 HydrophobicContact CD1-CZ 3.91Å; L748-F870 HydrophobicContact CD2-CZ 4.04Å; L748-F870 HydrophobicContact CG-CZ 4.08Å; L748-V881 HydrophobicContact CD2-CG1 4.02Å; L748-I884 HydrophobicContact CD1-CG2 3.7Å; L748-I884 HydrophobicContact CD2-CB 4.01Å; L748-I884 HydrophobicContact CD2-CG2 3.62Å; L748-I884 HydrophobicContact CG-CG2 4.31Å; L748-R885 HydrophobicContact CD2-CG 3.99Å; L748-R888 PolarHBondContact O-NH1 3.26Å; L748-E906 HydrophobicContact CD1-CG 4.03Å
749	L	94.8	Very high	93.3	Very high	20 Å²	20	31.1 Å²	31.1	11%	0.105	16%	0.161	C	C	.	.			trans	-54.8	138.9	171.2	-67.8	167.4	0	0	0	111.5	P682 L687 V690 I743 L744 D753	P682-L749 WeakPolarHBondContact CD-O 3.29Å; P682-L749 HydrophobicContact CG-CB 3.83Å; L687-L749 HydrophobicContact CD2-CD1 4.47Å; V690-L749 HydrophobicContact CG1-CD1 4.21Å; I743-L749 HydrophobicContact CD1-CD2 3.8Å; I743-L749 HydrophobicContact CG1-CD2 3.85Å; L744-L749 HydrophobicContact CD1-CD1 4.22Å; L749-D753 WeakPolarHBondContact CA-OD2 3.38Å; L749-D753 HydrophobicContact CD2-CB 4.22Å
750	L	94.8	Very high	93.3	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.157	C	C	.	.			trans	-123.5	159.1	174.9	-62.8	-179.1	0	0	0	109.6	I680 G752 D753 R885 R888 D889	I680-L750 HydrophobicContact CB-CD2 4.17Å; I680-L750 HydrophobicContact CD1-CD2 3.83Å; I680-L750 HydrophobicContact CG1-CD2 3.85Å; I680-L750 CarbonylContact O-C 3.59Å; I680-L750 WeakPolarHBondContact O-CA 3.45Å; L750-G752 PolarHBondContact O-N 2.97Å; L750-D753 PolarHBondContact N-OD2 2.84Å; L750-D753 WeakPolarHBondContact O-CB 3.41Å; L750-D753 PolarHBondContact O-N 3.41Å; L750-D753 VanDerWaalsContact O-N 3.1Å; L750-R885 HydrophobicContact CD2-CB 3.85Å; L750-R885 HydrophobicContact CD2-CG 4.05Å; L750-R888 HydrophobicContact CD1-CB 4.02Å; L750-R888 HydrophobicContact CD1-CG 3.84Å; L750-D889 HydrophobicContact CD1-CB 4.3Å
751	R	92.1	Very high	93.2	Very high	132 Å²	132	28.5 Å²	28.5	50%	0.498	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	135.6	174.4	-175.9	175	-58.7	-166.1	2.2	111	T679 I680 Y681 D753	T679-R751 PolarHBondContact O-NE 3.24Å; T679-R751 PolarHBondContact O-NH2 2.96Å; I680-R751 PolarHBondContact O-N 3.09Å; Y681-R751 PolarHBondContact O-NE 2.94Å; Y681-R751 PolarHBondContact O-NH2 3.24Å; R751-D753 VanDerWaalsContact C-N 3.25Å; R751-D753 PolarHBondContact O-N 2.95Å
752	G	89.2	Confident	93.1	Very high	41 Å²	41	28.5 Å²	28.5	42%	0.423	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	-4.6	-177.6	0	0	0	0	0	115	E686 L750 R754	E686-G752 PolarHBondContact OE1-N 3.01Å; L750-G752 PolarHBondContact O-N 2.97Å; G752-R754 PolarHBondContact O-N 2.99Å
753	D	91.6	Very high	92.9	Very high	23 Å²	23	28.9 Å²	28.9	12%	0.123	15%	0.153	C	C	.	.			trans	-59	126.8	163.7	-77	-33.5	0	0	0	108.9	I743 L749 L750 R751 R888	I743-D753 HydrophobicContact CD1-CB 4.31Å; I743-D753 WeakPolarHBondContact CD1-OD2 3.27Å; L749-D753 WeakPolarHBondContact CA-OD2 3.38Å; L749-D753 HydrophobicContact CD2-CB 4.22Å; L750-D753 PolarHBondContact N-OD2 2.84Å; L750-D753 WeakPolarHBondContact O-CB 3.41Å; L750-D753 PolarHBondContact O-N 3.41Å; L750-D753 VanDerWaalsContact O-N 3.1Å; R751-D753 VanDerWaalsContact C-N 3.25Å; R751-D753 PolarHBondContact O-N 2.95Å; D753-R888 IonicContact OD1-CZ 2.71Å; D753-R888 IonicContact OD1-NH1 3.76Å; D753-R888 PolarHBondContact OD1-NH1 3.25Å; D753-R888 IonicContact OD1-NH2 2.97Å; D753-R888 PolarHBondContact OD1-NH2 3.12Å; D753-R888 IonicContact OD2-CZ 3.02Å; D753-R888 IonicContact OD2-NH1 2.68Å; D753-R888 PolarHBondContact OD2-NH1 3.43Å; D753-R888 IonicContact OD2-NH2 2.79Å; D753-R888 PolarHBondContact OD2-NH2 3.19Å
754	R	90.6	Very high	92.6	Very high	82 Å²	82	34.1 Å²	34.1	31%	0.309	18%	0.175	S	C	.	.			trans	-109.3	-18.2	173.2	-59.8	-57	174.9	-125.5	8.9	112.6	E686 G752 K810 Q812	E686-R754 IonicContact OE1-CZ 3.52Å; E686-R754 IonicContact OE1-NH1 2.71Å; E686-R754 PolarHBondContact OE1-NH1 3.27Å; E686-R754 IonicContact OE1-NH2 3.4Å; E686-R754 PolarHBondContact OE1-NH2 2.97Å; G752-R754 PolarHBondContact O-N 2.99Å; R754-K810 WeakPolarHBondContact CD-O 3.35Å; R754-Q812 PolarHBondContact O-N 2.87Å
755	N	91.9	Very high	92.3	Very high	80 Å²	80	34.4 Å²	34.4	43%	0.428	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.1	-165.4	-63.9	32.9	0	0	0	111	Q812	N755-Q812 CarbonylContact C-O 3.57Å; N755-Q812 WeakPolarHBondContact CA-O 3.38Å; N755-Q812 PolarHBondContact ND2-OE1 3.36Å; N755-Q812 PolarHBondContact OD1-OE1 3.36Å
756	V	94.1	Very high	92.1	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.3	-172.4	169	0	0	0	0	110.2	V690 V694 L744 Q812 V813 T814	V690-V756 HydrophobicContact CG1-CG2 4.1Å; V690-V756 HydrophobicContact CG2-CG2 4.19Å; V694-V756 HydrophobicContact CG2-CG1 3.73Å; L744-V756 HydrophobicContact CB-CG1 4.08Å; L744-V756 HydrophobicContact CD1-CG1 4.44Å; L744-V756 HydrophobicContact CD2-CG1 3.69Å; L744-V756 HydrophobicContact CG-CG1 4.27Å; V756-Q812 PolarHBondContact N-O 3.05Å; V756-V813 HydrophobicContact CB-CG2 4.1Å; V756-V813 HydrophobicContact CG1-CG2 4.23Å; V756-V813 CarbonylContact O-C 3.49Å; V756-V813 WeakPolarHBondContact O-CA 3.46Å; V756-T814 PolarHBondContact O-N 3.17Å
757	E	94.7	Very high	91.8	Very high	82 Å²	82	34.6 Å²	34.6	38%	0.383	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.7	-173.9	-64.1	166.4	-158.7	0	0	112.7	V741 G742	V741-E757 HydrophobicContact CG2-CB 3.67Å; V741-E757 PolarHBondContact N-O 3.34Å; G742-E757 WeakPolarHBondContact CA-OE2 3.49Å; G742-E757 PolarHBondContact N-OE2 2.98Å
758	L	95.8	Very high	91.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.7	169.6	-59.9	-179.6	0	0	0	109.6	V694 V738 R740 L744 V813 T814 I815 S816	V694-L758 HydrophobicContact CG1-CD2 4.32Å; V738-L758 HydrophobicContact CG1-CB 4.17Å; V738-L758 HydrophobicContact CG1-CD1 4.26Å; V738-L758 HydrophobicContact CG1-CD2 4.42Å; R740-L758 HydrophobicContact CB-CD2 4.35Å; R740-L758 HydrophobicContact CG-CD2 3.82Å; L744-L758 HydrophobicContact CD2-CD2 4.06Å; L758-V813 HydrophobicContact CD1-CG1 3.65Å; L758-V813 HydrophobicContact CG-CG1 3.96Å; L758-T814 PolarHBondContact N-O 3.3Å; L758-I815 HydrophobicContact CB-CG1 4.27Å; L758-I815 HydrophobicContact CD1-CG1 4.39Å; L758-I815 WeakPolarHBondContact O-CA 3.43Å; L758-S816 PolarHBondContact O-N 3.47Å
759	I	95.3	Very high	91.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128	171.1	-69.9	-179.6	0	0	0	109.6	V738 M739 V741 L761 S816 T818 N860 L864	V738-I759 CarbonylContact C-O 3.45Å; V738-I759 WeakPolarHBondContact CA-O 3.36Å; M739-I759 PolarHBondContact N-O 2.97Å; M739-I759 PolarHBondContact O-N 3.09Å; V741-I759 HydrophobicContact CB-CD1 4.39Å; V741-I759 HydrophobicContact CG1-CB 4.49Å; V741-I759 HydrophobicContact CG1-CD1 3.71Å; V741-I759 HydrophobicContact CG1-CG1 4.06Å; V741-I759 HydrophobicContact CG2-CD1 3.94Å; V741-I759 HydrophobicContact CG2-CG1 3.81Å; I759-L761 HydrophobicContact CG2-CD2 4.04Å; I759-L761 HydrophobicContact CG2-CG 4.36Å; I759-S816 CarbonylContact C-O 3.5Å; I759-S816 WeakPolarHBondContact CA-O 3.21Å; I759-T818 HydrophobicContact CG2-CG2 3.67Å; I759-N860 HydrophobicContact CD1-CB 4.02Å; I759-N860 WeakPolarHBondContact CD1-O 3.41Å; I759-L864 HydrophobicContact CD1-CB 4.07Å
760	L	94.1	Very high	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.4	169.9	-176.8	63.6	0	0	0	109	F9 L701 L735 V738 I774 I815 S816 L817 T818	F9-L760 HydrophobicContact CE2-CD1 4.06Å; F9-L760 HydrophobicContact CZ-CD1 4.45Å; L701-L760 HydrophobicContact CD2-CD2 4.3Å; L735-L760 HydrophobicContact CB-CD1 4.28Å; L735-L760 HydrophobicContact CD1-CD1 4.25Å; L735-L760 HydrophobicContact CD1-CD2 4.1Å; L735-L760 HydrophobicContact CD2-CD1 4.49Å; L735-L760 HydrophobicContact CD2-CD2 4.03Å; L735-L760 HydrophobicContact CD2-CG 4.24Å; V738-L760 HydrophobicContact CG2-CD1 3.81Å; L760-I774 HydrophobicContact CD2-CD1 3.79Å; L760-I815 HydrophobicContact CB-CG2 3.94Å; L760-S816 PolarHBondContact N-O 3.41Å; L760-L817 HydrophobicContact CB-CG 4.49Å; L760-L817 HydrophobicContact CD2-CG 4.26Å; L760-T818 PolarHBondContact O-N 3.43Å
761	L	93.1	Very high	90.8	Very high	19 Å²	19	37.1 Å²	37.1	10%	0.099	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.5	177.8	-69.8	177.5	0	0	0	110.6	L735 K736 G737 M739 I759 T818 L864	L735-L761 CarbonylContact C-O 3.56Å; K736-L761 HydrophobicContact CB-CB 4.27Å; K736-L761 PolarHBondContact N-O 2.99Å; G737-L761 PolarHBondContact O-N 2.92Å; M739-L761 HydrophobicContact CG-CD1 3.89Å; M739-L761 HydrophobicContact CG-CG 4.43Å; M739-L761 HydrophobicContact SD-CD1 3.82Å; I759-L761 HydrophobicContact CG2-CD2 4.04Å; I759-L761 HydrophobicContact CG2-CG 4.36Å; L761-T818 HydrophobicContact CD2-CG2 3.91Å; L761-L864 HydrophobicContact CD1-CD2 4.33Å; L761-L864 HydrophobicContact CD2-CD2 4.07Å
762	T	91.3	Very high	90.7	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	156.2	177.5	48.4	0	0	0	0	111.6	M734 L735 K764 P766 L770 T818 S819	M734-T762 CarbonylContact O-C 3.56Å; M734-T762 WeakPolarHBondContact O-CA 3.41Å; L735-T762 HydrophobicContact CD2-CG2 3.77Å; T762-K764 PolarHBondContact OG1-O 3.35Å; T762-P766 HydrophobicContact CG2-CB 4.22Å; T762-L770 HydrophobicContact CG2-CD2 3.83Å; T762-T818 PolarHBondContact N-O 3.44Å; T762-T818 VanDerWaalsContact OG1-C 3.32Å; T762-T818 PolarHBondContact OG1-O 3.44Å; T762-S819 PolarHBondContact O-OG 2.99Å; T762-S819 WeakPolarHBondContact OG1-CB 3.41Å
763	A	87.6	Confident	90.7	Very high	16 Å²	16	36.4 Å²	36.4	13%	0.132	19%	0.185	C	C	.	.	S	Bend	trans	-80.2	-57.5	-179.8	0	0	0	0	0	111.7	M734 K736 S819 L821	M734-A763 PolarHBondContact O-N 3.39Å; K736-A763 HydrophobicContact CD-CB 4.49Å; K736-A763 HydrophobicContact CG-CB 4.41Å; K736-A763 PolarHBondContact NZ-O 3.27Å; A763-S819 PolarHBondContact O-OG 3.08Å; A763-L821 WeakPolarHBondContact O-CD1 3.46Å
764	K	87.1	Confident	90.7	Very high	135 Å²	135	35.3 Å²	35.3	59%	0.587	18%	0.179	S	C	*	.	S	Bend	trans	-83.1	-178.5	169	-60.9	-174.3	177.8	-174.1	0	110.4	T762 S819	T762-K764 PolarHBondContact OG1-O 3.35Å; K764-S819 WeakPolarHBondContact O-CB 3.38Å; K764-S819 PolarHBondContact O-OG 3.42Å
765	K	87.1	Confident	90.7	Very high	35 Å²	35	32.2 Å²	32.2	15%	0.152	17%	0.171	C	C	.	.			trans	-67	136.8	172.1	-62.5	178.7	-179.5	177.1	0	109.8	L821 M822 D825 D847 V851	K765-L821 HydrophobicContact CG-CB 4.31Å; K765-M822 HydrophobicContact CB-SD 3.8Å; K765-M822 HydrophobicContact CD-SD 4.04Å; K765-M822 HydrophobicContact CG-SD 3.68Å; K765-D825 WeakPolarHBondContact CE-OD1 3.26Å; K765-D825 WeakPolarHBondContact CE-OD2 3.43Å; K765-D825 IonicContact NZ-OD1 2.74Å; K765-D825 PolarHBondContact NZ-OD1 2.89Å; K765-D825 IonicContact NZ-OD2 3.21Å; K765-D825 PolarHBondContact NZ-OD2 3.25Å; K765-D847 VanDerWaalsContact CD-OD1 3.32Å; K765-D847 WeakPolarHBondContact CD-OD1 3.32Å; K765-D847 WeakPolarHBondContact CE-OD1 3.47Å; K765-D847 IonicContact NZ-OD1 2.71Å; K765-D847 PolarHBondContact NZ-OD1 2.64Å; K765-D847 IonicContact NZ-OD2 2.71Å; K765-D847 PolarHBondContact NZ-OD2 3.34Å; K765-V851 HydrophobicContact CB-CG2 4.26Å
766	P	87.1	Confident	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.			trans	-78.8	138.6	-174.8	33.5	-36.3	0	0	0	111.4	T762 L817 L852	T762-P766 HydrophobicContact CG2-CB 4.22Å; P766-L817 HydrophobicContact CB-CB 4.21Å; P766-L852 HydrophobicContact CB-CD1 3.81Å; P766-L852 HydrophobicContact CB-CG 4.44Å; P766-L852 HydrophobicContact CG-CB 4.43Å; P766-L852 HydrophobicContact CG-CD1 4.08Å; P766-L852 WeakPolarHBondContact O-CG 3.36Å; P766-L852 PolarHBondContact O-N 3.38Å
767	T	88.8	Confident	90.5	Very high	21 Å²	21	36.5 Å²	36.5	13%	0.129	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-114.1	160.2	-178.7	61.7	0	0	0	0	112.7	S769 L770 L771 P848 D850	T767-S769 VanDerWaalsContact C-N 3.27Å; T767-S769 WeakPolarHBondContact CB-OG 3.43Å; T767-S769 PolarHBondContact O-N 3.29Å; T767-S769 PolarHBondContact OG1-OG 3.43Å; T767-L770 PolarHBondContact O-N 2.83Å; T767-L770 WeakPolarHBondContact OG1-CB 3.5Å; T767-L770 PolarHBondContact OG1-N 3.47Å; T767-L770 VanDerWaalsContact OG1-N 3.14Å; T767-L771 PolarHBondContact O-N 3.49Å; T767-P848 HydrophobicContact CG2-CG 3.92Å; T767-D850 CarbonylContact C-O 3.47Å; T767-D850 WeakPolarHBondContact CA-O 3.45Å; T767-D850 WeakPolarHBondContact CB-O 3.46Å; T767-D850 WeakPolarHBondContact CB-OD2 3.21Å
768	V	88.4	Confident	90.3	Very high	24 Å²	24	32.6 Å²	32.6	15%	0.145	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-36.8	174.2	-178.1	0	0	0	0	110.7	L771 K772 P796 D850 L852	V768-L771 PolarHBondContact O-N 3.33Å; V768-K772 HydrophobicContact CG1-CD 3.84Å; V768-K772 HydrophobicContact CG1-CG 4.27Å; V768-K772 WeakPolarHBondContact O-CB 3.31Å; V768-K772 VanDerWaalsContact O-CG 3.27Å; V768-K772 WeakPolarHBondContact O-CG 3.43Å; V768-K772 PolarHBondContact O-N 2.99Å; V768-P796 HydrophobicContact CG1-CB 3.78Å; V768-P796 HydrophobicContact CG2-CB 4.25Å; V768-D850 WeakPolarHBondContact CB-OD1 3.37Å; V768-D850 PolarHBondContact N-O 3.45Å; V768-D850 PolarHBondContact N-OD2 3.03Å; V768-L852 HydrophobicContact CB-CD2 4.27Å; V768-L852 HydrophobicContact CG2-CD2 3.63Å
769	S	88.1	Confident	90	Very high	68 Å²	68	35.2 Å²	35.2	48%	0.476	19%	0.185	S	C	.	.	H	α-helix	trans	-58.2	-46.4	172.1	42.3	0	0	0	0	112.6	T767 K772 S773 D850	T767-S769 VanDerWaalsContact C-N 3.27Å; T767-S769 WeakPolarHBondContact CB-OG 3.43Å; T767-S769 PolarHBondContact O-N 3.29Å; T767-S769 PolarHBondContact OG1-OG 3.43Å; S769-K772 PolarHBondContact O-N 3.38Å; S769-S773 PolarHBondContact O-N 2.97Å; S769-D850 WeakPolarHBondContact CB-OD2 3.39Å; S769-D850 PolarHBondContact N-OD2 2.9Å; S769-D850 PolarHBondContact OG-OD2 3.07Å
770	L	88.6	Confident	89.7	Confident	16 Å²	16	42 Å²	42	8%	0.084	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-45.6	174.8	178.4	59.9	0	0	0	111.3	L708 M734 T762 T767 K772 S773 I774	L708-L770 HydrophobicContact CD1-CD1 4.25Å; M734-L770 HydrophobicContact CE-CD1 4.16Å; M734-L770 HydrophobicContact SD-CD1 4.01Å; T762-L770 HydrophobicContact CG2-CD2 3.83Å; T767-L770 PolarHBondContact O-N 2.83Å; T767-L770 WeakPolarHBondContact OG1-CB 3.5Å; T767-L770 PolarHBondContact OG1-N 3.47Å; T767-L770 VanDerWaalsContact OG1-N 3.14Å; L770-K772 PolarHBondContact O-N 3.48Å; L770-S773 PolarHBondContact O-N 3.24Å; L770-S773 VanDerWaalsContact O-N 3.15Å; L770-I774 HydrophobicContact CD1-CD1 3.9Å; L770-I774 HydrophobicContact CD1-CG1 4.3Å; L770-I774 HydrophobicContact CG-CD1 3.88Å; L770-I774 WeakPolarHBondContact O-CG1 3.25Å; L770-I774 PolarHBondContact O-N 2.91Å
771	L	90.2	Very high	89.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-45.6	176.5	-169.8	154.1	0	0	0	111.3	T767 V768 S773 I774 A775 A794 I801 L817 L852	T767-L771 PolarHBondContact O-N 3.49Å; V768-L771 PolarHBondContact O-N 3.33Å; L771-S773 PolarHBondContact O-N 3.11Å; L771-I774 PolarHBondContact O-N 3.47Å; L771-A775 WeakPolarHBondContact O-CB 3.14Å; L771-A775 PolarHBondContact O-N 3.16Å; L771-A794 HydrophobicContact CD2-CB 3.84Å; L771-I801 HydrophobicContact CD2-CD1 4.44Å; L771-I801 HydrophobicContact CD2-CG1 3.96Å; L771-I801 HydrophobicContact CG-CD1 4.14Å; L771-I801 HydrophobicContact CG-CG1 3.89Å; L771-L817 HydrophobicContact CB-CD2 4Å; L771-L817 HydrophobicContact CD1-CD1 4.27Å; L771-L817 HydrophobicContact CD1-CD2 4.42Å; L771-L817 HydrophobicContact CG-CD1 4.37Å; L771-L817 HydrophobicContact CG-CD2 4.28Å; L771-L852 HydrophobicContact CD1-CD1 3.83Å; L771-L852 HydrophobicContact CD1-CD2 3.96Å
772	K	90.3	Very high	89.1	Confident	114 Å²	114	43 Å²	43	50%	0.496	22%	0.218	S	C	.	.	H	α-helix	trans	-66.8	-30.9	175.5	-74.2	170.4	-179.8	163.7	0	113.1	V768 S769 L770 K776	V768-K772 HydrophobicContact CG1-CD 3.84Å; V768-K772 HydrophobicContact CG1-CG 4.27Å; V768-K772 WeakPolarHBondContact O-CB 3.31Å; V768-K772 VanDerWaalsContact O-CG 3.27Å; V768-K772 WeakPolarHBondContact O-CG 3.43Å; V768-K772 PolarHBondContact O-N 2.99Å; S769-K772 PolarHBondContact O-N 3.38Å; L770-K772 PolarHBondContact O-N 3.48Å; K772-K776 VanDerWaalsContact O-CG 3.28Å; K772-K776 WeakPolarHBondContact O-CG 3.33Å; K772-K776 PolarHBondContact O-N 2.92Å
773	S	89.5	Confident	88.9	Confident	43 Å²	43	46.9 Å²	46.9	30%	0.301	25%	0.245	S	C	.	.	H	α-helix	trans	-69.7	-49.2	173.8	-168.2	0	0	0	0	111.2	S769 L770 L771 A775 K776 Q777	S769-S773 PolarHBondContact O-N 2.97Å; L770-S773 PolarHBondContact O-N 3.24Å; L770-S773 VanDerWaalsContact O-N 3.15Å; L771-S773 PolarHBondContact O-N 3.11Å; S773-A775 VanDerWaalsContact C-N 3.33Å; S773-A775 PolarHBondContact O-N 2.89Å; S773-K776 PolarHBondContact O-N 3.38Å; S773-Q777 PolarHBondContact O-N 3.37Å; S773-Q777 VanDerWaalsContact O-N 3.11Å; S773-Q777 PolarHBondContact O-OE1 3.44Å; S773-Q777 PolarHBondContact OG-OE1 3.22Å
774	I	91.4	Very high	88.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-47.9	177.8	-68	160.9	0	0	0	109.8	L701 V704 L708 L735 L760 L770 L771 K776 Q777 L778 I801 L817	L701-I774 HydrophobicContact CD2-CG2 4.19Å; V704-I774 HydrophobicContact CG1-CB 4.34Å; V704-I774 HydrophobicContact CG1-CG1 4.01Å; V704-I774 HydrophobicContact CG1-CG2 4.22Å; L708-I774 HydrophobicContact CD1-CG1 4.18Å; L735-I774 HydrophobicContact CD1-CD1 4.35Å; L735-I774 HydrophobicContact CD2-CD1 4.27Å; L760-I774 HydrophobicContact CD2-CD1 3.79Å; L770-I774 HydrophobicContact CD1-CD1 3.9Å; L770-I774 HydrophobicContact CD1-CG1 4.3Å; L770-I774 HydrophobicContact CG-CD1 3.88Å; L770-I774 WeakPolarHBondContact O-CG1 3.25Å; L770-I774 PolarHBondContact O-N 2.91Å; L771-I774 PolarHBondContact O-N 3.47Å; I774-K776 PolarHBondContact O-N 3.49Å; I774-Q777 PolarHBondContact O-N 3.05Å; I774-Q777 VanDerWaalsContact O-N 3.08Å; I774-L778 VanDerWaalsContact O-CB 3.24Å; I774-L778 WeakPolarHBondContact O-CB 3.46Å; I774-L778 PolarHBondContact O-N 3.35Å; I774-I801 HydrophobicContact CB-CD1 3.97Å; I774-I801 HydrophobicContact CG2-CD1 3.56Å; I774-L817 HydrophobicContact CD1-CD2 4.03Å
775	A	91.3	Very high	88.4	Confident	17 Å²	17	47.3 Å²	47.3	14%	0.14	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-25.3	177.8	0	0	0	0	0	114.3	L771 S773 P779 A794 I801	L771-A775 WeakPolarHBondContact O-CB 3.14Å; L771-A775 PolarHBondContact O-N 3.16Å; S773-A775 VanDerWaalsContact C-N 3.33Å; S773-A775 PolarHBondContact O-N 2.89Å; A775-P779 WeakPolarHBondContact O-CD 3.15Å; A775-A794 HydrophobicContact CB-CB 3.75Å; A775-I801 HydrophobicContact CB-CD1 4.28Å
776	K	91	Very high	87.9	Confident	160 Å²	160	46.5 Å²	46.5	70%	0.696	25%	0.251	S	S	*	.	H	α-helix	trans	-84.1	-24.5	174.7	-74.7	173.6	-179.8	-176.3	0	114	K772 S773 I774	K772-K776 VanDerWaalsContact O-CG 3.28Å; K772-K776 WeakPolarHBondContact O-CG 3.33Å; K772-K776 PolarHBondContact O-N 2.92Å; S773-K776 PolarHBondContact O-N 3.38Å; I774-K776 PolarHBondContact O-N 3.49Å
777	Q	89.2	Confident	87.1	Confident	14 Å²	14	56.1 Å²	56.1	7%	0.065	30%	0.296	C	S	.	.	H	α-helix	trans	-89.7	-38.8	177.8	-67.8	170.5	-99.7	0	0	111.5	V704 S707 S773 I774 K780 E781	V704-Q777 HydrophobicContact CG1-CB 4.11Å; V704-Q777 HydrophobicContact CG2-CB 3.84Å; S707-Q777 PolarHBondContact OG-NE2 2.73Å; S773-Q777 PolarHBondContact O-N 3.37Å; S773-Q777 VanDerWaalsContact O-N 3.11Å; S773-Q777 PolarHBondContact O-OE1 3.44Å; S773-Q777 PolarHBondContact OG-OE1 3.22Å; I774-Q777 PolarHBondContact O-N 3.05Å; I774-Q777 VanDerWaalsContact O-N 3.08Å; Q777-K780 WeakPolarHBondContact O-CB 3.09Å; Q777-K780 PolarHBondContact O-N 3Å; Q777-E781 PolarHBondContact O-N 3.48Å
778	L	90.7	Very high	86.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-55.1	-41	-172	-168.9	62.3	0	0	0	115	A700 L701 V704 I774 K780 E781 L782 V792 I801 I803 I815	A700-L778 HydrophobicContact CB-CD1 3.8Å; L701-L778 HydrophobicContact CD2-CD1 3.96Å; L701-L778 HydrophobicContact CG-CD1 4.12Å; V704-L778 HydrophobicContact CG2-CB 4.42Å; V704-L778 HydrophobicContact CG2-CD1 4.24Å; I774-L778 VanDerWaalsContact O-CB 3.24Å; I774-L778 WeakPolarHBondContact O-CB 3.46Å; I774-L778 PolarHBondContact O-N 3.35Å; L778-K780 VanDerWaalsContact C-N 3.28Å; L778-K780 PolarHBondContact O-N 2.84Å; L778-E781 PolarHBondContact O-N 3.2Å; L778-L782 HydrophobicContact CG-CD1 4.07Å; L778-L782 WeakPolarHBondContact O-CB 3.25Å; L778-L782 VanDerWaalsContact O-CG 3.24Å; L778-L782 WeakPolarHBondContact O-CG 3.46Å; L778-L782 PolarHBondContact O-N 3.01Å; L778-V792 HydrophobicContact CD2-CG1 4.16Å; L778-I801 HydrophobicContact CD2-CG2 4.09Å; L778-I803 HydrophobicContact CD2-CD1 4.03Å; L778-I803 HydrophobicContact CD2-CG1 4.14Å; L778-I815 HydrophobicContact CD2-CD1 4.09Å
779	P	89.9	Confident	85.9	Confident	55 Å²	55	63.3 Å²	63.3	36%	0.357	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-33.7	174.5	-22.6	33.5	0	0	0	113.5	A775 S783 V792	A775-P779 WeakPolarHBondContact O-CD 3.15Å; P779-S783 PolarHBondContact O-N 3.49Å; P779-V792 HydrophobicContact CG-CB 4.01Å; P779-V792 HydrophobicContact CG-CG2 3.88Å
780	K	88.2	Confident	85.8	Confident	142 Å²	142	61.5 Å²	61.5	62%	0.617	31%	0.311	S	S	*	.	H	α-helix	trans	-68.8	-51.1	178.9	-53.6	-173	179.7	-169.8	0	109.8	Q777 L778 L782 S783 T784	Q777-K780 WeakPolarHBondContact O-CB 3.09Å; Q777-K780 PolarHBondContact O-N 3Å; L778-K780 VanDerWaalsContact C-N 3.28Å; L778-K780 PolarHBondContact O-N 2.84Å; K780-L782 VanDerWaalsContact C-N 3.29Å; K780-L782 PolarHBondContact O-N 2.75Å; K780-S783 PolarHBondContact O-N 3.44Å; K780-S783 VanDerWaalsContact O-N 3.14Å; K780-S783 PolarHBondContact O-OG 3Å; K780-T784 PolarHBondContact O-N 3.38Å; K780-T784 PolarHBondContact O-OG1 2.87Å
781	E	88.1	Confident	85.8	Confident	37 Å²	37	66.1 Å²	66.1	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-30	179.8	-52.4	-43.8	137.5	0	0	113.1	A700 L703 V704 Q777 L778 T784 F785	A700-E781 HydrophobicContact CB-CB 3.99Å; L703-E781 HydrophobicContact CB-CB 4.07Å; L703-E781 HydrophobicContact CB-CG 3.85Å; L703-E781 WeakPolarHBondContact CB-OE2 3.35Å; L703-E781 HydrophobicContact CD1-CB 4.45Å; L703-E781 WeakPolarHBondContact CD1-OE2 3.45Å; V704-E781 HydrophobicContact CG2-CB 4.32Å; V704-E781 HydrophobicContact CG2-CG 3.68Å; Q777-E781 PolarHBondContact O-N 3.48Å; L778-E781 PolarHBondContact O-N 3.2Å; E781-T784 WeakPolarHBondContact O-CB 3.38Å; E781-T784 PolarHBondContact O-N 3.25Å; E781-F785 WeakPolarHBondContact O-CD2 3.26Å
782	L	87.9	Confident	85.8	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.016	34%	0.341	C	S	.	.	H	α-helix	trans	-66.1	-40.2	172.4	-77.1	168.4	0	0	0	112.2	H696 A700 L778 K780 T784 F785 S786 Y790 V792 I803	H696-L782 HydrophobicContact CB-CD2 4.21Å; A700-L782 HydrophobicContact CB-CD2 3.68Å; A700-L782 HydrophobicContact CB-CG 3.8Å; L778-L782 HydrophobicContact CG-CD1 4.07Å; L778-L782 WeakPolarHBondContact O-CB 3.25Å; L778-L782 VanDerWaalsContact O-CG 3.24Å; L778-L782 WeakPolarHBondContact O-CG 3.46Å; L778-L782 PolarHBondContact O-N 3.01Å; K780-L782 VanDerWaalsContact C-N 3.29Å; K780-L782 PolarHBondContact O-N 2.75Å; L782-T784 PolarHBondContact O-N 2.85Å; L782-F785 PolarHBondContact O-N 2.7Å; L782-S786 PolarHBondContact O-N 2.82Å; L782-Y790 HydrophobicContact CB-CD2 4.02Å; L782-Y790 HydrophobicContact CD1-CD2 4.15Å; L782-Y790 HydrophobicContact CD1-CG 4.27Å; L782-Y790 HydrophobicContact CD2-CD2 4.02Å; L782-Y790 HydrophobicContact CD2-CE2 4.14Å; L782-Y790 HydrophobicContact CG-CD2 4.29Å; L782-V792 HydrophobicContact CD1-CG2 4.07Å; L782-I803 HydrophobicContact CD1-CD1 4.25Å; L782-I803 HydrophobicContact CD1-CG2 4.22Å
783	S	85.8	Confident	85.8	Confident	83 Å²	83	65.9 Å²	65.9	58%	0.58	34%	0.335	S	S	*	.	H	α-helix	trans	-62.6	-23.6	177.5	74.5	0	0	0	0	113.6	P779 K780 F785	P779-S783 PolarHBondContact O-N 3.49Å; K780-S783 PolarHBondContact O-N 3.44Å; K780-S783 VanDerWaalsContact O-N 3.14Å; K780-S783 PolarHBondContact O-OG 3Å; S783-F785 VanDerWaalsContact C-N 3.3Å; S783-F785 PolarHBondContact O-N 2.91Å
784	T	85.3	Confident	85.8	Confident	94 Å²	94	65.8 Å²	65.8	58%	0.577	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.8	173.6	-47.7	0	0	0	0	113.2	K780 E781 L782	K780-T784 PolarHBondContact O-N 3.38Å; K780-T784 PolarHBondContact O-OG1 2.87Å; E781-T784 WeakPolarHBondContact O-CB 3.38Å; E781-T784 PolarHBondContact O-N 3.25Å; L782-T784 PolarHBondContact O-N 2.85Å
785	F	80.7	Confident	85.7	Confident	66 Å²	66	69 Å²	69	29%	0.289	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-17.5	-176.2	-66.6	-63	0	0	0	114.5	R699 A700 L703 E781 L782 S783	R699-F785 HydrophobicContact CB-CD1 4.42Å; R699-F785 HydrophobicContact CB-CD2 4.06Å; R699-F785 HydrophobicContact CB-CE1 3.99Å; R699-F785 HydrophobicContact CB-CE2 3.6Å; R699-F785 HydrophobicContact CB-CG 4.46Å; R699-F785 HydrophobicContact CB-CZ 3.57Å; R699-F785 HydrophobicContact CG-CZ 4.49Å; A700-F785 HydrophobicContact CB-CD2 4.37Å; A700-F785 HydrophobicContact CB-CE2 4.42Å; L703-F785 HydrophobicContact CD1-CE2 3.59Å; L703-F785 HydrophobicContact CD1-CZ 3.54Å; L703-F785 HydrophobicContact CG-CE2 4.12Å; L703-F785 HydrophobicContact CG-CZ 4.02Å; E781-F785 WeakPolarHBondContact O-CD2 3.26Å; L782-F785 PolarHBondContact O-N 2.7Å; S783-F785 VanDerWaalsContact C-N 3.3Å; S783-F785 PolarHBondContact O-N 2.91Å
786	S	74.8	Confident	85.4	Confident	18 Å²	18	70.2 Å²	70.2	13%	0.126	36%	0.358	C	S	.	.			trans	-162.1	144	-178.8	54.5	0	0	0	0	112.2	L782 D788 Y790	L782-S786 PolarHBondContact O-N 2.82Å; S786-D788 PolarHBondContact O-N 2.58Å; S786-Y790 VanDerWaalsContact OG-CE2 3.3Å; S786-Y790 WeakPolarHBondContact OG-CE2 3.4Å
787	E	70.9	Confident	85.1	Confident	202 Å²	202	68.6 Å²	68.6	94%	0.944	36%	0.357	S	S	*	.	S	Bend	trans	-69.3	-7.6	167.6	-62.5	169.6	-165.5	0	0	112.6	Q789	E787-Q789 PolarHBondContact O-N 3.39Å
788	D	71.4	Confident	84.9	Confident	38 Å²	38	71.8 Å²	71.8	20%	0.203	37%	0.372	C	S	.	.	S	Bend	trans	-63.5	126.3	179	-66.8	-24.7	0	0	0	112	R692 S786 Y790 Q807	R692-D788 IonicContact NH1-OD2 3.82Å; S786-D788 PolarHBondContact O-N 2.58Å; D788-Y790 HydrophobicContact CB-CE2 4.23Å; D788-Y790 PolarHBondContact O-N 2.66Å; D788-Y790 VanDerWaalsContact O-N 3.1Å; D788-Q807 VanDerWaalsContact CG-NE2 3.27Å; D788-Q807 PolarHBondContact OD1-NE2 2.82Å; D788-Q807 PolarHBondContact OD2-NE2 3.24Å
789	Q	80.6	Confident	84.7	Confident	158 Å²	158	71.8 Å²	71.8	74%	0.738	37%	0.372	S	S	*	.			trans	-70.4	108.6	173.8	-62.4	-178.7	10.8	0	0	109.9	E787 S806	E787-Q789 PolarHBondContact O-N 3.39Å; Q789-S806 VanDerWaalsContact O-CB 3.26Å; Q789-S806 WeakPolarHBondContact O-CB 3.33Å; Q789-S806 PolarHBondContact O-N 3.2Å; Q789-S806 PolarHBondContact O-OG 2.81Å
790	Y	86.5	Confident	84.9	Confident	30 Å²	30	69.7 Å²	69.7	12%	0.118	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.3	167.9	-68.7	-65	0	0	0	110.2	I693 H696 L782 S786 D788 I803 C804	I693-Y790 HydrophobicContact CD1-CD1 4.47Å; I693-Y790 HydrophobicContact CD1-CE1 4.02Å; I693-Y790 HydrophobicContact CG1-CE1 3.86Å; H696-Y790 HydrophobicContact CB-CE2 4.48Å; H696-Y790 AromaticContact ND1-CE2 4Å; H696-Y790 AromaticContact ND1-CZ 3.94Å; H696-Y790 PolarHBondContact ND1-OH 2.75Å; L782-Y790 HydrophobicContact CB-CD2 4.02Å; L782-Y790 HydrophobicContact CD1-CD2 4.15Å; L782-Y790 HydrophobicContact CD1-CG 4.27Å; L782-Y790 HydrophobicContact CD2-CD2 4.02Å; L782-Y790 HydrophobicContact CD2-CE2 4.14Å; L782-Y790 HydrophobicContact CG-CD2 4.29Å; S786-Y790 VanDerWaalsContact OG-CE2 3.3Å; S786-Y790 WeakPolarHBondContact OG-CE2 3.4Å; D788-Y790 HydrophobicContact CB-CE2 4.23Å; D788-Y790 PolarHBondContact O-N 2.66Å; D788-Y790 VanDerWaalsContact O-N 3.1Å; Y790-I803 HydrophobicContact CD1-CG2 3.79Å; Y790-I803 HydrophobicContact CG-CG2 4.04Å; Y790-C804 WeakPolarHBondContact CA-O 3.34Å
791	E	88.1	Confident	85.1	Confident	113 Å²	113	62.9 Å²	62.9	53%	0.528	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	134.2	168.3	-169.6	-173.4	164.1	0	0	109	Q793 I803 C804	E791-Q793 HydrophobicContact CG-CG 4.47Å; E791-Q793 PolarHBondContact OE1-NE2 2.96Å; E791-I803 CarbonylContact O-C 3.58Å; E791-I803 WeakPolarHBondContact O-CA 3.43Å; E791-C804 HydrophobicContact CB-CB 4.29Å; E791-C804 PolarHBondContact N-O 3.39Å; E791-C804 PolarHBondContact O-N 3.03Å
792	V	91.1	Very high	85.4	Confident	32 Å²	32	61.5 Å²	61.5	19%	0.194	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.2	179.8	-177.5	0	0	0	0	109.6	L778 P779 L782 I801 V802 I803	L778-V792 HydrophobicContact CD2-CG1 4.16Å; P779-V792 HydrophobicContact CG-CB 4.01Å; P779-V792 HydrophobicContact CG-CG2 3.88Å; L782-V792 HydrophobicContact CD1-CG2 4.07Å; V792-I801 HydrophobicContact CG1-CG2 3.63Å; V792-V802 CarbonylContact C-O 3.59Å; V792-V802 WeakPolarHBondContact CA-O 3.34Å; V792-I803 HydrophobicContact CG2-CG1 4.4Å
793	Q	89.8	Confident	85.6	Confident	78 Å²	78	61.3 Å²	61.3	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.6	175.7	-59.8	-174.7	4.9	0	0	110	E791 I801 V802	E791-Q793 HydrophobicContact CG-CG 4.47Å; E791-Q793 PolarHBondContact OE1-NE2 2.96Å; Q793-I801 CarbonylContact O-C 3.57Å; Q793-I801 WeakPolarHBondContact O-CA 3.32Å; Q793-I801 WeakPolarHBondContact O-CG2 3.26Å; Q793-V802 HydrophobicContact CB-CB 4.43Å; Q793-V802 PolarHBondContact N-O 3.29Å; Q793-V802 PolarHBondContact O-N 2.96Å
794	A	89.7	Confident	85.9	Confident	42 Å²	42	59 Å²	59	35%	0.347	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	116.6	-174.3	0	0	0	0	0	110.6	L771 A775 P796	L771-A794 HydrophobicContact CD2-CB 3.84Å; A775-A794 HydrophobicContact CB-CB 3.75Å; A794-P796 WeakPolarHBondContact O-CD 3.38Å
795	H	89.2	Confident	86	Confident	68 Å²	68	55.1 Å²	55.1	32%	0.315	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	99.5	-176	-53.3	-74.9	0	0	0	109.6	D797 E798 A799 N800	H795-D797 VanDerWaalsContact C-N 3.33Å; H795-D797 PolarHBondContact O-N 3.35Å; H795-E798 HydrophobicContact CB-CB 4.24Å; H795-E798 HydrophobicContact CB-CG 4.43Å; H795-E798 PolarHBondContact O-N 3.24Å; H795-A799 PolarHBondContact O-N 3.02Å; H795-N800 PolarHBondContact CD2-OD1 2.74Å; H795-N800 PolarHBondContact N-O 2.95Å; H795-N800 PolarHBondContact O-N 3.17Å
796	P	84.6	Confident	86.2	Confident	41 Å²	41	54.9 Å²	54.9	27%	0.266	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-36.9	-175.1	28.1	-35	0	0	0	112.1	V768 A794 E798 A799	V768-P796 HydrophobicContact CG1-CB 3.78Å; V768-P796 HydrophobicContact CG2-CB 4.25Å; A794-P796 WeakPolarHBondContact O-CD 3.38Å; P796-E798 PolarHBondContact O-N 3.42Å; P796-A799 PolarHBondContact O-N 3.14Å; P796-A799 VanDerWaalsContact O-N 3.11Å
797	D	85.6	Confident	86.4	Confident	126 Å²	126	57.1 Å²	57.1	67%	0.674	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-27.9	-175.9	-45.1	-58.7	0	0	0	112.8	H795 N853	H795-D797 VanDerWaalsContact C-N 3.33Å; H795-D797 PolarHBondContact O-N 3.35Å; D797-N853 PolarHBondContact O-ND2 2.82Å
798	E	83.8	Confident	86.8	Confident	82 Å²	82	55 Å²	55	38%	0.383	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-5.9	177.5	-63.4	-128.5	112.2	0	0	113.9	H795 P796 N800 K856	H795-E798 HydrophobicContact CB-CB 4.24Å; H795-E798 HydrophobicContact CB-CG 4.43Å; H795-E798 PolarHBondContact O-N 3.24Å; P796-E798 PolarHBondContact O-N 3.42Å; E798-N800 VanDerWaalsContact C-N 3.27Å; E798-N800 VanDerWaalsContact CB-ND2 3.29Å; E798-N800 WeakPolarHBondContact CB-ND2 3.29Å; E798-N800 PolarHBondContact O-N 3.16Å; E798-N800 PolarHBondContact OE2-ND2 3.06Å; E798-K856 IonicContact OE1-NZ 2.61Å; E798-K856 PolarHBondContact OE1-NZ 2.96Å
799	A	87.8	Confident	87.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	31.8	-172.2	0	0	0	0	0	114.3	H795 P796 L817 L852 K856	H795-A799 PolarHBondContact O-N 3.02Å; P796-A799 PolarHBondContact O-N 3.14Å; P796-A799 VanDerWaalsContact O-N 3.11Å; A799-L817 PolarHBondContact O-N 3.45Å; A799-L852 HydrophobicContact CB-CB 3.93Å; A799-L852 HydrophobicContact CB-CD1 3.8Å; A799-L852 HydrophobicContact CB-CG 4.3Å; A799-K856 HydrophobicContact CB-CB 4.33Å
800	N	92.1	Very high	87.6	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.053	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.5	-175.6	74.2	37.9	0	0	0	114.8	H795 E798 T814 I815	H795-N800 PolarHBondContact CD2-OD1 2.74Å; H795-N800 PolarHBondContact N-O 2.95Å; H795-N800 PolarHBondContact O-N 3.17Å; E798-N800 VanDerWaalsContact C-N 3.27Å; E798-N800 VanDerWaalsContact CB-ND2 3.29Å; E798-N800 WeakPolarHBondContact CB-ND2 3.29Å; E798-N800 PolarHBondContact O-N 3.16Å; E798-N800 PolarHBondContact OE2-ND2 3.06Å; N800-T814 HydrophobicContact CB-CG2 3.8Å; N800-I815 CarbonylContact C-O 3.56Å; N800-I815 WeakPolarHBondContact CA-O 3.3Å
801	I	93.7	Very high	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	172.6	-58.4	175.2	0	0	0	107.1	L771 I774 A775 L778 V792 Q793 I815 L817	L771-I801 HydrophobicContact CD2-CD1 4.44Å; L771-I801 HydrophobicContact CD2-CG1 3.96Å; L771-I801 HydrophobicContact CG-CD1 4.14Å; L771-I801 HydrophobicContact CG-CG1 3.89Å; I774-I801 HydrophobicContact CB-CD1 3.97Å; I774-I801 HydrophobicContact CG2-CD1 3.56Å; A775-I801 HydrophobicContact CB-CD1 4.28Å; L778-I801 HydrophobicContact CD2-CG2 4.09Å; V792-I801 HydrophobicContact CG1-CG2 3.63Å; Q793-I801 CarbonylContact O-C 3.57Å; Q793-I801 WeakPolarHBondContact O-CA 3.32Å; Q793-I801 WeakPolarHBondContact O-CG2 3.26Å; I801-I815 HydrophobicContact CB-CB 4.46Å; I801-I815 PolarHBondContact N-O 3.38Å; I801-I815 PolarHBondContact O-N 3.45Å; I801-L817 HydrophobicContact CD1-CD1 4.1Å; I801-L817 HydrophobicContact CG1-CD1 4.21Å
802	V	93.7	Very high	88.1	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125	-178.6	170.6	0	0	0	0	109.3	V792 Q793 Q812 T814	V792-V802 CarbonylContact C-O 3.59Å; V792-V802 WeakPolarHBondContact CA-O 3.34Å; Q793-V802 HydrophobicContact CB-CB 4.43Å; Q793-V802 PolarHBondContact N-O 3.29Å; Q793-V802 PolarHBondContact O-N 2.96Å; V802-Q812 HydrophobicContact CG1-CG 3.66Å; V802-Q812 VanDerWaalsContact CG1-NE2 3.28Å; V802-T814 HydrophobicContact CG2-CG2 4.3Å
803	I	92.9	Very high	88.3	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.4	168.5	-52.9	169	0	0	0	108.3	I693 S697 L778 L782 Y790 E791 V792 Q812 V813 I815	I693-I803 HydrophobicContact CD1-CG2 4.47Å; S697-I803 VanDerWaalsContact OG-CD1 3.31Å; S697-I803 WeakPolarHBondContact OG-CD1 3.43Å; L778-I803 HydrophobicContact CD2-CD1 4.03Å; L778-I803 HydrophobicContact CD2-CG1 4.14Å; L782-I803 HydrophobicContact CD1-CD1 4.25Å; L782-I803 HydrophobicContact CD1-CG2 4.22Å; Y790-I803 HydrophobicContact CD1-CG2 3.79Å; Y790-I803 HydrophobicContact CG-CG2 4.04Å; E791-I803 CarbonylContact O-C 3.58Å; E791-I803 WeakPolarHBondContact O-CA 3.43Å; V792-I803 HydrophobicContact CG2-CG1 4.4Å; I803-Q812 CarbonylContact O-C 3.52Å; I803-Q812 WeakPolarHBondContact O-CA 3.34Å; I803-V813 HydrophobicContact CB-CB 4.46Å; I803-V813 PolarHBondContact N-O 2.95Å; I803-V813 PolarHBondContact O-N 3.44Å; I803-I815 HydrophobicContact CD1-CD1 3.52Å; I803-I815 HydrophobicContact CG1-CD1 4.04Å
804	C	90.8	Very high	88.5	Confident	33 Å²	33	45.4 Å²	45.4	22%	0.223	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.8	172.7	-69.8	0	0	0	0	110.5	Y790 E791	Y790-C804 WeakPolarHBondContact CA-O 3.34Å; E791-C804 HydrophobicContact CB-CB 4.29Å; E791-C804 PolarHBondContact N-O 3.39Å; E791-C804 PolarHBondContact O-N 3.03Å
805	S	89.3	Confident	88.8	Confident	13 Å²	13	43.4 Å²	43.4	9%	0.091	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	130	172	-172.2	0	0	0	0	111.3	Q807 M811	S805-Q807 PolarHBondContact OG-N 3.43Å; S805-M811 PolarHBondContact N-O 3.35Å
806	S	83.3	Confident	89	Confident	62 Å²	62	40.9 Å²	40.9	43%	0.434	22%	0.215	S	C	.	.	S	Bend	trans	-70.2	-29.7	169.1	54.8	0	0	0	0	113.5	Q789	Q789-S806 VanDerWaalsContact O-CB 3.26Å; Q789-S806 WeakPolarHBondContact O-CB 3.33Å; Q789-S806 PolarHBondContact O-N 3.2Å; Q789-S806 PolarHBondContact O-OG 2.81Å
807	Q	80.1	Confident	89.3	Confident	65 Å²	65	38.9 Å²	38.9	30%	0.304	20%	0.203	S	C	.	.	S	Bend	trans	-60.9	142.8	176.2	-72.1	-156.2	-8.1	0	0	111.2	R692 D788 S805 P809 K810	R692-Q807 VanDerWaalsContact CZ-OE1 3.28Å; D788-Q807 VanDerWaalsContact CG-NE2 3.27Å; D788-Q807 PolarHBondContact OD1-NE2 2.82Å; D788-Q807 PolarHBondContact OD2-NE2 3.24Å; S805-Q807 PolarHBondContact OG-N 3.43Å; Q807-P809 CarbonylContact O-C 3.57Å; Q807-K810 VanDerWaalsContact O-CA 3.31Å; Q807-K810 WeakPolarHBondContact O-CA 3.45Å; Q807-K810 PolarHBondContact O-N 2.89Å
808	E	78.1	Confident	89.7	Confident	157 Å²	157	32.9 Å²	32.9	73%	0.734	17%	0.17	S	C	*	.	S	Bend	trans	-84	138.6	168.4	-58	-158.3	145.5	0	0	111
809	P	83.1	Confident	90	Very high	36 Å²	36	29 Å²	29	23%	0.234	15%	0.152	C	C	.	.	S	Bend	cis	-71	131.3	-6.1	29.7	-34.8	0	0	0	112.4	A689 Q807 M811	A689-P809 HydrophobicContact CB-CG 4.12Å; Q807-P809 CarbonylContact O-C 3.57Å; P809-M811 HydrophobicContact CB-CE 3.93Å; P809-M811 HydrophobicContact CG-CE 3.82Å; P809-M811 PolarHBondContact O-N 2.75Å
810	K	87.3	Confident	89.9	Confident	129 Å²	129	31.2 Å²	31.2	56%	0.561	17%	0.166	S	C	*	.			trans	-61.3	100.8	-176.2	-62.6	-177.2	-177.4	-179.2	0	111.6	R754 Q807	R754-K810 WeakPolarHBondContact CD-O 3.35Å; Q807-K810 VanDerWaalsContact O-CA 3.31Å; Q807-K810 WeakPolarHBondContact O-CA 3.45Å; Q807-K810 PolarHBondContact O-N 2.89Å
811	M	90.7	Very high	89.5	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.025	18%	0.178	C	C	.	.			trans	-87.8	143.9	177.7	-70.3	-64.9	124.3	0	0	111.6	A689 V690 I693 S805 P809	A689-M811 HydrophobicContact CB-CG 3.95Å; V690-M811 HydrophobicContact CG2-SD 3.54Å; V690-M811 VanDerWaalsContact CG2-SD 3.54Å; I693-M811 HydrophobicContact CD1-CB 3.83Å; I693-M811 HydrophobicContact CG2-CB 3.96Å; I693-M811 HydrophobicContact CG2-CG 4.33Å; S805-M811 PolarHBondContact N-O 3.35Å; P809-M811 HydrophobicContact CB-CE 3.93Å; P809-M811 HydrophobicContact CG-CE 3.82Å; P809-M811 PolarHBondContact O-N 2.75Å
812	Q	93.4	Very high	88.9	Confident	55 Å²	55	33.5 Å²	33.5	26%	0.257	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.7	175.3	-173.9	-178.7	-6.3	0	0	109.7	R754 N755 V756 V802 I803	R754-Q812 PolarHBondContact O-N 2.87Å; N755-Q812 CarbonylContact C-O 3.57Å; N755-Q812 WeakPolarHBondContact CA-O 3.38Å; N755-Q812 PolarHBondContact ND2-OE1 3.36Å; N755-Q812 PolarHBondContact OD1-OE1 3.36Å; V756-Q812 PolarHBondContact N-O 3.05Å; V802-Q812 HydrophobicContact CG1-CG 3.66Å; V802-Q812 VanDerWaalsContact CG1-NE2 3.28Å; I803-Q812 CarbonylContact O-C 3.52Å; I803-Q812 WeakPolarHBondContact O-CA 3.34Å
813	V	94.7	Very high	88.2	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.4	172.5	170.2	0	0	0	0	109.4	I693 V694 V756 L758 I803 I815	I693-V813 HydrophobicContact CB-CG2 4.35Å; I693-V813 HydrophobicContact CD1-CB 4.39Å; I693-V813 HydrophobicContact CD1-CG2 3.85Å; I693-V813 HydrophobicContact CG1-CG2 3.83Å; I693-V813 HydrophobicContact CG2-CG2 3.71Å; V694-V813 HydrophobicContact CG2-CG2 4.33Å; V756-V813 HydrophobicContact CB-CG2 4.1Å; V756-V813 HydrophobicContact CG1-CG2 4.23Å; V756-V813 CarbonylContact O-C 3.49Å; V756-V813 WeakPolarHBondContact O-CA 3.46Å; L758-V813 HydrophobicContact CD1-CG1 3.65Å; L758-V813 HydrophobicContact CG-CG1 3.96Å; I803-V813 HydrophobicContact CB-CB 4.46Å; I803-V813 PolarHBondContact N-O 2.95Å; I803-V813 PolarHBondContact O-N 3.44Å; V813-I815 HydrophobicContact CG1-CG1 4.09Å
814	T	95.1	Very high	87	Confident	23 Å²	23	41.5 Å²	41.5	14%	0.141	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.1	174.9	-55.7	0	0	0	0	109.4	V756 L758 N800 V802	V756-T814 PolarHBondContact O-N 3.17Å; L758-T814 PolarHBondContact N-O 3.3Å; N800-T814 HydrophobicContact CB-CG2 3.8Å; V802-T814 HydrophobicContact CG2-CG2 4.3Å
815	I	95.1	Very high	85.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	103.7	177.8	-60.1	153.9	0	0	0	108.1	L701 L758 L760 L778 N800 I801 I803 V813	L701-I815 HydrophobicContact CD1-CD1 3.83Å; L701-I815 HydrophobicContact CD1-CG1 4.16Å; L701-I815 HydrophobicContact CD1-CG2 4.11Å; L701-I815 HydrophobicContact CD2-CD1 4.35Å; L701-I815 HydrophobicContact CG-CD1 4.37Å; L758-I815 HydrophobicContact CB-CG1 4.27Å; L758-I815 HydrophobicContact CD1-CG1 4.39Å; L758-I815 WeakPolarHBondContact O-CA 3.43Å; L760-I815 HydrophobicContact CB-CG2 3.94Å; L778-I815 HydrophobicContact CD2-CD1 4.09Å; N800-I815 CarbonylContact C-O 3.56Å; N800-I815 WeakPolarHBondContact CA-O 3.3Å; I801-I815 HydrophobicContact CB-CB 4.46Å; I801-I815 PolarHBondContact N-O 3.38Å; I801-I815 PolarHBondContact O-N 3.45Å; I803-I815 HydrophobicContact CD1-CD1 3.52Å; I803-I815 HydrophobicContact CG1-CD1 4.04Å; V813-I815 HydrophobicContact CG1-CG1 4.09Å
816	S	93.6	Very high	84	Confident	14 Å²	14	43.5 Å²	43.5	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.1	175.7	-75.8	0	0	0	0	111.8	L758 I759 L760 N860	L758-S816 PolarHBondContact O-N 3.47Å; I759-S816 CarbonylContact C-O 3.5Å; I759-S816 WeakPolarHBondContact CA-O 3.21Å; L760-S816 PolarHBondContact N-O 3.41Å; S816-N860 WeakPolarHBondContact CB-ND2 3.39Å; S816-N860 WeakPolarHBondContact CB-OD1 3.34Å; S816-N860 PolarHBondContact OG-ND2 2.96Å; S816-N860 PolarHBondContact OG-OD1 3.06Å
817	L	92.5	Very high	82.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.9	175.9	-78.4	73.1	0	0	0	110.9	L760 P766 L771 I774 A799 I801 L852 C857	L760-L817 HydrophobicContact CB-CG 4.49Å; L760-L817 HydrophobicContact CD2-CG 4.26Å; P766-L817 HydrophobicContact CB-CB 4.21Å; L771-L817 HydrophobicContact CB-CD2 4Å; L771-L817 HydrophobicContact CD1-CD1 4.27Å; L771-L817 HydrophobicContact CD1-CD2 4.42Å; L771-L817 HydrophobicContact CG-CD1 4.37Å; L771-L817 HydrophobicContact CG-CD2 4.28Å; I774-L817 HydrophobicContact CD1-CD2 4.03Å; A799-L817 PolarHBondContact O-N 3.45Å; I801-L817 HydrophobicContact CD1-CD1 4.1Å; I801-L817 HydrophobicContact CG1-CD1 4.21Å; L817-L852 HydrophobicContact CB-CD1 3.89Å; L817-L852 HydrophobicContact CD2-CD1 4.33Å; L817-C857 PolarHBondContact O-SG 2.81Å; L817-C857 VanDerWaalsContact O-SG 3.41Å
818	T	92.8	Very high	81.6	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	167	171	-164.4	0	0	0	0	112.3	I759 L760 L761 T762 C857 N860 L861	I759-T818 HydrophobicContact CG2-CG2 3.67Å; L760-T818 PolarHBondContact O-N 3.43Å; L761-T818 HydrophobicContact CD2-CG2 3.91Å; T762-T818 PolarHBondContact N-O 3.44Å; T762-T818 VanDerWaalsContact OG1-C 3.32Å; T762-T818 PolarHBondContact OG1-O 3.44Å; T818-C857 PolarHBondContact OG1-O 3.33Å; T818-N860 HydrophobicContact CG2-CB 4.36Å; T818-L861 HydrophobicContact CG2-CD2 3.67Å; T818-L861 HydrophobicContact CG2-CG 3.86Å; T818-L861 WeakPolarHBondContact OG1-CG 3.45Å
819	S	89.9	Confident	80.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.			trans	-135.8	139.8	176	-175.7	0	0	0	0	110	T762 A763 K764 L821 M822	T762-S819 PolarHBondContact O-OG 2.99Å; T762-S819 WeakPolarHBondContact OG1-CB 3.41Å; A763-S819 PolarHBondContact O-OG 3.08Å; K764-S819 WeakPolarHBondContact O-CB 3.38Å; K764-S819 PolarHBondContact O-OG 3.42Å; S819-L821 PolarHBondContact O-N 3.09Å; S819-L821 VanDerWaalsContact O-N 3.17Å; S819-M822 WeakPolarHBondContact O-CB 3.49Å; S819-M822 VanDerWaalsContact O-CG 3.31Å; S819-M822 WeakPolarHBondContact O-CG 3.46Å; S819-M822 PolarHBondContact O-N 3.37Å
820	P	87.2	Confident	79.2	Confident	46 Å²	46	41.3 Å²	41.3	30%	0.299	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-34.7	174.2	-26.5	35.6	0	0	0	113.8	M822 R823	P820-M822 PolarHBondContact O-N 3.03Å; P820-M822 VanDerWaalsContact O-N 3.15Å; P820-R823 WeakPolarHBondContact O-CB 3.44Å; P820-R823 PolarHBondContact O-N 3.09Å
821	L	83.6	Confident	77.7	Confident	55 Å²	55	40.4 Å²	40.4	29%	0.288	21%	0.214	S	C	.	.	H	α-helix	trans	-55.3	-34.8	-178.1	-55.9	-177.6	0	0	0	112.8	A763 K765 S819 R823 E824 D825	A763-L821 WeakPolarHBondContact O-CD1 3.46Å; K765-L821 HydrophobicContact CG-CB 4.31Å; S819-L821 PolarHBondContact O-N 3.09Å; S819-L821 VanDerWaalsContact O-N 3.17Å; L821-R823 PolarHBondContact O-N 3.37Å; L821-E824 VanDerWaalsContact CD2-OE2 3.32Å; L821-E824 WeakPolarHBondContact CD2-OE2 3.4Å; L821-E824 PolarHBondContact O-N 3.48Å; L821-D825 PolarHBondContact O-N 3.28Å; L821-D825 VanDerWaalsContact O-OD2 3.09Å
822	M	80.1	Confident	76	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-54.9	-21.1	179	-58.4	-61.6	-68.1	0	0	113.7	K765 S819 P820 D825 V851 R854 C857 L861	K765-M822 HydrophobicContact CB-SD 3.8Å; K765-M822 HydrophobicContact CD-SD 4.04Å; K765-M822 HydrophobicContact CG-SD 3.68Å; S819-M822 WeakPolarHBondContact O-CB 3.49Å; S819-M822 VanDerWaalsContact O-CG 3.31Å; S819-M822 WeakPolarHBondContact O-CG 3.46Å; S819-M822 PolarHBondContact O-N 3.37Å; P820-M822 PolarHBondContact O-N 3.03Å; P820-M822 VanDerWaalsContact O-N 3.15Å; M822-D825 WeakPolarHBondContact CA-OD2 3.33Å; M822-V851 HydrophobicContact CE-CG1 3.92Å; M822-V851 HydrophobicContact SD-CG1 4.39Å; M822-R854 HydrophobicContact CE-CB 4.01Å; M822-R854 HydrophobicContact CE-CG 3.98Å; M822-C857 HydrophobicContact CE-CB 4.16Å; M822-C857 HydrophobicContact CG-CB 4.25Å; M822-L861 HydrophobicContact CB-CD1 4.47Å
823	R	78.6	Confident	73.9	Confident	61 Å²	61	53.1 Å²	53.1	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-96.9	-28	177.3	-167.9	-178.9	-173.4	83.1	5.4	113.2	P820 L821 D825 T826 A827 L858 L861 R865 E950	P820-R823 WeakPolarHBondContact O-CB 3.44Å; P820-R823 PolarHBondContact O-N 3.09Å; L821-R823 PolarHBondContact O-N 3.37Å; R823-D825 VanDerWaalsContact C-N 3.33Å; R823-T826 WeakPolarHBondContact CA-OG1 3.43Å; R823-T826 PolarHBondContact O-N 2.92Å; R823-T826 PolarHBondContact O-OG1 3.39Å; R823-A827 PolarHBondContact O-N 3.09Å; R823-L858 HydrophobicContact CB-CD2 4.1Å; R823-L858 HydrophobicContact CG-CD2 4.37Å; R823-L861 HydrophobicContact CB-CD1 4.35Å; R823-R865 VanDerWaalsContact NH1-CZ 3.31Å; R823-E950 IonicContact CZ-OE2 2.78Å; R823-E950 IonicContact NH1-OE2 3.88Å; R823-E950 PolarHBondContact NH1-OE2 2.94Å; R823-E950 IonicContact NH2-OE2 3.19Å; R823-E950 PolarHBondContact NH2-OE2 3.17Å
824	E	67.5	Low	71.5	Confident	114 Å²	114	57.3 Å²	57.3	53%	0.533	31%	0.306	S	S	.	.	H	α-helix	trans	-69.4	-36.9	178.8	-71.6	159.2	-158.8	0	0	109.8	L821 T826 A827 A828	L821-E824 VanDerWaalsContact CD2-OE2 3.32Å; L821-E824 WeakPolarHBondContact CD2-OE2 3.4Å; L821-E824 PolarHBondContact O-N 3.48Å; E824-T826 VanDerWaalsContact C-N 3.33Å; E824-T826 PolarHBondContact O-N 3.36Å; E824-A827 PolarHBondContact O-N 3.06Å; E824-A827 VanDerWaalsContact O-N 3.1Å; E824-A828 PolarHBondContact O-N 3.11Å
825	D	58.7	Low	69	Low	41 Å²	41	64 Å²	64	22%	0.219	34%	0.335	C	S	.	.	H	α-helix	trans	-52.7	-46.2	168.3	-55.7	-57.1	0	0	0	112.5	K765 L821 M822 R823 A827 A828 E829	K765-D825 WeakPolarHBondContact CE-OD1 3.26Å; K765-D825 WeakPolarHBondContact CE-OD2 3.43Å; K765-D825 IonicContact NZ-OD1 2.74Å; K765-D825 PolarHBondContact NZ-OD1 2.89Å; K765-D825 IonicContact NZ-OD2 3.21Å; K765-D825 PolarHBondContact NZ-OD2 3.25Å; L821-D825 PolarHBondContact O-N 3.28Å; L821-D825 VanDerWaalsContact O-OD2 3.09Å; M822-D825 WeakPolarHBondContact CA-OD2 3.33Å; R823-D825 VanDerWaalsContact C-N 3.33Å; D825-A827 PolarHBondContact O-N 3.05Å; D825-A828 PolarHBondContact O-N 3.38Å; D825-E829 WeakPolarHBondContact O-CB 3.47Å; D825-E829 WeakPolarHBondContact O-CG 3.42Å; D825-E829 PolarHBondContact O-N 3.21Å
826	T	58.7	Low	66.4	Low	47 Å²	47	67.4 Å²	67.4	29%	0.288	37%	0.371	S	S	.	.	H	α-helix	trans	-68.9	-19.4	-179.1	33.8	0	0	0	0	114	R823 E824 K830 R854 L858	R823-T826 WeakPolarHBondContact CA-OG1 3.43Å; R823-T826 PolarHBondContact O-N 2.92Å; R823-T826 PolarHBondContact O-OG1 3.39Å; E824-T826 VanDerWaalsContact C-N 3.33Å; E824-T826 PolarHBondContact O-N 3.36Å; T826-K830 WeakPolarHBondContact O-CG 3.24Å; T826-R854 VanDerWaalsContact CG2-NH2 3.31Å; T826-L858 HydrophobicContact CG2-CD1 4.44Å
827	A	57.4	Low	64.2	Low	35 Å²	35	77.2 Å²	77.2	29%	0.289	41%	0.412	S	S	.	.	H	α-helix	trans	-79.7	-53.8	169.2	0	0	0	0	0	109.5	R823 E824 D825 E829 K830 D831	R823-A827 PolarHBondContact O-N 3.09Å; E824-A827 PolarHBondContact O-N 3.06Å; E824-A827 VanDerWaalsContact O-N 3.1Å; D825-A827 PolarHBondContact O-N 3.05Å; A827-E829 VanDerWaalsContact C-N 3.28Å; A827-E829 PolarHBondContact O-N 3.03Å; A827-K830 PolarHBondContact O-N 3Å; A827-D831 PolarHBondContact O-N 3.18Å
828	A	56	Low	61.6	Low	41 Å²	41	82 Å²	82	34%	0.339	45%	0.452	S	S	.	.	H	α-helix	trans	-58.7	-33.8	-178.7	0	0	0	0	0	113.7	E824 D825 K832	E824-A828 PolarHBondContact O-N 3.11Å; D825-A828 PolarHBondContact O-N 3.38Å; A828-K832 VanDerWaalsContact O-CB 3.25Å; A828-K832 WeakPolarHBondContact O-CB 3.4Å; A828-K832 WeakPolarHBondContact O-CD 3.34Å; A828-K832 WeakPolarHBondContact O-CG 3.37Å; A828-K832 PolarHBondContact O-N 3.34Å
829	E	55.4	Low	58.9	Low	98 Å²	98	87 Å²	87	46%	0.458	49%	0.493	S	S	.	.	H	α-helix	trans	-73.5	-31.8	174.6	-74.6	-177.3	127.5	0	0	113.2	D825 A827 Q833 R854	D825-E829 WeakPolarHBondContact O-CB 3.47Å; D825-E829 WeakPolarHBondContact O-CG 3.42Å; D825-E829 PolarHBondContact O-N 3.21Å; A827-E829 VanDerWaalsContact C-N 3.28Å; A827-E829 PolarHBondContact O-N 3.03Å; E829-Q833 WeakPolarHBondContact O-CG 3.28Å; E829-Q833 PolarHBondContact O-N 2.76Å; E829-R854 IonicContact OE1-NH1 2.72Å; E829-R854 IonicContact OE2-CZ 2.74Å; E829-R854 VanDerWaalsContact OE2-CZ 3.22Å; E829-R854 IonicContact OE2-NH1 3.41Å; E829-R854 PolarHBondContact OE2-NH1 2.81Å; E829-R854 IonicContact OE2-NH2 2.65Å; E829-R854 PolarHBondContact OE2-NH2 2.96Å
830	K	56.2	Low	56.8	Low	100 Å²	100	95.9 Å²	95.9	44%	0.435	54%	0.535	S	S	.	.	H	α-helix	trans	-74	-41.4	175	-76.4	-171.9	177.2	-170.2	0	111.5	T826 A827 K832 Q833 A834 E952	T826-K830 WeakPolarHBondContact O-CG 3.24Å; A827-K830 PolarHBondContact O-N 3Å; K830-K832 VanDerWaalsContact C-N 3.33Å; K830-K832 PolarHBondContact O-N 3.49Å; K830-Q833 PolarHBondContact O-N 3.04Å; K830-A834 PolarHBondContact O-N 2.76Å; K830-A834 VanDerWaalsContact O-N 3.12Å; K830-E952 IonicContact NZ-OE1 2.73Å; K830-E952 PolarHBondContact NZ-OE1 3.27Å; K830-E952 IonicContact NZ-OE2 2.82Å; K830-E952 PolarHBondContact NZ-OE2 2.7Å
831	D	55.5	Low	54.5	Low	110 Å²	110	102.3 Å²	102.3	59%	0.588	56%	0.558	S	S	*	*	H	α-helix	trans	-61.7	-43.5	174.8	-59.6	-30.5	0	0	0	110.2	A827 Q833 A834 E835	A827-D831 PolarHBondContact O-N 3.18Å; D831-Q833 PolarHBondContact O-N 2.8Å; D831-A834 PolarHBondContact O-N 2.92Å; D831-A834 VanDerWaalsContact O-N 3.1Å; D831-E835 PolarHBondContact O-N 3.22Å
832	K	53.3	Low	52.1	Low	158 Å²	158	106.6 Å²	106.6	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-68.7	-5.9	172.9	-72.2	172.8	-177	-178.4	0	115.6	A828 K830	A828-K832 VanDerWaalsContact O-CB 3.25Å; A828-K832 WeakPolarHBondContact O-CB 3.4Å; A828-K832 WeakPolarHBondContact O-CD 3.34Å; A828-K832 WeakPolarHBondContact O-CG 3.37Å; A828-K832 PolarHBondContact O-N 3.34Å; K830-K832 VanDerWaalsContact C-N 3.33Å; K830-K832 PolarHBondContact O-N 3.49Å
833	Q	49.6	Very low	50.1	Low	169 Å²	169	114.8 Å²	114.8	79%	0.79	62%	0.624	S	S	*	*	H	α-helix	trans	-101	-17.8	169.5	-78.1	-177.1	-0.2	0	0	112.8	E829 K830 D831	E829-Q833 WeakPolarHBondContact O-CG 3.28Å; E829-Q833 PolarHBondContact O-N 2.76Å; K830-Q833 PolarHBondContact O-N 3.04Å; D831-Q833 PolarHBondContact O-N 2.8Å
834	A	45.9	Very low	48.3	Very low	88 Å²	88	116.7 Å²	116.7	73%	0.727	65%	0.646	S	S	*	*	H	α-helix	trans	-80.5	-35.5	174.3	0	0	0	0	0	112.2	K830 D831	K830-A834 PolarHBondContact O-N 2.76Å; K830-A834 VanDerWaalsContact O-N 3.12Å; D831-A834 PolarHBondContact O-N 2.92Å; D831-A834 VanDerWaalsContact O-N 3.1Å
835	E	42.6	Very low	47.4	Very low	163 Å²	163	118.6 Å²	118.6	76%	0.762	66%	0.656	S	S	*	*	S	Bend	trans	-97.4	126.5	176.2	-63.4	-169.3	145.3	0	0	111.7	D831	D831-E835 PolarHBondContact O-N 3.22Å
836	G	39.8	Very low	47.2	Very low	73 Å²	73	126 Å²	126	75%	0.753	69%	0.686	S	S	*	*			trans	-70.9	149	-174.8	0	0	0	0	0	114.2	A838	G836-A838 PolarHBondContact O-N 3.4Å; G836-A838 VanDerWaalsContact O-N 3.07Å
837	K	47.2	Very low	47.1	Very low	220 Å²	220	127.8 Å²	127.8	96%	0.957	69%	0.693	S	S	*	*	S	Bend	trans	-35.5	103.5	179.9	-65	178.4	176.6	-179.3	0	115.5
838	A	38.1	Very low	47.6	Very low	101 Å²	101	129 Å²	129	84%	0.835	70%	0.699	S	S	*	*			trans	-170.2	63.8	152.8	0	0	0	0	0	115.3	G836	G836-A838 PolarHBondContact O-N 3.4Å; G836-A838 VanDerWaalsContact O-N 3.07Å
839	A	35.5	Very low	48.1	Very low	105 Å²	105	134 Å²	134	87%	0.868	73%	0.728	S	S	*	*			trans	-168.9	132.1	154.5	0	0	0	0	0	111.1
840	E	45.5	Very low	49.3	Very low	186 Å²	186	131.9 Å²	131.9	87%	0.869	72%	0.719	S	S	*	*			trans	-124.4	147.8	169.4	-172.6	-179.8	-174.2	0	0	109
841	K	38.8	Very low	50.6	Low	180 Å²	180	129 Å²	129	78%	0.783	71%	0.71	S	S	*	*			trans	71	130.5	-165.1	-54.5	-179.9	-179.2	178.8	0	112.3
842	D	33.8	Very low	51.9	Low	146 Å²	146	124 Å²	124	78%	0.781	68%	0.683	S	S	*	*	S	Bend	cis	-137.5	175.5	21.6	-92.3	-47.5	0	0	0	114.1
843	L	37.2	Very low	53.5	Low	174 Å²	174	120 Å²	120	91%	0.911	67%	0.67	S	S	*	*			trans	56.9	54.5	164.3	-62.7	176.8	0	0	0	117.6
844	S	41.8	Very low	55.2	Low	101 Å²	101	116 Å²	116	71%	0.706	65%	0.647	S	S	*	*			trans	-95.7	115.5	140.8	47.9	0	0	0	0	109.6	K846	S844-K846 PolarHBondContact O-N 2.95Å
845	E	47.9	Very low	57.3	Low	155 Å²	155	118.8 Å²	118.8	72%	0.724	64%	0.643	S	S	*	*			trans	-55.8	127.3	157	-79.2	-168.5	124.7	0	0	106.8	D847	E845-D847 PolarHBondContact O-N 3.13Å; E845-D847 VanDerWaalsContact O-N 3.09Å
846	K	54.5	Low	59.5	Low	197 Å²	197	114.2 Å²	114.2	86%	0.857	62%	0.621	S	S	*	*			trans	-67.9	111.9	173.6	-73.3	-176.5	177.7	179.5	0	107.6	S844	S844-K846 PolarHBondContact O-N 2.95Å
847	D	57.2	Low	61.9	Low	83 Å²	83	110.8 Å²	110.8	44%	0.444	59%	0.585	S	S	.	*			trans	-50	125.7	178.1	-83.6	2.8	0	0	0	109.9	K765 E845 V851	K765-D847 VanDerWaalsContact CD-OD1 3.32Å; K765-D847 WeakPolarHBondContact CD-OD1 3.32Å; K765-D847 WeakPolarHBondContact CE-OD1 3.47Å; K765-D847 IonicContact NZ-OD1 2.71Å; K765-D847 PolarHBondContact NZ-OD1 2.64Å; K765-D847 IonicContact NZ-OD2 2.71Å; K765-D847 PolarHBondContact NZ-OD2 3.34Å; E845-D847 PolarHBondContact O-N 3.13Å; E845-D847 VanDerWaalsContact O-N 3.09Å; D847-V851 HydrophobicContact CB-CG2 4.48Å
848	P	67	Low	63.9	Low	62 Å²	62	102.1 Å²	102.1	40%	0.403	55%	0.549	S	S	.	.			trans	-62.6	144.6	-177.9	20.3	-27.2	0	0	0	109.4	T767 D850 V851	T767-P848 HydrophobicContact CG2-CG 3.92Å; P848-D850 PolarHBondContact O-N 2.93Å; P848-V851 HydrophobicContact CG-CG2 3.84Å; P848-V851 WeakPolarHBondContact O-CG2 3.43Å; P848-V851 PolarHBondContact O-N 2.85Å
849	P	68.4	Low	66.4	Low	146 Å²	146	100.8 Å²	100.8	95%	0.948	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	5.4	-175.5	29.2	-37.2	0	0	0	114.3
850	D	80.2	Confident	69.1	Low	53 Å²	53	96.9 Å²	96.9	28%	0.283	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	12.2	-173	-167	62.7	0	0	0	111.8	T767 V768 S769 P848	T767-D850 CarbonylContact C-O 3.47Å; T767-D850 WeakPolarHBondContact CA-O 3.45Å; T767-D850 WeakPolarHBondContact CB-O 3.46Å; T767-D850 WeakPolarHBondContact CB-OD2 3.21Å; V768-D850 WeakPolarHBondContact CB-OD1 3.37Å; V768-D850 PolarHBondContact N-O 3.45Å; V768-D850 PolarHBondContact N-OD2 3.03Å; S769-D850 WeakPolarHBondContact CB-OD2 3.39Å; S769-D850 PolarHBondContact N-OD2 2.9Å; S769-D850 PolarHBondContact OG-OD2 3.07Å; P848-D850 PolarHBondContact O-N 2.93Å
851	V	82.3	Confident	71.3	Confident	40 Å²	40	88.7 Å²	88.7	24%	0.242	45%	0.454	C	S	.	.	B	Isolated β-bridge	trans	-62.8	137	175.8	168.5	0	0	0	0	111.3	K765 M822 D847 P848	K765-V851 HydrophobicContact CB-CG2 4.26Å; M822-V851 HydrophobicContact CE-CG1 3.92Å; M822-V851 HydrophobicContact SD-CG1 4.39Å; D847-V851 HydrophobicContact CB-CG2 4.48Å; P848-V851 HydrophobicContact CG-CG2 3.84Å; P848-V851 WeakPolarHBondContact O-CG2 3.43Å; P848-V851 PolarHBondContact O-N 2.85Å
852	L	83.6	Confident	73.9	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.021	42%	0.422	C	S	.	.			trans	-65	157.5	177.7	-65.2	176.9	0	0	0	112.6	P766 V768 L771 A799 L817 R854	P766-L852 HydrophobicContact CB-CD1 3.81Å; P766-L852 HydrophobicContact CB-CG 4.44Å; P766-L852 HydrophobicContact CG-CB 4.43Å; P766-L852 HydrophobicContact CG-CD1 4.08Å; P766-L852 WeakPolarHBondContact O-CG 3.36Å; P766-L852 PolarHBondContact O-N 3.38Å; V768-L852 HydrophobicContact CB-CD2 4.27Å; V768-L852 HydrophobicContact CG2-CD2 3.63Å; L771-L852 HydrophobicContact CD1-CD1 3.83Å; L771-L852 HydrophobicContact CD1-CD2 3.96Å; A799-L852 HydrophobicContact CB-CB 3.93Å; A799-L852 HydrophobicContact CB-CD1 3.8Å; A799-L852 HydrophobicContact CB-CG 4.3Å; L817-L852 HydrophobicContact CB-CD1 3.89Å; L817-L852 HydrophobicContact CD2-CD1 4.33Å; L852-R854 PolarHBondContact O-N 3Å
853	N	86.3	Confident	76.7	Confident	75 Å²	75	75.5 Å²	75.5	40%	0.401	40%	0.397	S	S	.	.			trans	-49	106	-177.1	-176.7	-22.1	0	0	0	112.7	D797 K855 K856 C857	D797-N853 PolarHBondContact O-ND2 2.82Å; N853-K855 PolarHBondContact O-N 2.76Å; N853-K855 VanDerWaalsContact O-N 3.1Å; N853-K855 PolarHBondContact OD1-N 3.39Å; N853-K856 HydrophobicContact CB-CB 4.19Å; N853-K856 HydrophobicContact CB-CG 4.19Å; N853-K856 PolarHBondContact O-N 3.32Å; N853-C857 PolarHBondContact O-N 3.1Å
854	R	86.6	Confident	79.4	Confident	83 Å²	83	67.8 Å²	67.8	31%	0.313	36%	0.356	S	S	.	.	H	α-helix	trans	-52.7	-36.4	-174.7	-174.9	167.4	-176.3	-161.8	-3.7	112.6	M822 T826 E829 L852 L858	M822-R854 HydrophobicContact CE-CB 4.01Å; M822-R854 HydrophobicContact CE-CG 3.98Å; T826-R854 VanDerWaalsContact CG2-NH2 3.31Å; E829-R854 IonicContact OE1-NH1 2.72Å; E829-R854 IonicContact OE2-CZ 2.74Å; E829-R854 VanDerWaalsContact OE2-CZ 3.22Å; E829-R854 IonicContact OE2-NH1 3.41Å; E829-R854 PolarHBondContact OE2-NH1 2.81Å; E829-R854 IonicContact OE2-NH2 2.65Å; E829-R854 PolarHBondContact OE2-NH2 2.96Å; L852-R854 PolarHBondContact O-N 3Å; R854-L858 HydrophobicContact CG-CD1 4.22Å; R854-L858 WeakPolarHBondContact O-CB 3.43Å; R854-L858 VanDerWaalsContact O-CG 3.28Å; R854-L858 WeakPolarHBondContact O-CG 3.5Å; R854-L858 PolarHBondContact O-N 3.46Å
855	K	88.9	Confident	81.9	Confident	148 Å²	148	65.3 Å²	65.3	64%	0.643	33%	0.332	S	S	*	.	H	α-helix	trans	-65.8	-52.9	176.6	-174.9	168.6	-178.1	170.6	0	111.6	N853 C857 L858 D859	N853-K855 PolarHBondContact O-N 2.76Å; N853-K855 VanDerWaalsContact O-N 3.1Å; N853-K855 PolarHBondContact OD1-N 3.39Å; K855-C857 VanDerWaalsContact C-N 3.31Å; K855-C857 PolarHBondContact O-N 3.4Å; K855-L858 WeakPolarHBondContact O-CA 3.28Å; K855-L858 WeakPolarHBondContact O-CB 3.41Å; K855-L858 PolarHBondContact O-N 3.07Å; K855-D859 PolarHBondContact O-N 3.18Å
856	K	89.7	Confident	84.1	Confident	67 Å²	67	58.9 Å²	58.9	29%	0.291	30%	0.301	S	S	.	.	H	α-helix	trans	-58.4	-41.3	177.5	-68.6	-76.6	-166.8	163.4	0	111.8	E798 A799 N853 L858 D859 N860	E798-K856 IonicContact OE1-NZ 2.61Å; E798-K856 PolarHBondContact OE1-NZ 2.96Å; A799-K856 HydrophobicContact CB-CB 4.33Å; N853-K856 HydrophobicContact CB-CB 4.19Å; N853-K856 HydrophobicContact CB-CG 4.19Å; N853-K856 PolarHBondContact O-N 3.32Å; K856-L858 VanDerWaalsContact C-N 3.33Å; K856-L858 PolarHBondContact O-N 3.44Å; K856-D859 PolarHBondContact O-N 3.46Å; K856-N860 WeakPolarHBondContact O-CB 3.49Å; K856-N860 VanDerWaalsContact O-CG 3.31Å; K856-N860 PolarHBondContact O-N 2.92Å; K856-N860 PolarHBondContact O-ND2 2.96Å
857	C	89.5	Confident	86	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-34.8	175.7	-68.6	0	0	0	0	113.1	L817 T818 M822 N853 K855 L861	L817-C857 PolarHBondContact O-SG 2.81Å; L817-C857 VanDerWaalsContact O-SG 3.41Å; T818-C857 PolarHBondContact OG1-O 3.33Å; M822-C857 HydrophobicContact CE-CB 4.16Å; M822-C857 HydrophobicContact CG-CB 4.25Å; N853-C857 PolarHBondContact O-N 3.1Å; K855-C857 VanDerWaalsContact C-N 3.31Å; K855-C857 PolarHBondContact O-N 3.4Å; C857-L861 WeakPolarHBondContact O-CG 3.23Å; C857-L861 PolarHBondContact O-N 3.48Å
858	L	90	Very high	87.8	Confident	38 Å²	38	51.4 Å²	51.4	20%	0.199	27%	0.266	C	S	.	.	H	α-helix	trans	-72.1	-41.5	172.9	-73.1	168	0	0	0	112.5	R823 T826 R854 K855 K856 N860 L861 A862	R823-L858 HydrophobicContact CB-CD2 4.1Å; R823-L858 HydrophobicContact CG-CD2 4.37Å; T826-L858 HydrophobicContact CG2-CD1 4.44Å; R854-L858 HydrophobicContact CG-CD1 4.22Å; R854-L858 WeakPolarHBondContact O-CB 3.43Å; R854-L858 VanDerWaalsContact O-CG 3.28Å; R854-L858 WeakPolarHBondContact O-CG 3.5Å; R854-L858 PolarHBondContact O-N 3.46Å; K855-L858 WeakPolarHBondContact O-CA 3.28Å; K855-L858 WeakPolarHBondContact O-CB 3.41Å; K855-L858 PolarHBondContact O-N 3.07Å; K856-L858 VanDerWaalsContact C-N 3.33Å; K856-L858 PolarHBondContact O-N 3.44Å; L858-N860 VanDerWaalsContact C-N 3.27Å; L858-N860 PolarHBondContact O-N 3.3Å; L858-L861 HydrophobicContact CD2-CD1 4.41Å; L858-L861 CarbonylContact O-C 3.19Å; L858-L861 WeakPolarHBondContact O-CA 3.39Å; L858-L861 WeakPolarHBondContact O-CB 3.47Å; L858-L861 PolarHBondContact O-N 3.43Å; L858-A862 PolarHBondContact O-N 3.01Å
859	D	90.5	Very high	89.1	Confident	74 Å²	74	50.1 Å²	50.1	40%	0.396	25%	0.253	S	S	.	.	H	α-helix	trans	-57.7	-42.3	174.4	-61.3	-30.4	0	0	0	110.5	K855 K856 L861 A862 S863	K855-D859 PolarHBondContact O-N 3.18Å; K856-D859 PolarHBondContact O-N 3.46Å; D859-L861 PolarHBondContact O-N 3.46Å; D859-A862 WeakPolarHBondContact O-CA 3.41Å; D859-A862 VanDerWaalsContact O-CB 3.3Å; D859-A862 WeakPolarHBondContact O-CB 3.34Å; D859-A862 PolarHBondContact O-N 2.88Å; D859-A862 VanDerWaalsContact O-N 3.13Å; D859-S863 PolarHBondContact O-N 3.33Å
860	N	92	Very high	90.5	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-41.6	173.1	-74.2	-50.6	0	0	0	112.2	I759 S816 T818 K856 L858 A862 S863 L864	I759-N860 HydrophobicContact CD1-CB 4.02Å; I759-N860 WeakPolarHBondContact CD1-O 3.41Å; S816-N860 WeakPolarHBondContact CB-ND2 3.39Å; S816-N860 WeakPolarHBondContact CB-OD1 3.34Å; S816-N860 PolarHBondContact OG-ND2 2.96Å; S816-N860 PolarHBondContact OG-OD1 3.06Å; T818-N860 HydrophobicContact CG2-CB 4.36Å; K856-N860 WeakPolarHBondContact O-CB 3.49Å; K856-N860 VanDerWaalsContact O-CG 3.31Å; K856-N860 PolarHBondContact O-N 2.92Å; K856-N860 PolarHBondContact O-ND2 2.96Å; L858-N860 VanDerWaalsContact C-N 3.27Å; L858-N860 PolarHBondContact O-N 3.3Å; N860-A862 VanDerWaalsContact C-N 3.28Å; N860-A862 PolarHBondContact O-N 3.24Å; N860-S863 PolarHBondContact O-N 3.31Å; N860-L864 PolarHBondContact O-N 2.59Å
861	L	91.3	Very high	91.1	Very high	15 Å²	15	43.8 Å²	43.8	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-67.3	-26.1	173.2	-70.5	168.8	0	0	0	113	T818 M822 R823 C857 L858 D859 R865	T818-L861 HydrophobicContact CG2-CD2 3.67Å; T818-L861 HydrophobicContact CG2-CG 3.86Å; T818-L861 WeakPolarHBondContact OG1-CG 3.45Å; M822-L861 HydrophobicContact CB-CD1 4.47Å; R823-L861 HydrophobicContact CB-CD1 4.35Å; C857-L861 WeakPolarHBondContact O-CG 3.23Å; C857-L861 PolarHBondContact O-N 3.48Å; L858-L861 HydrophobicContact CD2-CD1 4.41Å; L858-L861 CarbonylContact O-C 3.19Å; L858-L861 WeakPolarHBondContact O-CA 3.39Å; L858-L861 WeakPolarHBondContact O-CB 3.47Å; L858-L861 PolarHBondContact O-N 3.43Å; D859-L861 PolarHBondContact O-N 3.46Å; L861-R865 WeakPolarHBondContact O-CG 3.34Å; L861-R865 PolarHBondContact O-N 3.18Å; L861-R865 PolarHBondContact O-NE 3.17Å
862	A	92.3	Very high	91.6	Very high	13 Å²	13	45.8 Å²	45.8	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-55.1	168.2	0	0	0	0	0	110.6	L858 D859 N860 L864 R865 H866	L858-A862 PolarHBondContact O-N 3.01Å; D859-A862 WeakPolarHBondContact O-CA 3.41Å; D859-A862 VanDerWaalsContact O-CB 3.3Å; D859-A862 WeakPolarHBondContact O-CB 3.34Å; D859-A862 PolarHBondContact O-N 2.88Å; D859-A862 VanDerWaalsContact O-N 3.13Å; N860-A862 VanDerWaalsContact C-N 3.28Å; N860-A862 PolarHBondContact O-N 3.24Å; A862-L864 PolarHBondContact O-N 2.88Å; A862-L864 VanDerWaalsContact O-N 3.09Å; A862-R865 CarbonylContact O-C 3.59Å; A862-R865 WeakPolarHBondContact O-CA 3.46Å; A862-R865 WeakPolarHBondContact O-CB 3.33Å; A862-R865 PolarHBondContact O-N 3.3Å; A862-H866 PolarHBondContact O-CD2 3.41Å; A862-H866 PolarHBondContact O-N 2.93Å; A862-H866 PolarHBondContact O-ND1 3.08Å; A862-H866 PolarHBondContact O-NE2 3.47Å
863	S	93.2	Very high	92.1	Very high	36 Å²	36	51.6 Å²	51.6	25%	0.252	25%	0.251	S	S	.	.	H	α-helix	trans	-52.2	-35.4	175	-69.4	0	0	0	0	113.8	D859 N860 A867	D859-S863 PolarHBondContact O-N 3.33Å; N860-S863 PolarHBondContact O-N 3.31Å; S863-A867 WeakPolarHBondContact O-CB 3.4Å; S863-A867 PolarHBondContact O-N 3.23Å
864	L	93.5	Very high	92.5	Very high	11 Å²	11	48 Å²	48	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-66.8	-41.1	173.2	-176	55.6	0	0	0	113.6	M739 V741 I759 L761 N860 A862 K868	M739-L864 HydrophobicContact CB-CD1 3.79Å; M739-L864 HydrophobicContact CE-CD1 3.95Å; M739-L864 HydrophobicContact CG-CD1 4.21Å; M739-L864 HydrophobicContact SD-CD1 3.63Å; M739-L864 HydrophobicContact SD-CD2 4.07Å; M739-L864 HydrophobicContact SD-CG 4.43Å; V741-L864 HydrophobicContact CG1-CB 4.35Å; V741-L864 HydrophobicContact CG1-CD1 3.87Å; I759-L864 HydrophobicContact CD1-CB 4.07Å; L761-L864 HydrophobicContact CD1-CD2 4.33Å; L761-L864 HydrophobicContact CD2-CD2 4.07Å; N860-L864 PolarHBondContact O-N 2.59Å; A862-L864 PolarHBondContact O-N 2.88Å; A862-L864 VanDerWaalsContact O-N 3.09Å; L864-K868 WeakPolarHBondContact O-CG 3.47Å; L864-K868 PolarHBondContact O-N 3.22Å; L864-K868 VanDerWaalsContact O-N 3.17Å
865	R	93.9	Very high	92.8	Very high	50 Å²	50	47.3 Å²	47.3	19%	0.189	24%	0.235	C	C	.	.	H	α-helix	trans	-68.6	-42.3	174.4	-72.5	170.6	-71	149.1	0.7	110.9	R823 L861 A862 A867 K868 W869 C949 E950	R823-R865 VanDerWaalsContact NH1-CZ 3.31Å; L861-R865 WeakPolarHBondContact O-CG 3.34Å; L861-R865 PolarHBondContact O-N 3.18Å; L861-R865 PolarHBondContact O-NE 3.17Å; A862-R865 CarbonylContact O-C 3.59Å; A862-R865 WeakPolarHBondContact O-CA 3.46Å; A862-R865 WeakPolarHBondContact O-CB 3.33Å; A862-R865 PolarHBondContact O-N 3.3Å; R865-A867 VanDerWaalsContact C-N 3.31Å; R865-A867 PolarHBondContact O-N 3.21Å; R865-K868 PolarHBondContact O-N 2.86Å; R865-K868 VanDerWaalsContact O-N 3.13Å; R865-W869 WeakPolarHBondContact O-CB 3.28Å; R865-W869 PolarHBondContact O-N 3.48Å; R865-C949 HydrophobicContact CB-CB 3.87Å; R865-C949 PolarHBondContact NH1-O 3.49Å; R865-E950 IonicContact CZ-OE1 2.7Å; R865-E950 IonicContact CZ-OE2 3.31Å; R865-E950 IonicContact NH1-OE1 2.8Å; R865-E950 PolarHBondContact NH1-OE1 3.12Å; R865-E950 IonicContact NH1-OE2 2.71Å; R865-E950 PolarHBondContact NH1-OE2 2.88Å; R865-E950 IonicContact NH2-OE1 3.16Å; R865-E950 PolarHBondContact NH2-OE1 3.13Å; R865-E950 IonicContact NH2-OE2 3.22Å
866	H	94.7	Very high	92.8	Very high	19 Å²	19	43.9 Å²	43.9	9%	0.088	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-44	175.7	-54.8	163.2	0	0	0	111	A862 F870 W903 D947	A862-H866 PolarHBondContact O-CD2 3.41Å; A862-H866 PolarHBondContact O-N 2.93Å; A862-H866 PolarHBondContact O-ND1 3.08Å; A862-H866 PolarHBondContact O-NE2 3.47Å; H866-F870 WeakPolarHBondContact O-CB 3.39Å; H866-F870 PolarHBondContact O-N 2.9Å; H866-W903 HydrophobicContact CB-CD2 4.2Å; H866-W903 HydrophobicContact CB-CE3 3.87Å; H866-W903 HydrophobicContact CB-CH2 3.93Å; H866-W903 HydrophobicContact CB-CZ2 4.25Å; H866-W903 HydrophobicContact CB-CZ3 3.73Å; H866-W903 AromaticContact CD2-CD2 3.95Å; H866-W903 AromaticContact CD2-CE2 3.36Å; H866-W903 AromaticContact CD2-CH2 3.85Å; H866-W903 AromaticContact CD2-CZ2 3.31Å; H866-W903 WeakPolarHBondContact CD2-CZ2 3.47Å; H866-W903 AromaticContact CD2-NE1 3.67Å; H866-W903 AromaticContact CE1-CD1 3.65Å; H866-W903 AromaticContact CE1-CE2 3.91Å; H866-W903 AromaticContact CE1-CG 3.99Å; H866-W903 AromaticContact CE1-NE1 3.6Å; H866-W903 AromaticContact CG-CD2 3.73Å; H866-W903 AromaticContact CG-CE2 3.65Å; H866-W903 AromaticContact CG-CE3 3.94Å; H866-W903 AromaticContact CG-CZ2 3.81Å; H866-W903 AromaticContact ND1-CD2 3.85Å; H866-W903 AromaticContact ND1-CE2 3.98Å; H866-W903 AromaticContact ND1-CG 3.92Å; H866-W903 AromaticContact NE2-CD1 3.91Å; H866-W903 AromaticContact NE2-CE2 3.6Å; H866-W903 AromaticContact NE2-CZ2 3.94Å; H866-W903 AromaticContact NE2-NE1 3.37Å; H866-W903 PolarHBondContact NE2-NE1 2.86Å; H866-D947 IonicContact NE2-OD2 2.63Å
867	A	94.7	Very high	93	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-64.1	-42.5	175.7	0	0	0	0	0	113.1	V741 A745 S863 R865 Q871	V741-A867 HydrophobicContact CB-CB 4.35Å; V741-A867 HydrophobicContact CG1-CB 4.25Å; A745-A867 HydrophobicContact CB-CB 4.17Å; S863-A867 WeakPolarHBondContact O-CB 3.4Å; S863-A867 PolarHBondContact O-N 3.23Å; R865-A867 VanDerWaalsContact C-N 3.31Å; R865-A867 PolarHBondContact O-N 3.21Å; A867-Q871 WeakPolarHBondContact O-CB 3.33Å; A867-Q871 PolarHBondContact O-N 3.44Å; A867-Q871 VanDerWaalsContact O-N 3.13Å
868	K	94.4	Very high	93.2	Very high	120 Å²	120	48 Å²	48	52%	0.522	26%	0.263	S	S	.	.	H	α-helix	trans	-65.8	-45.6	176.4	-72.8	176.3	-179.8	-179.8	0	112.1	L864 R865 Q871 A872	L864-K868 WeakPolarHBondContact O-CG 3.47Å; L864-K868 PolarHBondContact O-N 3.22Å; L864-K868 VanDerWaalsContact O-N 3.17Å; R865-K868 PolarHBondContact O-N 2.86Å; R865-K868 VanDerWaalsContact O-N 3.13Å; K868-Q871 PolarHBondContact O-N 3.49Å; K868-A872 WeakPolarHBondContact O-CB 3.39Å; K868-A872 PolarHBondContact O-N 3.04Å; K868-A872 VanDerWaalsContact O-N 3.15Å
869	W	95.7	Very high	93.4	Very high	35 Å²	35	46.8 Å²	46.8	13%	0.133	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-47.8	175.8	175.6	97.1	0	0	0	111.1	R865 Q871 A872 R873 W903 L907 E910 P948 C949	R865-W869 WeakPolarHBondContact O-CB 3.28Å; R865-W869 PolarHBondContact O-N 3.48Å; W869-Q871 VanDerWaalsContact C-N 3.31Å; W869-Q871 PolarHBondContact O-N 3.33Å; W869-A872 CarbonylContact O-C 3.57Å; W869-A872 PolarHBondContact O-N 2.96Å; W869-R873 HydrophobicContact CD2-CB 4.18Å; W869-R873 HydrophobicContact CD2-CG 4.18Å; W869-R873 HydrophobicContact CG-CG 4.24Å; W869-R873 HydrophobicContact CZ2-CB 4.11Å; W869-R873 HydrophobicContact CZ2-CG 4.35Å; W869-R873 VanDerWaalsContact O-CB 3.26Å; W869-R873 WeakPolarHBondContact O-CB 3.47Å; W869-R873 WeakPolarHBondContact O-CG 3.29Å; W869-R873 PolarHBondContact O-N 3.27Å; W869-W903 AromaticContact CD2-CH2 3.77Å; W869-W903 HydrophobicContact CD2-CH2 3.77Å; W869-W903 HydrophobicContact CD2-CZ3 4.4Å; W869-W903 AromaticContact CE3-CH2 3.35Å; W869-W903 HydrophobicContact CE3-CH2 3.35Å; W869-W903 AromaticContact CE3-CZ3 3.53Å; W869-W903 HydrophobicContact CE3-CZ3 3.53Å; W869-W903 HydrophobicContact CG-CH2 4.28Å; W869-W903 AromaticContact CZ3-CH2 3.78Å; W869-W903 HydrophobicContact CZ3-CH2 3.78Å; W869-W903 AromaticContact CZ3-CZ3 3.68Å; W869-W903 HydrophobicContact CZ3-CZ3 3.68Å; W869-L907 HydrophobicContact CH2-CD1 3.61Å; W869-L907 HydrophobicContact CZ2-CD1 3.54Å; W869-L907 HydrophobicContact CZ3-CD1 4.47Å; W869-E910 HydrophobicContact CH2-CB 3.56Å; W869-E910 HydrophobicContact CH2-CG 3.7Å; W869-E910 HydrophobicContact CZ2-CB 4.26Å; W869-E910 HydrophobicContact CZ2-CG 4.01Å; W869-E910 HydrophobicContact CZ3-CB 4.43Å; W869-P948 HydrophobicContact CD2-CG 4.29Å; W869-P948 HydrophobicContact CG-CG 4.4Å; W869-P948 HydrophobicContact CZ2-CG 4.03Å; W869-C949 VanDerWaalsContact CB-SG 3.55Å
870	F	96.5	Very high	93.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-43.6	-179.3	-172	-77.4	0	0	0	111.4	K746 L748 H866 A872 R873 A874 N875 V881 I884 E906	K746-F870 HydrophobicContact CB-CD1 3.64Å; K746-F870 HydrophobicContact CB-CD2 4.35Å; K746-F870 HydrophobicContact CB-CE1 3.74Å; K746-F870 HydrophobicContact CB-CE2 4.42Å; K746-F870 HydrophobicContact CB-CG 3.98Å; K746-F870 HydrophobicContact CB-CZ 4.14Å; K746-F870 HydrophobicContact CD-CB 4.26Å; K746-F870 HydrophobicContact CD-CD1 4.49Å; K746-F870 HydrophobicContact CD-CD2 3.92Å; K746-F870 HydrophobicContact CD-CE2 4.41Å; K746-F870 HydrophobicContact CD-CG 3.97Å; K746-F870 HydrophobicContact CG-CB 3.97Å; K746-F870 HydrophobicContact CG-CD1 3.82Å; K746-F870 HydrophobicContact CG-CD2 4.14Å; K746-F870 HydrophobicContact CG-CE1 4.39Å; K746-F870 HydrophobicContact CG-CG 3.7Å; K746-F870 VanDerWaalsContact O-CE1 3.25Å; K746-F870 WeakPolarHBondContact O-CE1 3.48Å; L748-F870 HydrophobicContact CD1-CE2 3.86Å; L748-F870 HydrophobicContact CD1-CZ 3.91Å; L748-F870 HydrophobicContact CD2-CZ 4.04Å; L748-F870 HydrophobicContact CG-CZ 4.08Å; H866-F870 WeakPolarHBondContact O-CB 3.39Å; H866-F870 PolarHBondContact O-N 2.9Å; F870-A872 VanDerWaalsContact C-N 3.31Å; F870-A872 PolarHBondContact O-N 3.27Å; F870-R873 PolarHBondContact O-N 2.94Å; F870-A874 HydrophobicContact CD1-CB 4.11Å; F870-A874 HydrophobicContact CD2-CB 3.69Å; F870-A874 HydrophobicContact CE1-CB 4.05Å; F870-A874 HydrophobicContact CE2-CB 3.63Å; F870-A874 HydrophobicContact CG-CB 3.92Å; F870-A874 HydrophobicContact CZ-CB 3.81Å; F870-A874 PolarHBondContact O-N 2.85Å; F870-N875 HydrophobicContact CD1-CB 4.4Å; F870-N875 HydrophobicContact CE1-CB 4.35Å; F870-N875 PolarHBondContact O-N 3.4Å; F870-V881 HydrophobicContact CE1-CG2 4.27Å; F870-V881 HydrophobicContact CZ-CG2 4.28Å; F870-I884 HydrophobicContact CE2-CD1 3.69Å; F870-I884 HydrophobicContact CZ-CD1 4.07Å; F870-E906 HydrophobicContact CD2-CB 4.42Å; F870-E906 HydrophobicContact CD2-CG 4.34Å; F870-E906 WeakPolarHBondContact CD2-OE2 3.46Å; F870-E906 HydrophobicContact CE2-CB 4.35Å; F870-E906 HydrophobicContact CE2-CG 4.07Å
871	Q	93.2	Very high	93.8	Very high	65 Å²	65	43.1 Å²	43.1	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-34.9	177	-173.6	61.6	18.5	0	0	112.7	A867 K868 W869 N875	A867-Q871 WeakPolarHBondContact O-CB 3.33Å; A867-Q871 PolarHBondContact O-N 3.44Å; A867-Q871 VanDerWaalsContact O-N 3.13Å; K868-Q871 PolarHBondContact O-N 3.49Å; W869-Q871 VanDerWaalsContact C-N 3.31Å; W869-Q871 PolarHBondContact O-N 3.33Å; Q871-N875 PolarHBondContact NE2-ND2 3.27Å
872	A	93.7	Very high	94.1	Very high	82 Å²	82	44.1 Å²	44.1	68%	0.678	24%	0.243	S	C	*	.	H	α-helix	trans	-83.8	-20.2	179.4	0	0	0	0	0	114.4	K868 W869 F870	K868-A872 WeakPolarHBondContact O-CB 3.39Å; K868-A872 PolarHBondContact O-N 3.04Å; K868-A872 VanDerWaalsContact O-N 3.15Å; W869-A872 CarbonylContact O-C 3.57Å; W869-A872 PolarHBondContact O-N 2.96Å; F870-A872 VanDerWaalsContact C-N 3.31Å; F870-A872 PolarHBondContact O-N 3.27Å
873	R	93.9	Very high	94.3	Very high	127 Å²	127	43.5 Å²	43.5	48%	0.479	24%	0.238	S	C	.	.	H	α-helix	trans	-121	-62.7	-169.8	-66.3	-60.2	-54	-170.7	-0.6	113.5	W869 F870 E910	W869-R873 HydrophobicContact CD2-CB 4.18Å; W869-R873 HydrophobicContact CD2-CG 4.18Å; W869-R873 HydrophobicContact CG-CG 4.24Å; W869-R873 HydrophobicContact CZ2-CB 4.11Å; W869-R873 HydrophobicContact CZ2-CG 4.35Å; W869-R873 VanDerWaalsContact O-CB 3.26Å; W869-R873 WeakPolarHBondContact O-CB 3.47Å; W869-R873 WeakPolarHBondContact O-CG 3.29Å; W869-R873 PolarHBondContact O-N 3.27Å; F870-R873 PolarHBondContact O-N 2.94Å; R873-E910 HydrophobicContact CB-CG 4.16Å; R873-E910 IonicContact CZ-OE1 3.69Å; R873-E910 VanDerWaalsContact CZ-OE1 3.24Å; R873-E910 IonicContact NE-OE1 2.79Å; R873-E910 PolarHBondContact NE-OE1 3.03Å; R873-E910 IonicContact NH2-OE1 2.96Å; R873-E910 PolarHBondContact NH2-OE1 2.99Å
874	A	93.7	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-37.9	-173.5	0	0	0	0	0	113.3	F870 G876 L877 E910	F870-A874 HydrophobicContact CD1-CB 4.11Å; F870-A874 HydrophobicContact CD2-CB 3.69Å; F870-A874 HydrophobicContact CE1-CB 4.05Å; F870-A874 HydrophobicContact CE2-CB 3.63Å; F870-A874 HydrophobicContact CG-CB 3.92Å; F870-A874 HydrophobicContact CZ-CB 3.81Å; F870-A874 PolarHBondContact O-N 2.85Å; A874-G876 VanDerWaalsContact C-N 3.32Å; A874-G876 PolarHBondContact O-N 2.97Å; A874-L877 WeakPolarHBondContact O-CB 3.48Å; A874-L877 PolarHBondContact O-N 3.44Å; A874-L877 VanDerWaalsContact O-N 3.14Å; A874-E910 HydrophobicContact CB-CB 4.36Å; A874-E910 HydrophobicContact CB-CG 4.18Å
875	N	92.9	Very high	94.6	Very high	68 Å²	68	42.8 Å²	42.8	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.7	-174.5	-178.1	62.6	0	0	0	113.8	F870 Q871	F870-N875 HydrophobicContact CD1-CB 4.4Å; F870-N875 HydrophobicContact CE1-CB 4.35Å; F870-N875 PolarHBondContact O-N 3.4Å; Q871-N875 PolarHBondContact NE2-ND2 3.27Å
876	G	90.6	Very high	94.7	Very high	75 Å²	75	40.4 Å²	40.4	77%	0.773	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.1	175	0	0	0	0	0	114.6	A874	A874-G876 VanDerWaalsContact C-N 3.32Å; A874-G876 PolarHBondContact O-N 2.97Å
877	L	93.1	Very high	94.8	Very high	44 Å²	44	39.7 Å²	39.7	23%	0.23	22%	0.217	C	C	.	.	S	Bend	trans	-91.4	121.4	-170.2	-173.3	60.3	0	0	0	111.1	A874 S879 C880 E910 I913	A874-L877 WeakPolarHBondContact O-CB 3.48Å; A874-L877 PolarHBondContact O-N 3.44Å; A874-L877 VanDerWaalsContact O-N 3.14Å; L877-S879 PolarHBondContact O-N 3.4Å; L877-C880 HydrophobicContact CB-CB 3.8Å; L877-C880 HydrophobicContact CD2-CB 4.05Å; L877-C880 HydrophobicContact CG-CB 3.96Å; L877-C880 VanDerWaalsContact O-CB 3.25Å; L877-C880 WeakPolarHBondContact O-CB 3.43Å; L877-C880 PolarHBondContact O-N 3.41Å; L877-C880 VanDerWaalsContact O-N 3.17Å; L877-E910 HydrophobicContact CD2-CG 4.32Å; L877-I913 HydrophobicContact CD1-CG2 4.08Å; L877-I913 HydrophobicContact CD2-CB 3.8Å; L877-I913 HydrophobicContact CD2-CG2 3.73Å; L877-I913 HydrophobicContact CG-CB 4.37Å; L877-I913 HydrophobicContact CG-CG2 3.73Å
878	Q	92.9	Very high	94.9	Very high	111 Å²	111	41.1 Å²	41.1	52%	0.519	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	137.1	-176.9	-174.6	176	-49	0	0	111.5	C880 P919 L920	Q878-C880 PolarHBondContact O-N 2.96Å; Q878-P919 HydrophobicContact CB-CB 4.31Å; Q878-L920 PolarHBondContact NE2-O 3.12Å; Q878-L920 VanDerWaalsContact NE2-O 3.09Å
879	S	94.4	Very high	94.9	Very high	11 Å²	11	36 Å²	36	8%	0.077	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	-14.1	-177.7	-53.4	0	0	0	0	116.4	L877 I882 V883 L920 S921 P922	L877-S879 PolarHBondContact O-N 3.4Å; S879-I882 WeakPolarHBondContact O-CB 3.27Å; S879-I882 PolarHBondContact O-N 3.13Å; S879-V883 WeakPolarHBondContact O-CG2 3.46Å; S879-V883 PolarHBondContact O-N 3.04Å; S879-L920 PolarHBondContact OG-O 2.66Å; S879-S921 VanDerWaalsContact OG-C 3.31Å; S879-P922 WeakPolarHBondContact OG-CD 3.31Å
880	C	95.9	Very high	94.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-58.3	-175.3	-174.5	0	0	0	0	112.9	L877 Q878 I882 V883 I884 I913	L877-C880 HydrophobicContact CB-CB 3.8Å; L877-C880 HydrophobicContact CD2-CB 4.05Å; L877-C880 HydrophobicContact CG-CB 3.96Å; L877-C880 VanDerWaalsContact O-CB 3.25Å; L877-C880 WeakPolarHBondContact O-CB 3.43Å; L877-C880 PolarHBondContact O-N 3.41Å; L877-C880 VanDerWaalsContact O-N 3.17Å; Q878-C880 PolarHBondContact O-N 2.96Å; C880-I882 PolarHBondContact O-N 3.42Å; C880-I882 VanDerWaalsContact O-N 3.16Å; C880-V883 PolarHBondContact O-N 2.88Å; C880-V883 VanDerWaalsContact O-N 3.11Å; C880-I884 WeakPolarHBondContact O-CG1 3.3Å; C880-I884 PolarHBondContact O-N 3.19Å; C880-I913 HydrophobicContact CB-CD1 4.09Å
881	V	96.2	Very high	94.8	Very high	20 Å²	20	35.6 Å²	35.6	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-31.1	179.2	-175.9	0	0	0	0	112.5	L748 F870 R885	L748-V881 HydrophobicContact CD2-CG1 4.02Å; F870-V881 HydrophobicContact CE1-CG2 4.27Å; F870-V881 HydrophobicContact CZ-CG2 4.28Å; V881-R885 WeakPolarHBondContact O-CG 3.35Å; V881-R885 PolarHBondContact O-N 3.33Å
882	I	95.9	Very high	94.8	Very high	36 Å²	36	38 Å²	38	19%	0.185	21%	0.213	C	C	.	.	H	α-helix	trans	-70.1	-47.9	177.3	-61.5	175.6	0	0	0	110.2	I673 M674 H677 S879 C880 R885 V886 P922	I673-I882 HydrophobicContact CG2-CG2 4.15Å; M674-I882 HydrophobicContact CE-CD1 4.49Å; M674-I882 HydrophobicContact SD-CD1 4.03Å; M674-I882 HydrophobicContact SD-CG2 4.17Å; H677-I882 HydrophobicContact CB-CG2 4.21Å; S879-I882 WeakPolarHBondContact O-CB 3.27Å; S879-I882 PolarHBondContact O-N 3.13Å; C880-I882 PolarHBondContact O-N 3.42Å; C880-I882 VanDerWaalsContact O-N 3.16Å; I882-R885 PolarHBondContact O-N 3.18Å; I882-V886 WeakPolarHBondContact O-CG2 3.29Å; I882-V886 PolarHBondContact O-N 2.82Å; I882-V886 VanDerWaalsContact O-N 3.14Å; I882-P922 HydrophobicContact CD1-CG 4.43Å; I882-P922 HydrophobicContact CG2-CB 4.35Å
883	V	97.1	Very high	94.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-42.2	178.6	171.6	0	0	0	0	111.1	S879 C880 R885 V886 L887 V909 A925 M926 V929	S879-V883 WeakPolarHBondContact O-CG2 3.46Å; S879-V883 PolarHBondContact O-N 3.04Å; C880-V883 PolarHBondContact O-N 2.88Å; C880-V883 VanDerWaalsContact O-N 3.11Å; V883-R885 PolarHBondContact O-N 3.17Å; V883-V886 PolarHBondContact O-N 2.98Å; V883-L887 HydrophobicContact CG1-CD1 3.71Å; V883-L887 HydrophobicContact CG1-CG 4.24Å; V883-L887 WeakPolarHBondContact O-CB 3.47Å; V883-L887 WeakPolarHBondContact O-CG 3.49Å; V883-L887 PolarHBondContact O-N 2.85Å; V883-V909 HydrophobicContact CB-CG1 4.24Å; V883-V909 HydrophobicContact CG1-CG1 3.91Å; V883-V909 HydrophobicContact CG1-CG2 4.41Å; V883-A925 HydrophobicContact CG2-CB 3.76Å; V883-M926 HydrophobicContact CG1-CE 4.05Å; V883-M926 HydrophobicContact CG1-SD 4.33Å; V883-M926 HydrophobicContact CG2-CB 4.36Å; V883-V929 HydrophobicContact CG1-CG2 4.35Å
884	I	97.1	Very high	94.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-43	177.5	-63.8	174.8	0	0	0	111.4	L748 F870 C880 V886 L887 R888 M905 E906 V909	L748-I884 HydrophobicContact CD1-CG2 3.7Å; L748-I884 HydrophobicContact CD2-CB 4.01Å; L748-I884 HydrophobicContact CD2-CG2 3.62Å; L748-I884 HydrophobicContact CG-CG2 4.31Å; F870-I884 HydrophobicContact CE2-CD1 3.69Å; F870-I884 HydrophobicContact CZ-CD1 4.07Å; C880-I884 WeakPolarHBondContact O-CG1 3.3Å; C880-I884 PolarHBondContact O-N 3.19Å; I884-V886 PolarHBondContact O-N 3.02Å; I884-L887 PolarHBondContact O-N 3.39Å; I884-R888 WeakPolarHBondContact O-CB 3.32Å; I884-R888 PolarHBondContact O-N 2.8Å; I884-M905 HydrophobicContact CG2-CE 4.37Å; I884-E906 HydrophobicContact CD1-CB 4.41Å; I884-E906 HydrophobicContact CD1-CG 4.45Å; I884-E906 HydrophobicContact CG2-CG 4Å; I884-V909 HydrophobicContact CD1-CB 4.14Å; I884-V909 HydrophobicContact CD1-CG1 4.15Å; I884-V909 HydrophobicContact CG1-CB 3.71Å; I884-V909 HydrophobicContact CG1-CG1 3.58Å; I884-V909 HydrophobicContact CG1-CG2 4.08Å
885	R	96.4	Very high	94.7	Very high	32 Å²	32	39.1 Å²	39.1	12%	0.121	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-43	174.6	-77.1	-175.4	-159.9	150.6	1.3	112.5	H677 I680 G747 L748 L750 V881 I882 V883 R888 D889	H677-R885 PolarHBondContact NE2-NH1 3.4Å; I680-R885 HydrophobicContact CD1-CB 4.43Å; I680-R885 WeakPolarHBondContact CD1-O 3.09Å; G747-R885 VanDerWaalsContact O-CZ 3.26Å; G747-R885 PolarHBondContact O-NE 2.74Å; G747-R885 PolarHBondContact O-NH2 3.19Å; L748-R885 HydrophobicContact CD2-CG 3.99Å; L750-R885 HydrophobicContact CD2-CB 3.85Å; L750-R885 HydrophobicContact CD2-CG 4.05Å; V881-R885 WeakPolarHBondContact O-CG 3.35Å; V881-R885 PolarHBondContact O-N 3.33Å; I882-R885 PolarHBondContact O-N 3.18Å; V883-R885 PolarHBondContact O-N 3.17Å; R885-R888 PolarHBondContact O-N 3.27Å; R885-D889 PolarHBondContact O-N 2.87Å; R885-D889 VanDerWaalsContact O-N 3.1Å
886	V	96.8	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71.8	-35.2	-179.2	174.2	0	0	0	0	112.2	I673 K676 H677 I680 I882 V883 I884 L890 M926 L988	I673-V886 HydrophobicContact CG2-CG2 4.31Å; K676-V886 HydrophobicContact CG-CG1 4.35Å; H677-V886 HydrophobicContact CB-CG2 4.09Å; I680-V886 HydrophobicContact CD1-CB 4.45Å; I680-V886 HydrophobicContact CD1-CG2 3.89Å; I882-V886 WeakPolarHBondContact O-CG2 3.29Å; I882-V886 PolarHBondContact O-N 2.82Å; I882-V886 VanDerWaalsContact O-N 3.14Å; V883-V886 PolarHBondContact O-N 2.98Å; I884-V886 PolarHBondContact O-N 3.02Å; V886-L890 PolarHBondContact O-N 3.04Å; V886-L890 VanDerWaalsContact O-N 3.1Å; V886-M926 HydrophobicContact CB-CE 3.91Å; V886-M926 HydrophobicContact CG1-CE 3.53Å; V886-L988 HydrophobicContact CG1-CD2 3.36Å
887	L	96.2	Very high	94.8	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-70.1	-35	171.7	-70.6	171.4	0	0	0	111.9	V883 I884 L890 C891 W897 M905 V909 M926 V929	V883-L887 HydrophobicContact CG1-CD1 3.71Å; V883-L887 HydrophobicContact CG1-CG 4.24Å; V883-L887 WeakPolarHBondContact O-CB 3.47Å; V883-L887 WeakPolarHBondContact O-CG 3.49Å; V883-L887 PolarHBondContact O-N 2.85Å; I884-L887 PolarHBondContact O-N 3.39Å; L887-L890 CarbonylContact O-C 3.59Å; L887-L890 WeakPolarHBondContact O-CA 3.35Å; L887-L890 WeakPolarHBondContact O-CB 3.27Å; L887-L890 PolarHBondContact O-N 3.23Å; L887-C891 PolarHBondContact O-N 3.14Å; L887-C891 PolarHBondContact O-SG 2.85Å; L887-W897 HydrophobicContact CD2-CZ3 4.08Å; L887-M905 HydrophobicContact CB-CG 4.32Å; L887-M905 HydrophobicContact CB-SD 3.65Å; L887-V909 HydrophobicContact CD1-CG2 3.58Å; L887-M926 HydrophobicContact CD2-CE 4.2Å; L887-M926 HydrophobicContact CD2-SD 3.81Å; L887-M926 HydrophobicContact CG-CE 4.09Å; L887-M926 HydrophobicContact CG-SD 4.16Å; L887-V929 HydrophobicContact CD1-CG1 3.87Å
888	R	95.8	Very high	94.8	Very high	35 Å²	35	34.8 Å²	34.8	13%	0.132	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-43	173.8	-173.8	173.7	173.3	-111.4	-17.7	112.4	L748 L750 D753 I884 R885 L890 C891 Q892 M905	L748-R888 PolarHBondContact O-NH1 3.26Å; L750-R888 HydrophobicContact CD1-CB 4.02Å; L750-R888 HydrophobicContact CD1-CG 3.84Å; D753-R888 IonicContact OD1-CZ 2.71Å; D753-R888 IonicContact OD1-NH1 3.76Å; D753-R888 PolarHBondContact OD1-NH1 3.25Å; D753-R888 IonicContact OD1-NH2 2.97Å; D753-R888 PolarHBondContact OD1-NH2 3.12Å; D753-R888 IonicContact OD2-CZ 3.02Å; D753-R888 IonicContact OD2-NH1 2.68Å; D753-R888 PolarHBondContact OD2-NH1 3.43Å; D753-R888 IonicContact OD2-NH2 2.79Å; D753-R888 PolarHBondContact OD2-NH2 3.19Å; I884-R888 WeakPolarHBondContact O-CB 3.32Å; I884-R888 PolarHBondContact O-N 2.8Å; R885-R888 PolarHBondContact O-N 3.27Å; R888-L890 VanDerWaalsContact C-N 3.28Å; R888-L890 PolarHBondContact O-N 2.87Å; R888-C891 PolarHBondContact O-N 3.19Å; R888-Q892 WeakPolarHBondContact O-CG 3.44Å; R888-Q892 PolarHBondContact O-N 3.13Å; R888-M905 HydrophobicContact CB-CE 3.84Å; R888-M905 HydrophobicContact CG-CE 4.4Å
889	D	95.8	Very high	94.7	Very high	12 Å²	12	34.2 Å²	34.2	6%	0.064	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-38.1	169	150.2	99.3	0	0	0	112	K676 I680 L750 R885 Q892 R893	K676-D889 WeakPolarHBondContact CE-OD1 3.48Å; K676-D889 WeakPolarHBondContact CE-OD2 3.46Å; K676-D889 IonicContact NZ-OD1 3.28Å; K676-D889 PolarHBondContact NZ-OD1 3.17Å; K676-D889 IonicContact NZ-OD2 3.93Å; K676-D889 PolarHBondContact NZ-OD2 3.13Å; I680-D889 HydrophobicContact CD1-CB 3.82Å; I680-D889 HydrophobicContact CG2-CB 4.06Å; I680-D889 WeakPolarHBondContact CG2-OD1 3.4Å; L750-D889 HydrophobicContact CD1-CB 4.3Å; R885-D889 PolarHBondContact O-N 2.87Å; R885-D889 VanDerWaalsContact O-N 3.1Å; D889-Q892 PolarHBondContact O-N 2.97Å; D889-R893 VanDerWaalsContact CG-NE 3.28Å; D889-R893 WeakPolarHBondContact O-CB 3.15Å; D889-R893 WeakPolarHBondContact O-CG 3.21Å; D889-R893 PolarHBondContact O-N 3.03Å; D889-R893 IonicContact OD1-NE 2.73Å; D889-R893 PolarHBondContact OD1-NE 2.82Å; D889-R893 VanDerWaalsContact OD1-NE 3.16Å; D889-R893 IonicContact OD2-CZ 2.7Å; D889-R893 IonicContact OD2-NE 3.74Å; D889-R893 PolarHBondContact OD2-NE 3.11Å; D889-R893 IonicContact OD2-NH2 3.47Å; D889-R893 PolarHBondContact OD2-NH2 2.84Å
890	L	94.7	Very high	94.6	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-67.6	-41.7	177.7	-164.7	155.8	0	0	0	111.4	V886 L887 R888 Q892 R893 V894 W897 V987	V886-L890 PolarHBondContact O-N 3.04Å; V886-L890 VanDerWaalsContact O-N 3.1Å; L887-L890 CarbonylContact O-C 3.59Å; L887-L890 WeakPolarHBondContact O-CA 3.35Å; L887-L890 WeakPolarHBondContact O-CB 3.27Å; L887-L890 PolarHBondContact O-N 3.23Å; R888-L890 VanDerWaalsContact C-N 3.28Å; R888-L890 PolarHBondContact O-N 2.87Å; L890-Q892 VanDerWaalsContact C-N 3.29Å; L890-Q892 PolarHBondContact O-N 3.43Å; L890-R893 PolarHBondContact O-N 3.4Å; L890-V894 HydrophobicContact CD2-CB 4.23Å; L890-V894 HydrophobicContact CD2-CG2 4.07Å; L890-V894 HydrophobicContact CG-CG2 4.28Å; L890-V894 WeakPolarHBondContact O-CB 3.25Å; L890-V894 PolarHBondContact O-N 2.87Å; L890-W897 HydrophobicContact CD2-CB 3.85Å; L890-W897 HydrophobicContact CD2-CD2 3.31Å; L890-W897 HydrophobicContact CD2-CE3 3.82Å; L890-W897 HydrophobicContact CD2-CG 3.33Å; L890-W897 HydrophobicContact CD2-CZ2 4.28Å; L890-W897 HydrophobicContact CD2-CZ3 4.48Å; L890-V987 HydrophobicContact CD1-CG1 3.63Å
891	C	94.4	Very high	94.4	Very high	21 Å²	21	36 Å²	36	14%	0.142	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-32.9	172.6	-62.5	0	0	0	0	113	L887 R888 W897 G898	L887-C891 PolarHBondContact O-N 3.14Å; L887-C891 PolarHBondContact O-SG 2.85Å; R888-C891 PolarHBondContact O-N 3.19Å; C891-W897 HydrophobicContact CB-CB 4.34Å; C891-W897 PolarHBondContact SG-O 3.46Å; C891-G898 WeakPolarHBondContact O-CA 3.48Å; C891-G898 PolarHBondContact O-N 3.27Å
892	Q	92.8	Very high	94.2	Very high	115 Å²	115	38.7 Å²	38.7	54%	0.537	22%	0.216	S	C	.	.	H	α-helix	trans	-71.8	-37.1	173.3	-73.2	171.3	-32.4	0	0	112.6	R888 D889 L890	R888-Q892 WeakPolarHBondContact O-CG 3.44Å; R888-Q892 PolarHBondContact O-N 3.13Å; D889-Q892 PolarHBondContact O-N 2.97Å; L890-Q892 VanDerWaalsContact C-N 3.29Å; L890-Q892 PolarHBondContact O-N 3.43Å
893	R	93.1	Very high	94.2	Very high	85 Å²	85	38.1 Å²	38.1	32%	0.321	21%	0.211	S	C	.	.	H	α-helix	trans	-83.3	-27.9	-179.4	-72.2	-176	-64.5	103.1	1.2	114.7	D889 L890 V987 L988	D889-R893 VanDerWaalsContact CG-NE 3.28Å; D889-R893 WeakPolarHBondContact O-CB 3.15Å; D889-R893 WeakPolarHBondContact O-CG 3.21Å; D889-R893 PolarHBondContact O-N 3.03Å; D889-R893 IonicContact OD1-NE 2.73Å; D889-R893 PolarHBondContact OD1-NE 2.82Å; D889-R893 VanDerWaalsContact OD1-NE 3.16Å; D889-R893 IonicContact OD2-CZ 2.7Å; D889-R893 IonicContact OD2-NE 3.74Å; D889-R893 PolarHBondContact OD2-NE 3.11Å; D889-R893 IonicContact OD2-NH2 3.47Å; D889-R893 PolarHBondContact OD2-NH2 2.84Å; L890-R893 PolarHBondContact O-N 3.4Å; R893-V987 PolarHBondContact NH1-O 3.43Å; R893-V987 PolarHBondContact NH2-O 2.8Å; R893-V987 VanDerWaalsContact NH2-O 3.15Å; R893-L988 PolarHBondContact NH2-O 3.26Å
894	V	93.6	Very high	94	Very high	40 Å²	40	38.2 Å²	38.2	24%	0.242	21%	0.212	C	C	.	.			trans	-120.9	102.1	-171.1	-171.7	0	0	0	0	109.1	L890 T896 W897 G898	L890-V894 HydrophobicContact CD2-CB 4.23Å; L890-V894 HydrophobicContact CD2-CG2 4.07Å; L890-V894 HydrophobicContact CG-CG2 4.28Å; L890-V894 WeakPolarHBondContact O-CB 3.25Å; L890-V894 PolarHBondContact O-N 2.87Å; V894-T896 PolarHBondContact O-N 3.26Å; V894-W897 HydrophobicContact CB-CB 4.47Å; V894-W897 PolarHBondContact O-N 3.12Å; V894-G898 PolarHBondContact O-N 3.17Å; V894-G898 VanDerWaalsContact O-N 3.15Å
895	P	93.3	Very high	93.9	Very high	109 Å²	109	38.6 Å²	38.6	71%	0.708	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.7	-174.5	-29.9	36.4	0	0	0	115	W897 G898	P895-W897 VanDerWaalsContact C-N 3.32Å; P895-W897 PolarHBondContact O-N 2.96Å; P895-G898 PolarHBondContact O-N 2.75Å
896	T	93.1	Very high	93.9	Very high	43 Å²	43	37.5 Å²	37.5	26%	0.264	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-45.1	171.3	-53.8	0	0	0	0	112.5	V894 K899 D967 I968	V894-T896 PolarHBondContact O-N 3.26Å; T896-K899 WeakPolarHBondContact O-CB 3.36Å; T896-K899 WeakPolarHBondContact O-CG 3.28Å; T896-D967 HydrophobicContact CG2-CB 3.5Å; T896-D967 VanDerWaalsContact CG2-CB 3.5Å; T896-I968 HydrophobicContact CG2-CG1 4.09Å; T896-I968 WeakPolarHBondContact O-CD1 3.29Å; T896-I968 VanDerWaalsContact O-CG1 3.25Å; T896-I968 WeakPolarHBondContact O-CG1 3.39Å
897	W	93.3	Very high	93.8	Very high	6 Å²	6	37.5 Å²	37.5	2%	0.023	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-80.9	-26.2	-179.6	-71.6	71.1	0	0	0	112.2	L887 L890 C891 V894 P895 K899 L900 L930 I933 I968 S971 T972	L887-W897 HydrophobicContact CD2-CZ3 4.08Å; L890-W897 HydrophobicContact CD2-CB 3.85Å; L890-W897 HydrophobicContact CD2-CD2 3.31Å; L890-W897 HydrophobicContact CD2-CE3 3.82Å; L890-W897 HydrophobicContact CD2-CG 3.33Å; L890-W897 HydrophobicContact CD2-CZ2 4.28Å; L890-W897 HydrophobicContact CD2-CZ3 4.48Å; C891-W897 HydrophobicContact CB-CB 4.34Å; C891-W897 PolarHBondContact SG-O 3.46Å; V894-W897 HydrophobicContact CB-CB 4.47Å; V894-W897 PolarHBondContact O-N 3.12Å; P895-W897 VanDerWaalsContact C-N 3.32Å; P895-W897 PolarHBondContact O-N 2.96Å; W897-K899 PolarHBondContact O-N 2.8Å; W897-L900 VanDerWaalsContact O-CB 3.27Å; W897-L900 WeakPolarHBondContact O-CB 3.27Å; W897-L900 PolarHBondContact O-N 3.28Å; W897-L930 HydrophobicContact CH2-CD2 3.77Å; W897-L930 HydrophobicContact CZ2-CD2 4.37Å; W897-I933 HydrophobicContact CH2-CD1 4.19Å; W897-I933 HydrophobicContact CZ3-CD1 4.07Å; W897-I968 HydrophobicContact CD2-CG2 4.48Å; W897-S971 PolarHBondContact NE1-OG 3.03Å; W897-T972 HydrophobicContact CH2-CG2 4.2Å; W897-T972 WeakPolarHBondContact CH2-OG1 3.36Å; W897-T972 HydrophobicContact CZ2-CG2 4.45Å; W897-T972 WeakPolarHBondContact CZ2-OG1 3.48Å
898	G	91.7	Very high	93.7	Very high	47 Å²	47	37.5 Å²	37.5	49%	0.485	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-58.5	-13.9	169.7	0	0	0	0	0	114.6	C891 V894 P895 L900	C891-G898 WeakPolarHBondContact O-CA 3.48Å; C891-G898 PolarHBondContact O-N 3.27Å; V894-G898 PolarHBondContact O-N 3.17Å; V894-G898 VanDerWaalsContact O-N 3.15Å; P895-G898 PolarHBondContact O-N 2.75Å; G898-L900 VanDerWaalsContact C-N 3.32Å
899	K	92.2	Very high	93.7	Very high	99 Å²	99	35.9 Å²	35.9	43%	0.43	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-75.9	-13.6	171.2	-53.3	-179.1	-170.9	179.2	0	113.8	T896 W897 A964 D967 I968	T896-K899 WeakPolarHBondContact O-CB 3.36Å; T896-K899 WeakPolarHBondContact O-CG 3.28Å; W897-K899 PolarHBondContact O-N 2.8Å; K899-A964 HydrophobicContact CB-CB 4.04Å; K899-A964 HydrophobicContact CD-CB 3.46Å; K899-A964 VanDerWaalsContact CD-CB 3.46Å; K899-A964 HydrophobicContact CG-CB 4.38Å; K899-D967 IonicContact NZ-OD2 3.27Å; K899-D967 PolarHBondContact NZ-OD2 3.44Å; K899-I968 HydrophobicContact CB-CD1 4.37Å
900	L	91.3	Very high	93.7	Very high	12 Å²	12	35.7 Å²	35.7	6%	0.063	20%	0.203	C	C	.	.	S	Bend	trans	-82.8	122.4	-179.9	-175.8	64.4	0	0	0	110.4	W897 G898 S902 A904 M905 L957 M960 I968	W897-L900 VanDerWaalsContact O-CB 3.27Å; W897-L900 WeakPolarHBondContact O-CB 3.27Å; W897-L900 PolarHBondContact O-N 3.28Å; G898-L900 VanDerWaalsContact C-N 3.32Å; L900-S902 PolarHBondContact O-N 2.97Å; L900-A904 HydrophobicContact CD1-CB 4.04Å; L900-M905 HydrophobicContact CD2-CB 3.79Å; L900-M905 HydrophobicContact CD2-CG 4.22Å; L900-M905 HydrophobicContact CG-CB 4.23Å; L900-L957 HydrophobicContact CD1-CD2 4.48Å; L900-M960 HydrophobicContact CB-CE 4.4Å; L900-M960 HydrophobicContact CD1-CE 3.92Å; L900-M960 HydrophobicContact CD1-SD 3.75Å; L900-I968 HydrophobicContact CB-CD1 4.03Å
901	P	92.3	Very high	93.7	Very high	36 Å²	36	39 Å²	39	23%	0.234	22%	0.217	C	C	.	.			trans	-57.8	134.3	175.7	-25.5	34.5	0	0	0	111.9	W903 A904 M905 M960	P901-W903 PolarHBondContact O-N 3.31Å; P901-W903 VanDerWaalsContact O-N 3.1Å; P901-A904 HydrophobicContact CB-CB 4.14Å; P901-A904 HydrophobicContact CG-CB 4.46Å; P901-A904 WeakPolarHBondContact O-CB 3.48Å; P901-A904 PolarHBondContact O-N 3.47Å; P901-M905 PolarHBondContact O-N 2.78Å; P901-M960 WeakPolarHBondContact CD-SD 3.39Å; P901-M960 HydrophobicContact CG-CG 4.11Å; P901-M960 HydrophobicContact CG-SD 4.37Å
902	S	92.3	Very high	93.8	Very high	77 Å²	77	38.3 Å²	38.3	54%	0.538	21%	0.212	S	C	.	.	H	α-helix	trans	-52	-38.5	-179.2	-53.7	0	0	0	0	112.9	L900 M905 E906	L900-S902 PolarHBondContact O-N 2.97Å; S902-M905 PolarHBondContact O-N 3.38Å; S902-E906 WeakPolarHBondContact O-CG 3.42Å; S902-E906 PolarHBondContact O-N 2.82Å
903	W	94.3	Very high	93.9	Very high	24 Å²	24	33.1 Å²	33.1	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-69.3	-40.2	177.2	178.5	-133.2	0	0	0	113.1	H866 W869 P901 M905 E906 L907 D947 P948 C949 V956	H866-W903 HydrophobicContact CB-CD2 4.2Å; H866-W903 HydrophobicContact CB-CE3 3.87Å; H866-W903 HydrophobicContact CB-CH2 3.93Å; H866-W903 HydrophobicContact CB-CZ2 4.25Å; H866-W903 HydrophobicContact CB-CZ3 3.73Å; H866-W903 AromaticContact CD2-CD2 3.95Å; H866-W903 AromaticContact CD2-CE2 3.36Å; H866-W903 AromaticContact CD2-CH2 3.85Å; H866-W903 AromaticContact CD2-CZ2 3.31Å; H866-W903 WeakPolarHBondContact CD2-CZ2 3.47Å; H866-W903 AromaticContact CD2-NE1 3.67Å; H866-W903 AromaticContact CE1-CD1 3.65Å; H866-W903 AromaticContact CE1-CE2 3.91Å; H866-W903 AromaticContact CE1-CG 3.99Å; H866-W903 AromaticContact CE1-NE1 3.6Å; H866-W903 AromaticContact CG-CD2 3.73Å; H866-W903 AromaticContact CG-CE2 3.65Å; H866-W903 AromaticContact CG-CE3 3.94Å; H866-W903 AromaticContact CG-CZ2 3.81Å; H866-W903 AromaticContact ND1-CD2 3.85Å; H866-W903 AromaticContact ND1-CE2 3.98Å; H866-W903 AromaticContact ND1-CG 3.92Å; H866-W903 AromaticContact NE2-CD1 3.91Å; H866-W903 AromaticContact NE2-CE2 3.6Å; H866-W903 AromaticContact NE2-CZ2 3.94Å; H866-W903 AromaticContact NE2-NE1 3.37Å; H866-W903 PolarHBondContact NE2-NE1 2.86Å; W869-W903 AromaticContact CD2-CH2 3.77Å; W869-W903 HydrophobicContact CD2-CH2 3.77Å; W869-W903 HydrophobicContact CD2-CZ3 4.4Å; W869-W903 AromaticContact CE3-CH2 3.35Å; W869-W903 HydrophobicContact CE3-CH2 3.35Å; W869-W903 AromaticContact CE3-CZ3 3.53Å; W869-W903 HydrophobicContact CE3-CZ3 3.53Å; W869-W903 HydrophobicContact CG-CH2 4.28Å; W869-W903 AromaticContact CZ3-CH2 3.78Å; W869-W903 HydrophobicContact CZ3-CH2 3.78Å; W869-W903 AromaticContact CZ3-CZ3 3.68Å; W869-W903 HydrophobicContact CZ3-CZ3 3.68Å; P901-W903 PolarHBondContact O-N 3.31Å; P901-W903 VanDerWaalsContact O-N 3.1Å; W903-M905 VanDerWaalsContact C-N 3.31Å; W903-M905 PolarHBondContact O-N 3.33Å; W903-E906 HydrophobicContact CE3-CB 4.24Å; W903-E906 PolarHBondContact O-N 3.44Å; W903-L907 WeakPolarHBondContact O-CB 3.15Å; W903-L907 PolarHBondContact O-N 2.84Å; W903-D947 PolarHBondContact NE1-OD2 2.87Å; W903-P948 HydrophobicContact CZ2-CG 4.46Å; W903-C949 HydrophobicContact CZ2-CB 4.37Å; W903-V956 HydrophobicContact CB-CG1 4.44Å; W903-V956 HydrophobicContact CG-CG1 4.26Å
904	A	94	Very high	94	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-43.3	173.5	0	0	0	0	0	111.1	L900 P901 L908 L945 V956 L957	L900-A904 HydrophobicContact CD1-CB 4.04Å; P901-A904 HydrophobicContact CB-CB 4.14Å; P901-A904 HydrophobicContact CG-CB 4.46Å; P901-A904 WeakPolarHBondContact O-CB 3.48Å; P901-A904 PolarHBondContact O-N 3.47Å; A904-L908 WeakPolarHBondContact O-CB 2.97Å; A904-L908 PolarHBondContact O-N 2.82Å; A904-L945 HydrophobicContact CB-CD2 3.94Å; A904-L945 VanDerWaalsContact O-CD2 3.27Å; A904-L945 WeakPolarHBondContact O-CD2 3.44Å; A904-V956 HydrophobicContact CB-CB 4.35Å; A904-V956 HydrophobicContact CB-CG1 3.81Å; A904-L957 HydrophobicContact CB-CD2 3.9Å
905	M	94.8	Very high	94	Very high	9 Å²	9	33 Å²	33	4%	0.044	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-48.5	175.8	-178.4	-177.9	65.1	0	0	112.3	I884 L887 R888 L900 P901 S902 W903 V909	I884-M905 HydrophobicContact CG2-CE 4.37Å; L887-M905 HydrophobicContact CB-CG 4.32Å; L887-M905 HydrophobicContact CB-SD 3.65Å; R888-M905 HydrophobicContact CB-CE 3.84Å; R888-M905 HydrophobicContact CG-CE 4.4Å; L900-M905 HydrophobicContact CD2-CB 3.79Å; L900-M905 HydrophobicContact CD2-CG 4.22Å; L900-M905 HydrophobicContact CG-CB 4.23Å; P901-M905 PolarHBondContact O-N 2.78Å; S902-M905 PolarHBondContact O-N 3.38Å; W903-M905 VanDerWaalsContact C-N 3.31Å; W903-M905 PolarHBondContact O-N 3.33Å; M905-V909 WeakPolarHBondContact O-CG2 3.46Å; M905-V909 PolarHBondContact O-N 3.42Å; M905-V909 VanDerWaalsContact O-N 3.09Å
906	E	95.6	Very high	94	Very high	8 Å²	8	28.8 Å²	28.8	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-59.4	-48.1	177.4	-73	172.2	-153.4	0	0	112.3	K746 L748 F870 I884 S902 W903 V909 E910	K746-E906 WeakPolarHBondContact CD-OE1 3.38Å; K746-E906 VanDerWaalsContact CD-OE2 3.32Å; K746-E906 WeakPolarHBondContact CD-OE2 3.35Å; K746-E906 WeakPolarHBondContact CE-OE2 3.47Å; K746-E906 IonicContact NZ-OE1 2.59Å; K746-E906 PolarHBondContact NZ-OE1 2.96Å; K746-E906 IonicContact NZ-OE2 2.81Å; K746-E906 PolarHBondContact NZ-OE2 2.79Å; L748-E906 HydrophobicContact CD1-CG 4.03Å; F870-E906 HydrophobicContact CD2-CB 4.42Å; F870-E906 HydrophobicContact CD2-CG 4.34Å; F870-E906 WeakPolarHBondContact CD2-OE2 3.46Å; F870-E906 HydrophobicContact CE2-CB 4.35Å; F870-E906 HydrophobicContact CE2-CG 4.07Å; I884-E906 HydrophobicContact CD1-CB 4.41Å; I884-E906 HydrophobicContact CD1-CG 4.45Å; I884-E906 HydrophobicContact CG2-CG 4Å; S902-E906 WeakPolarHBondContact O-CG 3.42Å; S902-E906 PolarHBondContact O-N 2.82Å; W903-E906 HydrophobicContact CE3-CB 4.24Å; W903-E906 PolarHBondContact O-N 3.44Å; E906-V909 PolarHBondContact O-N 2.96Å; E906-E910 PolarHBondContact O-N 2.8Å; E906-E910 VanDerWaalsContact O-N 3.09Å
907	L	95.2	Very high	93.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-40.4	-177.4	179.6	58.1	0	0	0	112.1	W869 W903 K911 L945 P948 V956	W869-L907 HydrophobicContact CH2-CD1 3.61Å; W869-L907 HydrophobicContact CZ2-CD1 3.54Å; W869-L907 HydrophobicContact CZ3-CD1 4.47Å; W903-L907 WeakPolarHBondContact O-CB 3.15Å; W903-L907 PolarHBondContact O-N 2.84Å; L907-K911 HydrophobicContact CD1-CD 4.32Å; L907-K911 HydrophobicContact CD1-CG 4.45Å; L907-K911 HydrophobicContact CG-CD 4.42Å; L907-K911 WeakPolarHBondContact O-CB 3.46Å; L907-K911 WeakPolarHBondContact O-CG 3.2Å; L907-K911 PolarHBondContact O-N 3.42Å; L907-L945 HydrophobicContact CB-CD2 4.21Å; L907-L945 HydrophobicContact CD2-CD2 4.13Å; L907-L945 HydrophobicContact CD2-CG 3.91Å; L907-L945 HydrophobicContact CG-CD1 4.31Å; L907-L945 HydrophobicContact CG-CD2 4.21Å; L907-L945 HydrophobicContact CG-CG 4.13Å; L907-P948 HydrophobicContact CD1-CG 3.63Å; L907-V956 HydrophobicContact CD2-CG2 3.9Å
908	L	94.8	Very high	93.5	Very high	4 Å²	4	35 Å²	35	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-45.9	175	178.6	63.2	0	0	0	111.4	A904 E910 K911 V912 I933 I937 L938 L945	A904-L908 WeakPolarHBondContact O-CB 2.97Å; A904-L908 PolarHBondContact O-N 2.82Å; L908-E910 PolarHBondContact O-N 3.26Å; L908-K911 PolarHBondContact O-N 2.8Å; L908-V912 HydrophobicContact CD1-CG2 3.92Å; L908-V912 HydrophobicContact CG-CG2 4.36Å; L908-V912 WeakPolarHBondContact O-CB 3.42Å; L908-V912 WeakPolarHBondContact O-CG2 3.42Å; L908-V912 PolarHBondContact O-N 3.15Å; L908-I933 HydrophobicContact CD2-CD1 3.86Å; L908-I933 HydrophobicContact CD2-CG1 3.61Å; L908-I937 HydrophobicContact CD1-CD1 4.09Å; L908-I937 HydrophobicContact CD1-CG2 4.08Å; L908-L938 HydrophobicContact CD2-CD2 4.44Å; L908-L945 HydrophobicContact CB-CD1 4.36Å; L908-L945 HydrophobicContact CB-CD2 4.17Å; L908-L945 HydrophobicContact CD1-CD1 4.3Å
909	V	96.2	Very high	93.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-66.3	-38.9	-179	176.9	0	0	0	0	111.6	V883 I884 L887 M905 E906 I913 V929	V883-V909 HydrophobicContact CB-CG1 4.24Å; V883-V909 HydrophobicContact CG1-CG1 3.91Å; V883-V909 HydrophobicContact CG1-CG2 4.41Å; I884-V909 HydrophobicContact CD1-CB 4.14Å; I884-V909 HydrophobicContact CD1-CG1 4.15Å; I884-V909 HydrophobicContact CG1-CB 3.71Å; I884-V909 HydrophobicContact CG1-CG1 3.58Å; I884-V909 HydrophobicContact CG1-CG2 4.08Å; L887-V909 HydrophobicContact CD1-CG2 3.58Å; M905-V909 WeakPolarHBondContact O-CG2 3.46Å; M905-V909 PolarHBondContact O-N 3.42Å; M905-V909 VanDerWaalsContact O-N 3.09Å; E906-V909 PolarHBondContact O-N 2.96Å; V909-I913 HydrophobicContact CG1-CD1 3.53Å; V909-I913 HydrophobicContact CG1-CG1 4.34Å; V909-I913 WeakPolarHBondContact O-CB 3.19Å; V909-I913 WeakPolarHBondContact O-CG1 3.28Å; V909-I913 PolarHBondContact O-N 3.45Å; V909-V929 HydrophobicContact CB-CG2 4.46Å; V909-V929 HydrophobicContact CG1-CG2 4.24Å; V909-V929 HydrophobicContact CG2-CG1 4.14Å; V909-V929 HydrophobicContact CG2-CG2 4.12Å
910	E	95.8	Very high	93.5	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-48.7	173.4	-168.9	-87.8	175.3	0	0	111.8	W869 R873 A874 L877 E906 L908 V912 I913 S914	W869-E910 HydrophobicContact CH2-CB 3.56Å; W869-E910 HydrophobicContact CH2-CG 3.7Å; W869-E910 HydrophobicContact CZ2-CB 4.26Å; W869-E910 HydrophobicContact CZ2-CG 4.01Å; W869-E910 HydrophobicContact CZ3-CB 4.43Å; R873-E910 HydrophobicContact CB-CG 4.16Å; R873-E910 IonicContact CZ-OE1 3.69Å; R873-E910 VanDerWaalsContact CZ-OE1 3.24Å; R873-E910 IonicContact NE-OE1 2.79Å; R873-E910 PolarHBondContact NE-OE1 3.03Å; R873-E910 IonicContact NH2-OE1 2.96Å; R873-E910 PolarHBondContact NH2-OE1 2.99Å; A874-E910 HydrophobicContact CB-CB 4.36Å; A874-E910 HydrophobicContact CB-CG 4.18Å; L877-E910 HydrophobicContact CD2-CG 4.32Å; E906-E910 PolarHBondContact O-N 2.8Å; E906-E910 VanDerWaalsContact O-N 3.09Å; L908-E910 PolarHBondContact O-N 3.26Å; E910-V912 PolarHBondContact O-N 3.43Å; E910-I913 PolarHBondContact O-N 2.86Å; E910-S914 WeakPolarHBondContact O-CB 3.49Å; E910-S914 PolarHBondContact O-N 3.5Å; E910-S914 PolarHBondContact O-OG 3.14Å
911	K	94.5	Very high	93.7	Very high	73 Å²	73	35.8 Å²	35.8	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-61.6	-43.1	179.1	-74.6	179.6	-178.9	171.9	0	111.7	L907 L908 S914 S915 L945 M946	L907-K911 HydrophobicContact CD1-CD 4.32Å; L907-K911 HydrophobicContact CD1-CG 4.45Å; L907-K911 HydrophobicContact CG-CD 4.42Å; L907-K911 WeakPolarHBondContact O-CB 3.46Å; L907-K911 WeakPolarHBondContact O-CG 3.2Å; L907-K911 PolarHBondContact O-N 3.42Å; L908-K911 PolarHBondContact O-N 2.8Å; K911-S914 PolarHBondContact O-OG 2.95Å; K911-S915 VanDerWaalsContact O-CB 3.32Å; K911-S915 WeakPolarHBondContact O-CB 3.25Å; K911-S915 PolarHBondContact O-N 2.79Å; K911-S915 PolarHBondContact O-OG 3.39Å; K911-L945 HydrophobicContact CD-CD1 3.94Å; K911-M946 PolarHBondContact NZ-O 3.37Å
912	V	94.9	Very high	93.8	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-44.3	-179.8	173.1	0	0	0	0	112	L908 E910 S915 R928 V929 C932	L908-V912 HydrophobicContact CD1-CG2 3.92Å; L908-V912 HydrophobicContact CG-CG2 4.36Å; L908-V912 WeakPolarHBondContact O-CB 3.42Å; L908-V912 WeakPolarHBondContact O-CG2 3.42Å; L908-V912 PolarHBondContact O-N 3.15Å; E910-V912 PolarHBondContact O-N 3.43Å; V912-S915 PolarHBondContact O-OG 3.48Å; V912-R928 HydrophobicContact CG1-CB 4.18Å; V912-R928 HydrophobicContact CG1-CG 3.66Å; V912-R928 WeakPolarHBondContact CG1-O 3.23Å; V912-R928 PolarHBondContact O-NE 3.49Å; V912-V929 HydrophobicContact CB-CG2 4.08Å; V912-V929 HydrophobicContact CG1-CG2 3.83Å; V912-C932 HydrophobicContact CG1-CB 4.19Å; V912-C932 HydrophobicContact CG2-CB 3.61Å; V912-C932 VanDerWaalsContact CG2-SG 3.53Å
913	I	95.6	Very high	93.9	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-76.5	-36.3	-179.4	-61.6	170.7	0	0	0	111.1	L877 C880 V909 E910 S915 A916 L920 A925	L877-I913 HydrophobicContact CD1-CG2 4.08Å; L877-I913 HydrophobicContact CD2-CB 3.8Å; L877-I913 HydrophobicContact CD2-CG2 3.73Å; L877-I913 HydrophobicContact CG-CB 4.37Å; L877-I913 HydrophobicContact CG-CG2 3.73Å; C880-I913 HydrophobicContact CB-CD1 4.09Å; V909-I913 HydrophobicContact CG1-CD1 3.53Å; V909-I913 HydrophobicContact CG1-CG1 4.34Å; V909-I913 WeakPolarHBondContact O-CB 3.19Å; V909-I913 WeakPolarHBondContact O-CG1 3.28Å; V909-I913 PolarHBondContact O-N 3.45Å; E910-I913 PolarHBondContact O-N 2.86Å; I913-S915 VanDerWaalsContact C-N 3.31Å; I913-S915 PolarHBondContact O-N 3.24Å; I913-A916 VanDerWaalsContact O-CB 3.26Å; I913-A916 WeakPolarHBondContact O-CB 3.42Å; I913-A916 PolarHBondContact O-N 3.14Å; I913-A916 VanDerWaalsContact O-N 3.17Å; I913-L920 HydrophobicContact CG2-CD1 4.36Å; I913-A925 HydrophobicContact CD1-CB 3.82Å; I913-A925 HydrophobicContact CG1-CB 4.13Å
914	S	94.8	Very high	93.9	Very high	49 Å²	49	34.6 Å²	34.6	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-72.3	-21.8	178.4	65.5	0	0	0	0	113.6	E910 K911 A916	E910-S914 WeakPolarHBondContact O-CB 3.49Å; E910-S914 PolarHBondContact O-N 3.5Å; E910-S914 PolarHBondContact O-OG 3.14Å; K911-S914 PolarHBondContact O-OG 2.95Å; S914-A916 PolarHBondContact O-N 3.42Å
915	S	94.1	Very high	93.9	Very high	72 Å²	72	34.5 Å²	34.5	50%	0.503	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.1	169.6	72.8	0	0	0	0	114.5	K911 V912 I913 R928	K911-S915 VanDerWaalsContact O-CB 3.32Å; K911-S915 WeakPolarHBondContact O-CB 3.25Å; K911-S915 PolarHBondContact O-N 2.79Å; K911-S915 PolarHBondContact O-OG 3.39Å; V912-S915 PolarHBondContact O-OG 3.48Å; I913-S915 VanDerWaalsContact C-N 3.31Å; I913-S915 PolarHBondContact O-N 3.24Å; S915-R928 PolarHBondContact O-NH2 2.91Å; S915-R928 PolarHBondContact OG-NH2 3.14Å
916	A	92.8	Very high	94	Very high	22 Å²	22	34.4 Å²	34.4	18%	0.182	22%	0.219	C	C	.	.	S	Bend	trans	-79.3	145	177.6	0	0	0	0	0	111.7	I913 S914 G918 L920	I913-A916 VanDerWaalsContact O-CB 3.26Å; I913-A916 WeakPolarHBondContact O-CB 3.42Å; I913-A916 PolarHBondContact O-N 3.14Å; I913-A916 VanDerWaalsContact O-N 3.17Å; S914-A916 PolarHBondContact O-N 3.42Å; A916-G918 PolarHBondContact O-N 3.42Å; A916-G918 VanDerWaalsContact O-N 3.11Å; A916-L920 HydrophobicContact CB-CD1 3.93Å; A916-L920 HydrophobicContact CB-CD2 4.06Å; A916-L920 HydrophobicContact CB-CG 3.96Å
917	S	86.7	Confident	94	Very high	143 Å²	143	36.9 Å²	36.9	100%	1	23%	0.228	S	C	*	.	S	Bend	trans	-72	1.6	179.1	52.4	0	0	0	0	114.7
918	G	89.8	Confident	94	Very high	36 Å²	36	40.8 Å²	40.8	37%	0.371	24%	0.243	S	C	.	.	S	Bend	trans	-175.8	173.7	-180	0	0	0	0	0	112.9	A916 L920	A916-G918 PolarHBondContact O-N 3.42Å; A916-G918 VanDerWaalsContact O-N 3.11Å; G918-L920 PolarHBondContact O-N 3.42Å
919	P	90.8	Very high	94.1	Very high	106 Å²	106	40.6 Å²	40.6	69%	0.688	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-65.8	124.3	-177.5	26.2	-34.1	0	0	0	112.2	Q878	Q878-P919 HydrophobicContact CB-CB 4.31Å
920	L	93.7	Very high	94.1	Very high	28 Å²	28	40.7 Å²	40.7	15%	0.147	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-88.8	148.9	178.7	-57.9	-176.5	0	0	0	112	Q878 S879 I913 A916 G918 E924 A925 R928	Q878-L920 PolarHBondContact NE2-O 3.12Å; Q878-L920 VanDerWaalsContact NE2-O 3.09Å; S879-L920 PolarHBondContact OG-O 2.66Å; I913-L920 HydrophobicContact CG2-CD1 4.36Å; A916-L920 HydrophobicContact CB-CD1 3.93Å; A916-L920 HydrophobicContact CB-CD2 4.06Å; A916-L920 HydrophobicContact CB-CG 3.96Å; G918-L920 PolarHBondContact O-N 3.42Å; L920-E924 HydrophobicContact CB-CB 4.46Å; L920-E924 HydrophobicContact CD2-CG 4.15Å; L920-A925 HydrophobicContact CB-CB 3.97Å; L920-A925 HydrophobicContact CD1-CB 4.28Å; L920-R928 HydrophobicContact CD1-CB 4.4Å
921	S	94.4	Very high	94.1	Very high	40 Å²	40	44.1 Å²	44.1	28%	0.28	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-77.1	163	165.2	78.5	0	0	0	0	110.5	D670 S879 G923 E924 A925	D670-S921 WeakPolarHBondContact OD1-CB 3.44Å; D670-S921 PolarHBondContact OD1-OG 3.19Å; D670-S921 PolarHBondContact OD2-OG 3.47Å; S879-S921 VanDerWaalsContact OG-C 3.31Å; S921-G923 VanDerWaalsContact C-N 3.28Å; S921-G923 PolarHBondContact O-N 3.23Å; S921-E924 PolarHBondContact O-N 3.27Å; S921-E924 PolarHBondContact OG-N 2.66Å; S921-A925 VanDerWaalsContact O-CB 3.25Å; S921-A925 WeakPolarHBondContact O-CB 3.45Å; S921-A925 PolarHBondContact O-N 3.09Å
922	P	94.9	Very high	94.2	Very high	17 Å²	17	42 Å²	42	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-37.7	-179.3	-27.1	35.9	0	0	0	114.2	D670 I673 M674 S879 I882 M926	D670-P922 WeakPolarHBondContact OD1-CD 3.32Å; I673-P922 HydrophobicContact CB-CB 4.33Å; I673-P922 VanDerWaalsContact CD1-O 3.27Å; I673-P922 WeakPolarHBondContact CD1-O 3.47Å; I673-P922 HydrophobicContact CG2-CB 3.73Å; M674-P922 HydrophobicContact CG-CG 4.42Å; M674-P922 HydrophobicContact SD-CB 4.45Å; M674-P922 HydrophobicContact SD-CG 3.9Å; S879-P922 WeakPolarHBondContact OG-CD 3.31Å; I882-P922 HydrophobicContact CD1-CG 4.43Å; I882-P922 HydrophobicContact CG2-CB 4.35Å; P922-M926 VanDerWaalsContact O-CB 3.31Å; P922-M926 WeakPolarHBondContact O-CB 3.48Å; P922-M926 PolarHBondContact O-N 3.23Å
923	G	93.8	Very high	94.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-51.2	173.2	0	0	0	0	0	112.6	D670 S921 M926 R927	D670-G923 WeakPolarHBondContact OD1-CA 3.37Å; D670-G923 PolarHBondContact OD1-N 2.64Å; S921-G923 VanDerWaalsContact C-N 3.28Å; S921-G923 PolarHBondContact O-N 3.23Å; G923-M926 PolarHBondContact O-N 3Å; G923-R927 VanDerWaalsContact O-CB 3.27Å; G923-R927 WeakPolarHBondContact O-CB 3.38Å; G923-R927 PolarHBondContact O-N 3.45Å
924	E	93.9	Very high	94.1	Very high	95 Å²	95	42.2 Å²	42.2	44%	0.444	26%	0.255	S	S	.	.	H	α-helix	trans	-71.9	-35	-178	-158.6	71.5	165.6	0	0	112.3	L920 S921 R927 R928	L920-E924 HydrophobicContact CB-CB 4.46Å; L920-E924 HydrophobicContact CD2-CG 4.15Å; S921-E924 PolarHBondContact O-N 3.27Å; S921-E924 PolarHBondContact OG-N 2.66Å; E924-R927 PolarHBondContact O-N 3.29Å; E924-R927 WeakPolarHBondContact OE2-CD 3.09Å; E924-R927 IonicContact OE2-NE 2.73Å; E924-R927 PolarHBondContact OE2-NE 3.15Å; E924-R928 VanDerWaalsContact O-CB 3.3Å; E924-R928 WeakPolarHBondContact O-CB 3.32Å; E924-R928 PolarHBondContact O-N 3.36Å
925	A	96	Very high	94	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-45.5	174.2	0	0	0	0	0	111.9	V883 I913 L920 S921 R928 V929	V883-A925 HydrophobicContact CG2-CB 3.76Å; I913-A925 HydrophobicContact CD1-CB 3.82Å; I913-A925 HydrophobicContact CG1-CB 4.13Å; L920-A925 HydrophobicContact CB-CB 3.97Å; L920-A925 HydrophobicContact CD1-CB 4.28Å; S921-A925 VanDerWaalsContact O-CB 3.25Å; S921-A925 WeakPolarHBondContact O-CB 3.45Å; S921-A925 PolarHBondContact O-N 3.09Å; A925-R928 PolarHBondContact O-N 3.39Å; A925-V929 WeakPolarHBondContact O-CG2 3.3Å; A925-V929 PolarHBondContact O-N 3.49Å; A925-V929 VanDerWaalsContact O-N 3.11Å
926	M	95.6	Very high	93.9	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-46.1	174.1	179.7	65.6	73.3	0	0	111.5	I673 V883 V886 L887 P922 G923 R928 V929 L930 L979	I673-M926 HydrophobicContact CD1-CB 3.44Å; I673-M926 VanDerWaalsContact CD1-CB 3.44Å; I673-M926 HydrophobicContact CD1-CG 3.84Å; V883-M926 HydrophobicContact CG1-CE 4.05Å; V883-M926 HydrophobicContact CG1-SD 4.33Å; V883-M926 HydrophobicContact CG2-CB 4.36Å; V886-M926 HydrophobicContact CB-CE 3.91Å; V886-M926 HydrophobicContact CG1-CE 3.53Å; L887-M926 HydrophobicContact CD2-CE 4.2Å; L887-M926 HydrophobicContact CD2-SD 3.81Å; L887-M926 HydrophobicContact CG-CE 4.09Å; L887-M926 HydrophobicContact CG-SD 4.16Å; P922-M926 VanDerWaalsContact O-CB 3.31Å; P922-M926 WeakPolarHBondContact O-CB 3.48Å; P922-M926 PolarHBondContact O-N 3.23Å; G923-M926 PolarHBondContact O-N 3Å; M926-R928 PolarHBondContact O-N 2.87Å; M926-V929 PolarHBondContact O-N 3.24Å; M926-L930 HydrophobicContact CG-CD1 4.35Å; M926-L930 WeakPolarHBondContact O-CG 3.12Å; M926-L930 PolarHBondContact O-N 2.87Å; M926-L930 HydrophobicContact SD-CG 4.47Å; M926-L979 HydrophobicContact CG-CD1 4.46Å
927	R	95.6	Very high	93.8	Very high	61 Å²	61	42.8 Å²	42.8	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-52.9	-51.8	175.1	177.6	-171.1	-62.8	-96	-6.8	111	D669 G923 E924 V929 L930 E931 L979	D669-R927 IonicContact OD2-CZ 3.16Å; D669-R927 IonicContact OD2-NH2 3.27Å; D669-R927 PolarHBondContact OD2-NH2 3.15Å; G923-R927 VanDerWaalsContact O-CB 3.27Å; G923-R927 WeakPolarHBondContact O-CB 3.38Å; G923-R927 PolarHBondContact O-N 3.45Å; E924-R927 PolarHBondContact O-N 3.29Å; E924-R927 WeakPolarHBondContact OE2-CD 3.09Å; E924-R927 IonicContact OE2-NE 2.73Å; E924-R927 PolarHBondContact OE2-NE 3.15Å; R927-V929 VanDerWaalsContact C-N 3.34Å; R927-V929 PolarHBondContact O-N 3.46Å; R927-L930 CarbonylContact O-C 3.56Å; R927-L930 PolarHBondContact O-N 3.42Å; R927-L930 VanDerWaalsContact O-N 3.16Å; R927-E931 VanDerWaalsContact CG-OE1 3.29Å; R927-E931 WeakPolarHBondContact CG-OE1 3.11Å; R927-E931 WeakPolarHBondContact O-CG 3.42Å; R927-E931 PolarHBondContact O-N 3.2Å; R927-L979 HydrophobicContact CB-CD1 4.16Å; R927-L979 HydrophobicContact CB-CD2 4.12Å; R927-L979 HydrophobicContact CG-CD2 4.09Å; R927-L979 VanDerWaalsContact NH2-CD2 3.26Å
928	R	96.1	Very high	94	Very high	81 Å²	81	36 Å²	36	31%	0.306	20%	0.204	S	C	.	.	H	α-helix	trans	-62.6	-35.2	-179.7	-166.2	-174.6	172.7	79.9	-3.1	113.4	V912 S915 L920 E924 A925 M926 E931 C932	V912-R928 HydrophobicContact CG1-CB 4.18Å; V912-R928 HydrophobicContact CG1-CG 3.66Å; V912-R928 WeakPolarHBondContact CG1-O 3.23Å; V912-R928 PolarHBondContact O-NE 3.49Å; S915-R928 PolarHBondContact O-NH2 2.91Å; S915-R928 PolarHBondContact OG-NH2 3.14Å; L920-R928 HydrophobicContact CD1-CB 4.4Å; E924-R928 VanDerWaalsContact O-CB 3.3Å; E924-R928 WeakPolarHBondContact O-CB 3.32Å; E924-R928 PolarHBondContact O-N 3.36Å; A925-R928 PolarHBondContact O-N 3.39Å; M926-R928 PolarHBondContact O-N 2.87Å; R928-E931 PolarHBondContact O-N 3.1Å; R928-C932 WeakPolarHBondContact O-CB 3.39Å; R928-C932 PolarHBondContact O-N 2.81Å
929	V	96.7	Very high	94.1	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-43.5	173.5	173.5	0	0	0	0	111.3	V883 L887 V909 V912 A925 M926 R927 E931 C932 I933	V883-V929 HydrophobicContact CG1-CG2 4.35Å; L887-V929 HydrophobicContact CD1-CG1 3.87Å; V909-V929 HydrophobicContact CB-CG2 4.46Å; V909-V929 HydrophobicContact CG1-CG2 4.24Å; V909-V929 HydrophobicContact CG2-CG1 4.14Å; V909-V929 HydrophobicContact CG2-CG2 4.12Å; V912-V929 HydrophobicContact CB-CG2 4.08Å; V912-V929 HydrophobicContact CG1-CG2 3.83Å; A925-V929 WeakPolarHBondContact O-CG2 3.3Å; A925-V929 PolarHBondContact O-N 3.49Å; A925-V929 VanDerWaalsContact O-N 3.11Å; M926-V929 PolarHBondContact O-N 3.24Å; R927-V929 VanDerWaalsContact C-N 3.34Å; R927-V929 PolarHBondContact O-N 3.46Å; V929-E931 VanDerWaalsContact C-N 3.32Å; V929-E931 PolarHBondContact O-N 3.03Å; V929-C932 PolarHBondContact O-N 3.5Å; V929-I933 HydrophobicContact CG1-CD1 3.89Å; V929-I933 WeakPolarHBondContact O-CG1 3.32Å; V929-I933 PolarHBondContact O-N 2.79Å
930	L	96.1	Very high	93.8	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-35.4	174.4	-64.4	178.9	0	0	0	111.9	W897 M926 R927 S934 T972 A975 L976 L979	W897-L930 HydrophobicContact CH2-CD2 3.77Å; W897-L930 HydrophobicContact CZ2-CD2 4.37Å; M926-L930 HydrophobicContact CG-CD1 4.35Å; M926-L930 WeakPolarHBondContact O-CG 3.12Å; M926-L930 PolarHBondContact O-N 2.87Å; M926-L930 HydrophobicContact SD-CG 4.47Å; R927-L930 CarbonylContact O-C 3.56Å; R927-L930 PolarHBondContact O-N 3.42Å; R927-L930 VanDerWaalsContact O-N 3.16Å; L930-S934 WeakPolarHBondContact O-CB 3.28Å; L930-S934 PolarHBondContact O-N 3.05Å; L930-S934 PolarHBondContact O-OG 2.87Å; L930-T972 HydrophobicContact CB-CG2 4.02Å; L930-T972 HydrophobicContact CD2-CG2 3.66Å; L930-T972 HydrophobicContact CG-CG2 4.46Å; L930-T972 WeakPolarHBondContact O-CG2 3.27Å; L930-A975 HydrophobicContact CD1-CB 4.25Å; L930-A975 HydrophobicContact CD2-CB 4.3Å; L930-L976 HydrophobicContact CB-CB 4.26Å; L930-L976 HydrophobicContact CB-CD1 4.21Å; L930-L979 HydrophobicContact CD1-CD1 3.83Å
931	E	95.8	Very high	93.3	Very high	80 Å²	80	42 Å²	42	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-50.4	172.1	-72.9	164.8	175.4	0	0	111.4	R927 R928 V929 I933 S934 T935 L976	R927-E931 VanDerWaalsContact CG-OE1 3.29Å; R927-E931 WeakPolarHBondContact CG-OE1 3.11Å; R927-E931 WeakPolarHBondContact O-CG 3.42Å; R927-E931 PolarHBondContact O-N 3.2Å; R928-E931 PolarHBondContact O-N 3.1Å; V929-E931 VanDerWaalsContact C-N 3.32Å; V929-E931 PolarHBondContact O-N 3.03Å; E931-I933 PolarHBondContact O-N 3.27Å; E931-S934 WeakPolarHBondContact O-CB 3.23Å; E931-S934 PolarHBondContact O-N 3.45Å; E931-S934 VanDerWaalsContact O-N 3.09Å; E931-T935 PolarHBondContact O-N 2.84Å; E931-T935 PolarHBondContact O-OG1 2.96Å; E931-L976 HydrophobicContact CG-CD1 3.68Å; E931-L976 HydrophobicContact CG-CD2 3.91Å; E931-L976 HydrophobicContact CG-CG 4.46Å
932	C	95.1	Very high	92.5	Very high	29 Å²	29	41.3 Å²	41.3	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-36.2	-177.5	-172.9	0	0	0	0	113.9	V912 R928 V929 T935 I937	V912-C932 HydrophobicContact CG1-CB 4.19Å; V912-C932 HydrophobicContact CG2-CB 3.61Å; V912-C932 VanDerWaalsContact CG2-SG 3.53Å; R928-C932 WeakPolarHBondContact O-CB 3.39Å; R928-C932 PolarHBondContact O-N 2.81Å; V929-C932 PolarHBondContact O-N 3.5Å; C932-T935 PolarHBondContact O-OG1 3.09Å; C932-I937 VanDerWaalsContact O-CG2 3.29Å; C932-I937 WeakPolarHBondContact O-CG2 3.35Å
933	I	94.4	Very high	91.8	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-70.2	-38.3	171.3	-61.4	162.1	0	0	0	110.3	W897 L908 V929 E931 T935 G936 L938 I968 T972	W897-I933 HydrophobicContact CH2-CD1 4.19Å; W897-I933 HydrophobicContact CZ3-CD1 4.07Å; L908-I933 HydrophobicContact CD2-CD1 3.86Å; L908-I933 HydrophobicContact CD2-CG1 3.61Å; V929-I933 HydrophobicContact CG1-CD1 3.89Å; V929-I933 WeakPolarHBondContact O-CG1 3.32Å; V929-I933 PolarHBondContact O-N 2.79Å; E931-I933 PolarHBondContact O-N 3.27Å; I933-T935 VanDerWaalsContact C-N 3.29Å; I933-T935 PolarHBondContact O-N 3.32Å; I933-G936 PolarHBondContact O-N 3.39Å; I933-L938 HydrophobicContact CG2-CD1 3.93Å; I933-L938 HydrophobicContact CG2-CG 4.42Å; I933-I968 HydrophobicContact CG2-CG2 4.18Å; I933-T972 HydrophobicContact CB-CG2 3.55Å; I933-T972 HydrophobicContact CD1-CG2 4.5Å; I933-T972 HydrophobicContact CG2-CG2 3.7Å; I933-T972 WeakPolarHBondContact CG2-OG1 3.47Å
934	S	94.6	Very high	91.2	Very high	16 Å²	16	46.4 Å²	46.4	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-28.4	179.6	-64.8	0	0	0	0	113.7	L930 E931 G936 T972 Q973 L976	L930-S934 WeakPolarHBondContact O-CB 3.28Å; L930-S934 PolarHBondContact O-N 3.05Å; L930-S934 PolarHBondContact O-OG 2.87Å; E931-S934 WeakPolarHBondContact O-CB 3.23Å; E931-S934 PolarHBondContact O-N 3.45Å; E931-S934 VanDerWaalsContact O-N 3.09Å; S934-G936 PolarHBondContact O-N 3.42Å; S934-T972 WeakPolarHBondContact OG-CG2 3.07Å; S934-Q973 PolarHBondContact O-NE2 3.45Å; S934-Q973 WeakPolarHBondContact OG-CA 3.25Å; S934-Q973 PolarHBondContact OG-N 3.35Å; S934-L976 WeakPolarHBondContact OG-CD2 3.48Å
935	T	93.3	Very high	91	Very high	118 Å²	118	42.1 Å²	42.1	72%	0.724	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	1.9	170.6	50.8	0	0	0	0	114	E931 C932 I933	E931-T935 PolarHBondContact O-N 2.84Å; E931-T935 PolarHBondContact O-OG1 2.96Å; C932-T935 PolarHBondContact O-OG1 3.09Å; I933-T935 VanDerWaalsContact C-N 3.29Å; I933-T935 PolarHBondContact O-N 3.32Å
936	G	90.8	Very high	90.7	Very high	7 Å²	7	46 Å²	46	7%	0.072	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	25	173	0	0	0	0	0	115.1	I933 S934 L938 L939	I933-G936 PolarHBondContact O-N 3.39Å; S934-G936 PolarHBondContact O-N 3.42Å; G936-L938 PolarHBondContact O-N 3.25Å; G936-L939 VanDerWaalsContact O-CB 3.31Å; G936-L939 WeakPolarHBondContact O-CB 3.29Å; G936-L939 PolarHBondContact O-N 3.03Å
937	I	92.1	Very high	90.6	Very high	30 Å²	30	46.6 Å²	46.6	15%	0.154	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.6	178.3	-164.6	168	0	0	0	113.8	L908 C932 P943	L908-I937 HydrophobicContact CD1-CD1 4.09Å; L908-I937 HydrophobicContact CD1-CG2 4.08Å; C932-I937 VanDerWaalsContact O-CG2 3.29Å; C932-I937 WeakPolarHBondContact O-CG2 3.35Å; I937-P943 HydrophobicContact CG1-CG 4.06Å
938	L	91.2	Very high	90.4	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-20.6	177.1	-53.9	-178.7	0	0	0	113.4	L908 I933 G936 L957 R965 I968	L908-L938 HydrophobicContact CD2-CD2 4.44Å; I933-L938 HydrophobicContact CG2-CD1 3.93Å; I933-L938 HydrophobicContact CG2-CG 4.42Å; G936-L938 PolarHBondContact O-N 3.25Å; L938-L957 HydrophobicContact CB-CD1 4.42Å; L938-L957 HydrophobicContact CD2-CD1 3.75Å; L938-L957 HydrophobicContact CD2-CD2 3.83Å; L938-L957 HydrophobicContact CD2-CG 4.47Å; L938-R965 HydrophobicContact CB-CB 4.21Å; L938-R965 WeakPolarHBondContact O-CD 3.48Å; L938-R965 PolarHBondContact O-NH1 3.2Å; L938-R965 VanDerWaalsContact O-NH1 3.13Å; L938-I968 HydrophobicContact CD1-CB 4.24Å; L938-I968 HydrophobicContact CD1-CG2 3.62Å
939	L	90.8	Very high	90.2	Very high	59 Å²	59	43.9 Å²	43.9	31%	0.309	26%	0.264	S	S	.	.	S	Bend	trans	-65.6	156.7	-175.4	-61.3	-179.4	0	0	0	111.4	G936 D941 G942	G936-L939 VanDerWaalsContact O-CB 3.31Å; G936-L939 WeakPolarHBondContact O-CB 3.29Å; G936-L939 PolarHBondContact O-N 3.03Å; L939-D941 PolarHBondContact O-N 2.78Å; L939-G942 PolarHBondContact O-N 2.89Å
940	P	84.3	Confident	89.9	Confident	77 Å²	77	46.5 Å²	46.5	50%	0.5	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33	-177	22.5	-34.3	0	0	0	113.8	G942 L962	P940-G942 PolarHBondContact O-N 3.45Å; P940-L962 HydrophobicContact CB-CD2 3.97Å; P940-L962 HydrophobicContact CG-CD2 4.06Å
941	D	83.6	Confident	89.5	Confident	159 Å²	159	54.7 Å²	54.7	85%	0.85	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	2.2	177.1	-44.7	-71	0	0	0	113.4	L939	L939-D941 PolarHBondContact O-N 2.78Å
942	G	78.6	Confident	89.2	Confident	25 Å²	25	56 Å²	56	26%	0.258	32%	0.318	S	S	.	.	S	Bend	trans	-76.9	168.2	176	0	0	0	0	0	112.9	L939 P940 G944	L939-G942 PolarHBondContact O-N 2.89Å; P940-G942 PolarHBondContact O-N 3.45Å; G942-G944 PolarHBondContact O-N 3.45Å
943	P	80.2	Confident	88.7	Confident	107 Å²	107	60.3 Å²	60.3	70%	0.695	35%	0.346	S	S	*	.			trans	-71.1	6.6	-180	31.9	-37.6	0	0	0	114.6	I937	I937-P943 HydrophobicContact CG1-CG 4.06Å
944	G	79.6	Confident	88.4	Confident	18 Å²	18	62.7 Å²	62.7	19%	0.186	36%	0.36	C	S	.	.			trans	64.2	-177.1	-174.9	0	0	0	0	0	114.1	G942	G942-G944 PolarHBondContact O-N 3.45Å
945	L	89.9	Confident	88.1	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.026	36%	0.363	C	S	.	.			trans	-128.1	72.6	175.3	-165.8	72.9	0	0	0	110.9	A904 L907 L908 K911 D947 D955 V956 L957	A904-L945 HydrophobicContact CB-CD2 3.94Å; A904-L945 VanDerWaalsContact O-CD2 3.27Å; A904-L945 WeakPolarHBondContact O-CD2 3.44Å; L907-L945 HydrophobicContact CB-CD2 4.21Å; L907-L945 HydrophobicContact CD2-CD2 4.13Å; L907-L945 HydrophobicContact CD2-CG 3.91Å; L907-L945 HydrophobicContact CG-CD1 4.31Å; L907-L945 HydrophobicContact CG-CD2 4.21Å; L907-L945 HydrophobicContact CG-CG 4.13Å; L908-L945 HydrophobicContact CB-CD1 4.36Å; L908-L945 HydrophobicContact CB-CD2 4.17Å; L908-L945 HydrophobicContact CD1-CD1 4.3Å; K911-L945 HydrophobicContact CD-CD1 3.94Å; L945-D947 PolarHBondContact O-N 2.75Å; L945-D955 PolarHBondContact N-OD1 3.15Å; L945-V956 WeakPolarHBondContact O-CG2 3.48Å; L945-V956 PolarHBondContact O-N 2.81Å; L945-L957 HydrophobicContact CB-CD1 4.09Å; L945-L957 HydrophobicContact CB-CD2 4.39Å; L945-L957 HydrophobicContact CB-CG 3.9Å; L945-L957 HydrophobicContact CD2-CD2 4.39Å
946	M	90.4	Very high	87.9	Confident	80 Å²	80	58.7 Å²	58.7	39%	0.394	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-53.4	129.2	178.9	-58.2	-61.6	101.5	0	0	112.8	K911 P953 T954 D955	K911-M946 PolarHBondContact NZ-O 3.37Å; M946-P953 HydrophobicContact SD-CB 4.37Å; M946-T954 WeakPolarHBondContact CA-O 3.22Å; M946-D955 HydrophobicContact CE-CB 3.69Å
947	D	93	Very high	87.8	Confident	20 Å²	20	58.4 Å²	58.4	11%	0.107	33%	0.331	C	S	.	.			trans	-74	122	179.9	-162.1	-37.9	0	0	0	112.2	H866 W903 L945 C949 E950 T954 V956	H866-D947 IonicContact NE2-OD2 2.63Å; W903-D947 PolarHBondContact NE1-OD2 2.87Å; L945-D947 PolarHBondContact O-N 2.75Å; D947-C949 VanDerWaalsContact C-N 3.28Å; D947-C949 PolarHBondContact O-N 2.92Å; D947-C949 WeakPolarHBondContact OD1-CA 3.25Å; D947-C949 VanDerWaalsContact OD1-CB 3.28Å; D947-C949 WeakPolarHBondContact OD1-CB 3.5Å; D947-C949 PolarHBondContact OD1-N 2.78Å; D947-E950 HydrophobicContact CB-CB 4.47Å; D947-E950 HydrophobicContact CB-CG 4.45Å; D947-T954 PolarHBondContact N-O 3.35Å; D947-V956 HydrophobicContact CB-CG2 3.73Å
948	P	92.5	Very high	87.5	Confident	64 Å²	64	64 Å²	64	42%	0.416	36%	0.356	S	S	.	.	S	Bend	trans	-80.8	-2.8	177.3	35.1	-37.9	0	0	0	114.1	W869 W903 L907	W869-P948 HydrophobicContact CD2-CG 4.29Å; W869-P948 HydrophobicContact CG-CG 4.4Å; W869-P948 HydrophobicContact CZ2-CG 4.03Å; W903-P948 HydrophobicContact CZ2-CG 4.46Å; L907-P948 HydrophobicContact CD1-CG 3.63Å
949	C	91.9	Very high	87.2	Confident	20 Å²	20	68.4 Å²	68.4	14%	0.135	39%	0.387	C	S	.	.	S	Bend	trans	-99.4	-20.7	179.6	-68.9	0	0	0	0	113.4	R865 W869 W903 D947	R865-C949 HydrophobicContact CB-CB 3.87Å; R865-C949 PolarHBondContact NH1-O 3.49Å; W869-C949 VanDerWaalsContact CB-SG 3.55Å; W903-C949 HydrophobicContact CZ2-CB 4.37Å; D947-C949 VanDerWaalsContact C-N 3.28Å; D947-C949 PolarHBondContact O-N 2.92Å; D947-C949 WeakPolarHBondContact OD1-CA 3.25Å; D947-C949 VanDerWaalsContact OD1-CB 3.28Å; D947-C949 WeakPolarHBondContact OD1-CB 3.5Å; D947-C949 PolarHBondContact OD1-N 2.78Å
950	E	90.6	Very high	87.1	Confident	56 Å²	56	66 Å²	66	26%	0.262	37%	0.374	S	S	.	.	S	Bend	trans	-85.2	159.2	175.9	-69.3	-56.3	150.9	0	0	113.2	R823 R865 D947	R823-E950 IonicContact CZ-OE2 2.78Å; R823-E950 IonicContact NH1-OE2 3.88Å; R823-E950 PolarHBondContact NH1-OE2 2.94Å; R823-E950 IonicContact NH2-OE2 3.19Å; R823-E950 PolarHBondContact NH2-OE2 3.17Å; R865-E950 IonicContact CZ-OE1 2.7Å; R865-E950 IonicContact CZ-OE2 3.31Å; R865-E950 IonicContact NH1-OE1 2.8Å; R865-E950 PolarHBondContact NH1-OE1 3.12Å; R865-E950 IonicContact NH1-OE2 2.71Å; R865-E950 PolarHBondContact NH1-OE2 2.88Å; R865-E950 IonicContact NH2-OE1 3.16Å; R865-E950 PolarHBondContact NH2-OE1 3.13Å; R865-E950 IonicContact NH2-OE2 3.22Å; D947-E950 HydrophobicContact CB-CB 4.47Å; D947-E950 HydrophobicContact CB-CG 4.45Å
951	K	87.2	Confident	87.4	Confident	175 Å²	175	70.8 Å²	70.8	76%	0.761	39%	0.387	S	S	*	.	S	Bend	trans	-83.1	-33.4	174.7	-78.4	-170.1	174.2	-174.7	0	112.1
952	E	88	Confident	87.8	Confident	107 Å²	107	68.4 Å²	68.4	50%	0.5	37%	0.374	S	S	.	.	S	Bend	trans	-96.3	152.3	-179.5	-72.3	162.4	-134.1	0	0	109	K830 T954	K830-E952 IonicContact NZ-OE1 2.73Å; K830-E952 PolarHBondContact NZ-OE1 3.27Å; K830-E952 IonicContact NZ-OE2 2.82Å; K830-E952 PolarHBondContact NZ-OE2 2.7Å; E952-T954 VanDerWaalsContact C-N 3.28Å; E952-T954 PolarHBondContact O-N 3.04Å; E952-T954 PolarHBondContact O-OG1 3.33Å
953	P	85.5	Confident	88.6	Confident	120 Å²	120	72.4 Å²	72.4	78%	0.779	39%	0.386	S	S	*	.			trans	-73.2	80.2	-177.6	30.4	-35.4	0	0	0	111.4	M946	M946-P953 HydrophobicContact SD-CB 4.37Å
954	T	87.3	Confident	89.2	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.319	36%	0.356	S	S	.	.			trans	-90.3	128.3	-179.8	-51.4	0	0	0	0	111.1	M946 D947 E952	M946-T954 WeakPolarHBondContact CA-O 3.22Å; D947-T954 PolarHBondContact N-O 3.35Å; E952-T954 VanDerWaalsContact C-N 3.28Å; E952-T954 PolarHBondContact O-N 3.04Å; E952-T954 PolarHBondContact O-OG1 3.33Å
955	D	89.8	Confident	89.9	Confident	32 Å²	32	68 Å²	68	17%	0.171	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-84.5	117.6	170.4	-178	25.7	0	0	0	110.4	L945 M946 L957 E958 R965	L945-D955 PolarHBondContact N-OD1 3.15Å; M946-D955 HydrophobicContact CE-CB 3.69Å; D955-L957 PolarHBondContact O-N 2.92Å; D955-L957 VanDerWaalsContact O-N 3.11Å; D955-L957 PolarHBondContact OD1-N 3.42Å; D955-L957 WeakPolarHBondContact OD2-CB 3.2Å; D955-E958 VanDerWaalsContact O-CB 3.3Å; D955-E958 WeakPolarHBondContact O-CB 3.39Å; D955-E958 PolarHBondContact O-N 3.09Å; D955-R965 IonicContact OD2-NH2 3.19Å
956	V	89.6	Confident	90.1	Very high	18 Å²	18	72.8 Å²	72.8	11%	0.109	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.6	178.8	-169.3	0	0	0	0	111.5	W903 A904 L907 L945 D947	W903-V956 HydrophobicContact CB-CG1 4.44Å; W903-V956 HydrophobicContact CG-CG1 4.26Å; A904-V956 HydrophobicContact CB-CB 4.35Å; A904-V956 HydrophobicContact CB-CG1 3.81Å; L907-V956 HydrophobicContact CD2-CG2 3.9Å; L945-V956 WeakPolarHBondContact O-CG2 3.48Å; L945-V956 PolarHBondContact O-N 2.81Å; D947-V956 HydrophobicContact CB-CG2 3.73Å
957	L	87.9	Confident	90.3	Very high	1 Å²	1	71 Å²	71	1%	0.005	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.6	177.2	-48.9	177.5	0	0	0	114	L900 A904 L938 L945 D955 S959 M960 R965	L900-L957 HydrophobicContact CD1-CD2 4.48Å; A904-L957 HydrophobicContact CB-CD2 3.9Å; L938-L957 HydrophobicContact CB-CD1 4.42Å; L938-L957 HydrophobicContact CD2-CD1 3.75Å; L938-L957 HydrophobicContact CD2-CD2 3.83Å; L938-L957 HydrophobicContact CD2-CG 4.47Å; L945-L957 HydrophobicContact CB-CD1 4.09Å; L945-L957 HydrophobicContact CB-CD2 4.39Å; L945-L957 HydrophobicContact CB-CG 3.9Å; L945-L957 HydrophobicContact CD2-CD2 4.39Å; D955-L957 PolarHBondContact O-N 2.92Å; D955-L957 VanDerWaalsContact O-N 3.11Å; D955-L957 PolarHBondContact OD1-N 3.42Å; D955-L957 WeakPolarHBondContact OD2-CB 3.2Å; L957-S959 PolarHBondContact O-N 3.09Å; L957-S959 VanDerWaalsContact O-N 3.13Å; L957-M960 HydrophobicContact CD2-SD 3.82Å; L957-M960 WeakPolarHBondContact O-CB 3.25Å; L957-M960 PolarHBondContact O-N 2.89Å; L957-R965 VanDerWaalsContact C-NH2 3.28Å; L957-R965 PolarHBondContact O-NH2 3.11Å
958	E	85.2	Confident	90.4	Very high	148 Å²	148	70 Å²	70	69%	0.692	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-38.6	-177.8	-172.6	-177.8	174	0	0	112.2	D955 M960	D955-E958 VanDerWaalsContact O-CB 3.3Å; D955-E958 WeakPolarHBondContact O-CB 3.39Å; D955-E958 PolarHBondContact O-N 3.09Å; E958-M960 PolarHBondContact O-N 2.99Å; E958-M960 VanDerWaalsContact O-N 3.13Å
959	S	84.6	Confident	90.5	Very high	93 Å²	93	67.2 Å²	67.2	65%	0.65	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.1	175.7	62.7	0	0	0	0	115.6	L957	L957-S959 PolarHBondContact O-N 3.09Å; L957-S959 VanDerWaalsContact O-N 3.13Å
960	M	89.1	Confident	90.7	Very high	10 Å²	10	68.6 Å²	68.6	5%	0.049	36%	0.356	C	S	.	.	S	Bend	trans	-97.6	117.3	-174.8	-60.4	-179.6	69.4	0	0	112.8	L900 P901 L957 E958 R965 I968	L900-M960 HydrophobicContact CB-CE 4.4Å; L900-M960 HydrophobicContact CD1-CE 3.92Å; L900-M960 HydrophobicContact CD1-SD 3.75Å; P901-M960 WeakPolarHBondContact CD-SD 3.39Å; P901-M960 HydrophobicContact CG-CG 4.11Å; P901-M960 HydrophobicContact CG-SD 4.37Å; L957-M960 HydrophobicContact CD2-SD 3.82Å; L957-M960 WeakPolarHBondContact O-CB 3.25Å; L957-M960 PolarHBondContact O-N 2.89Å; E958-M960 PolarHBondContact O-N 2.99Å; E958-M960 VanDerWaalsContact O-N 3.13Å; M960-R965 HydrophobicContact CB-CG 3.92Å; M960-R965 HydrophobicContact CE-CG 4.43Å; M960-R965 PolarHBondContact O-NE 3.32Å; M960-I968 HydrophobicContact CE-CD1 3.53Å
961	K	91.7	Very high	91	Very high	177 Å²	177	67.7 Å²	67.7	77%	0.77	36%	0.355	S	S	*	.			trans	-52	138.5	169.4	-60.3	-176.3	179.9	-175.2	0	111.2	Q963 A964 R965	K961-Q963 VanDerWaalsContact C-N 3.33Å; K961-Q963 PolarHBondContact O-N 2.84Å; K961-A964 WeakPolarHBondContact O-CA 3.01Å; K961-A964 VanDerWaalsContact O-CB 3.26Å; K961-A964 WeakPolarHBondContact O-CB 3.46Å; K961-A964 PolarHBondContact O-N 2.97Å; K961-R965 PolarHBondContact O-N 3.16Å
962	L	92.1	Very high	91.5	Very high	108 Å²	108	59.4 Å²	59.4	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-49.8	-48.2	-176.4	-61.9	178.2	0	0	0	113.4	P940 A964 R965 E966	P940-L962 HydrophobicContact CB-CD2 3.97Å; P940-L962 HydrophobicContact CG-CD2 4.06Å; L962-A964 VanDerWaalsContact C-N 3.27Å; L962-A964 PolarHBondContact O-N 3.23Å; L962-R965 WeakPolarHBondContact O-CA 3.06Å; L962-R965 WeakPolarHBondContact O-CB 3.27Å; L962-R965 PolarHBondContact O-N 3.34Å; L962-E966 PolarHBondContact O-N 2.95Å
963	Q	94.4	Very high	91.9	Very high	110 Å²	110	58.3 Å²	58.3	51%	0.514	31%	0.314	S	S	.	.	H	α-helix	trans	-53.9	-41.5	176.1	-169.2	62.7	64.8	0	0	112.7	K961 R965 E966 D967	K961-Q963 VanDerWaalsContact C-N 3.33Å; K961-Q963 PolarHBondContact O-N 2.84Å; Q963-R965 VanDerWaalsContact C-N 3.26Å; Q963-R965 PolarHBondContact O-N 2.88Å; Q963-E966 PolarHBondContact NE2-OE2 3.11Å; Q963-E966 PolarHBondContact O-N 2.86Å; Q963-D967 PolarHBondContact NE2-OD1 2.79Å; Q963-D967 PolarHBondContact O-N 3.45Å
964	A	93.1	Very high	92.4	Very high	9 Å²	9	57.1 Å²	57.1	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-63.5	-34.4	178.3	0	0	0	0	0	112.3	K899 K961 L962 I968	K899-A964 HydrophobicContact CB-CB 4.04Å; K899-A964 HydrophobicContact CD-CB 3.46Å; K899-A964 VanDerWaalsContact CD-CB 3.46Å; K899-A964 HydrophobicContact CG-CB 4.38Å; K961-A964 WeakPolarHBondContact O-CA 3.01Å; K961-A964 VanDerWaalsContact O-CB 3.26Å; K961-A964 WeakPolarHBondContact O-CB 3.46Å; K961-A964 PolarHBondContact O-N 2.97Å; L962-A964 VanDerWaalsContact C-N 3.27Å; L962-A964 PolarHBondContact O-N 3.23Å; A964-I968 WeakPolarHBondContact O-CD1 3.38Å; A964-I968 VanDerWaalsContact O-CG1 3.25Å; A964-I968 WeakPolarHBondContact O-CG1 3.38Å; A964-I968 PolarHBondContact O-N 3.44Å
965	R	93.3	Very high	92.8	Very high	24 Å²	24	55 Å²	55	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-70.5	-39.9	177.7	-44.5	-160.1	-168.5	-175.7	-2.7	111.2	L938 D955 L957 M960 K961 L962 Q963 T969	L938-R965 HydrophobicContact CB-CB 4.21Å; L938-R965 WeakPolarHBondContact O-CD 3.48Å; L938-R965 PolarHBondContact O-NH1 3.2Å; L938-R965 VanDerWaalsContact O-NH1 3.13Å; D955-R965 IonicContact OD2-NH2 3.19Å; L957-R965 VanDerWaalsContact C-NH2 3.28Å; L957-R965 PolarHBondContact O-NH2 3.11Å; M960-R965 HydrophobicContact CB-CG 3.92Å; M960-R965 HydrophobicContact CE-CG 4.43Å; M960-R965 PolarHBondContact O-NE 3.32Å; K961-R965 PolarHBondContact O-N 3.16Å; L962-R965 WeakPolarHBondContact O-CA 3.06Å; L962-R965 WeakPolarHBondContact O-CB 3.27Å; L962-R965 PolarHBondContact O-N 3.34Å; Q963-R965 VanDerWaalsContact C-N 3.26Å; Q963-R965 PolarHBondContact O-N 2.88Å; R965-T969 WeakPolarHBondContact O-CB 3.4Å; R965-T969 PolarHBondContact O-N 3.43Å; R965-T969 PolarHBondContact O-OG1 2.89Å
966	E	94.3	Very high	93.1	Very high	104 Å²	104	55.1 Å²	55.1	49%	0.486	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-51.1	172.5	-173.8	-176.5	-161.7	0	0	111.7	L962 Q963 I968 T969 A970	L962-E966 PolarHBondContact O-N 2.95Å; Q963-E966 PolarHBondContact NE2-OE2 3.11Å; Q963-E966 PolarHBondContact O-N 2.86Å; E966-I968 PolarHBondContact O-N 3.42Å; E966-T969 PolarHBondContact O-N 3.16Å; E966-A970 PolarHBondContact O-N 3.15Å
967	D	95.6	Very high	93.5	Very high	42 Å²	42	60.9 Å²	60.9	23%	0.225	31%	0.306	C	S	.	.	H	α-helix	trans	-53.7	-43.2	-179.8	-54.8	-26.5	0	0	0	111.3	T896 K899 Q963 S971	T896-D967 HydrophobicContact CG2-CB 3.5Å; T896-D967 VanDerWaalsContact CG2-CB 3.5Å; K899-D967 IonicContact NZ-OD2 3.27Å; K899-D967 PolarHBondContact NZ-OD2 3.44Å; Q963-D967 PolarHBondContact NE2-OD1 2.79Å; Q963-D967 PolarHBondContact O-N 3.45Å; D967-S971 WeakPolarHBondContact O-CB 3.46Å; D967-S971 PolarHBondContact O-N 3.32Å
968	I	95.1	Very high	93.8	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-43.7	177.9	-69.2	164.7	0	0	0	110.8	T896 W897 K899 L900 I933 L938 M960 A964 E966 S971 T972	T896-I968 HydrophobicContact CG2-CG1 4.09Å; T896-I968 WeakPolarHBondContact O-CD1 3.29Å; T896-I968 VanDerWaalsContact O-CG1 3.25Å; T896-I968 WeakPolarHBondContact O-CG1 3.39Å; W897-I968 HydrophobicContact CD2-CG2 4.48Å; K899-I968 HydrophobicContact CB-CD1 4.37Å; L900-I968 HydrophobicContact CB-CD1 4.03Å; I933-I968 HydrophobicContact CG2-CG2 4.18Å; L938-I968 HydrophobicContact CD1-CB 4.24Å; L938-I968 HydrophobicContact CD1-CG2 3.62Å; M960-I968 HydrophobicContact CE-CD1 3.53Å; A964-I968 WeakPolarHBondContact O-CD1 3.38Å; A964-I968 VanDerWaalsContact O-CG1 3.25Å; A964-I968 WeakPolarHBondContact O-CG1 3.38Å; A964-I968 PolarHBondContact O-N 3.44Å; E966-I968 PolarHBondContact O-N 3.42Å; I968-S971 PolarHBondContact O-N 2.95Å; I968-T972 VanDerWaalsContact O-CB 3.3Å; I968-T972 WeakPolarHBondContact O-CB 3.26Å; I968-T972 PolarHBondContact O-N 3.11Å; I968-T972 PolarHBondContact O-OG1 3.47Å
969	T	95.1	Very high	94.2	Very high	5 Å²	5	55 Å²	55	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-47.2	177.5	-63.3	0	0	0	0	111.1	R965 E966 T972 Q973	R965-T969 WeakPolarHBondContact O-CB 3.4Å; R965-T969 PolarHBondContact O-N 3.43Å; R965-T969 PolarHBondContact O-OG1 2.89Å; E966-T969 PolarHBondContact O-N 3.16Å; T969-T972 WeakPolarHBondContact O-CB 3.36Å; T969-T972 PolarHBondContact O-N 3.38Å; T969-Q973 WeakPolarHBondContact O-CG 3.44Å; T969-Q973 PolarHBondContact O-N 3.24Å
970	A	96.3	Very high	94.6	Very high	50 Å²	50	53.5 Å²	53.5	41%	0.413	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-43	176.9	0	0	0	0	0	112.5	E966 T972 Q973 H974	E966-A970 PolarHBondContact O-N 3.15Å; A970-T972 VanDerWaalsContact C-N 3.3Å; A970-T972 PolarHBondContact O-N 3.33Å; A970-Q973 PolarHBondContact O-N 2.65Å; A970-H974 PolarHBondContact O-N 3.31Å
971	S	96.3	Very high	94.8	Very high	37 Å²	37	60.3 Å²	60.3	26%	0.259	30%	0.301	S	S	.	.	H	α-helix	trans	-60.8	-39.7	173.9	-172.8	0	0	0	0	111.7	W897 D967 I968 H974 A975	W897-S971 PolarHBondContact NE1-OG 3.03Å; D967-S971 WeakPolarHBondContact O-CB 3.46Å; D967-S971 PolarHBondContact O-N 3.32Å; I968-S971 PolarHBondContact O-N 2.95Å; S971-H974 WeakPolarHBondContact O-CB 3.42Å; S971-H974 PolarHBondContact O-N 3.14Å; S971-A975 PolarHBondContact O-N 3Å
972	T	96.4	Very high	94.7	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.5	-44	176.7	-54.8	0	0	0	0	111.8	W897 L930 I933 S934 I968 T969 A970 H974 A975 L976	W897-T972 HydrophobicContact CH2-CG2 4.2Å; W897-T972 WeakPolarHBondContact CH2-OG1 3.36Å; W897-T972 HydrophobicContact CZ2-CG2 4.45Å; W897-T972 WeakPolarHBondContact CZ2-OG1 3.48Å; L930-T972 HydrophobicContact CB-CG2 4.02Å; L930-T972 HydrophobicContact CD2-CG2 3.66Å; L930-T972 HydrophobicContact CG-CG2 4.46Å; L930-T972 WeakPolarHBondContact O-CG2 3.27Å; I933-T972 HydrophobicContact CB-CG2 3.55Å; I933-T972 HydrophobicContact CD1-CG2 4.5Å; I933-T972 HydrophobicContact CG2-CG2 3.7Å; I933-T972 WeakPolarHBondContact CG2-OG1 3.47Å; S934-T972 WeakPolarHBondContact OG-CG2 3.07Å; I968-T972 VanDerWaalsContact O-CB 3.3Å; I968-T972 WeakPolarHBondContact O-CB 3.26Å; I968-T972 PolarHBondContact O-N 3.11Å; I968-T972 PolarHBondContact O-OG1 3.47Å; T969-T972 WeakPolarHBondContact O-CB 3.36Å; T969-T972 PolarHBondContact O-N 3.38Å; A970-T972 VanDerWaalsContact C-N 3.3Å; A970-T972 PolarHBondContact O-N 3.33Å; T972-H974 PolarHBondContact O-N 2.69Å; T972-A975 CarbonylContact O-C 3.57Å; T972-A975 PolarHBondContact O-N 3.37Å; T972-L976 WeakPolarHBondContact O-CB 3.49Å; T972-L976 PolarHBondContact O-N 3.15Å
973	Q	96.7	Very high	94.8	Very high	84 Å²	84	58 Å²	58	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-59.4	-31.1	174.2	-72.8	170.3	-1.1	0	0	111.8	S934 T969 A970 R977	S934-Q973 PolarHBondContact O-NE2 3.45Å; S934-Q973 WeakPolarHBondContact OG-CA 3.25Å; S934-Q973 PolarHBondContact OG-N 3.35Å; T969-Q973 WeakPolarHBondContact O-CG 3.44Å; T969-Q973 PolarHBondContact O-N 3.24Å; A970-Q973 PolarHBondContact O-N 2.65Å; Q973-R977 WeakPolarHBondContact O-CG 3.3Å; Q973-R977 PolarHBondContact O-N 3.34Å; Q973-R977 PolarHBondContact O-NE 2.9Å
974	H	96.7	Very high	94.7	Very high	96 Å²	96	52.8 Å²	52.8	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-72.1	-48.2	169.7	-172.7	75.2	0	0	0	112.3	A970 S971 T972 L976 R977 L978	A970-H974 PolarHBondContact O-N 3.31Å; S971-H974 WeakPolarHBondContact O-CB 3.42Å; S971-H974 PolarHBondContact O-N 3.14Å; T972-H974 PolarHBondContact O-N 2.69Å; H974-L976 VanDerWaalsContact C-N 3.31Å; H974-L976 PolarHBondContact O-N 3.47Å; H974-R977 PolarHBondContact O-N 3.13Å; H974-L978 PolarHBondContact O-N 3.23Å
975	A	95.7	Very high	94.7	Very high	6 Å²	6	54 Å²	54	5%	0.05	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-38.6	177.9	0	0	0	0	0	113.2	L930 S971 T972 L978 L979 V987	L930-A975 HydrophobicContact CD1-CB 4.25Å; L930-A975 HydrophobicContact CD2-CB 4.3Å; S971-A975 PolarHBondContact O-N 3Å; T972-A975 CarbonylContact O-C 3.57Å; T972-A975 PolarHBondContact O-N 3.37Å; A975-L978 PolarHBondContact O-N 2.94Å; A975-L979 WeakPolarHBondContact O-CB 3.42Å; A975-L979 PolarHBondContact O-N 3.22Å; A975-V987 HydrophobicContact CB-CG1 3.9Å; A975-V987 HydrophobicContact CB-CG2 3.88Å
976	L	96.4	Very high	94.8	Very high	35 Å²	35	58.5 Å²	58.5	18%	0.183	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-43.3	175.8	179.6	59.5	0	0	0	111.9	L930 E931 S934 T972 H974 L979 A980	L930-L976 HydrophobicContact CB-CB 4.26Å; L930-L976 HydrophobicContact CB-CD1 4.21Å; E931-L976 HydrophobicContact CG-CD1 3.68Å; E931-L976 HydrophobicContact CG-CD2 3.91Å; E931-L976 HydrophobicContact CG-CG 4.46Å; S934-L976 WeakPolarHBondContact OG-CD2 3.48Å; T972-L976 WeakPolarHBondContact O-CB 3.49Å; T972-L976 PolarHBondContact O-N 3.15Å; H974-L976 VanDerWaalsContact C-N 3.31Å; H974-L976 PolarHBondContact O-N 3.47Å; L976-L979 PolarHBondContact O-N 2.94Å; L976-A980 PolarHBondContact O-N 3.37Å
977	R	96.7	Very high	94.7	Very high	139 Å²	139	54.5 Å²	54.5	53%	0.525	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-44.2	173.2	-75.1	175.9	-72.8	159.6	-7	111.3	Q973 H974 L979 A980 F981	Q973-R977 WeakPolarHBondContact O-CG 3.3Å; Q973-R977 PolarHBondContact O-N 3.34Å; Q973-R977 PolarHBondContact O-NE 2.9Å; H974-R977 PolarHBondContact O-N 3.13Å; R977-L979 VanDerWaalsContact C-N 3.32Å; R977-L979 PolarHBondContact O-N 3.33Å; R977-A980 PolarHBondContact O-N 3.11Å; R977-F981 WeakPolarHBondContact O-CD2 3.37Å; R977-F981 PolarHBondContact O-N 2.86Å
978	L	94.9	Very high	94.6	Very high	26 Å²	26	52.6 Å²	52.6	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-42.6	174	-69.9	177.5	0	0	0	111.7	H974 A975 F981 R982 Q983 K986 V987	H974-L978 PolarHBondContact O-N 3.23Å; A975-L978 PolarHBondContact O-N 2.94Å; L978-F981 CarbonylContact O-C 3.56Å; L978-F981 PolarHBondContact O-N 3.41Å; L978-R982 PolarHBondContact O-N 3.42Å; L978-Q983 HydrophobicContact CB-CB 4.29Å; L978-Q983 HydrophobicContact CD2-CB 4.11Å; L978-Q983 WeakPolarHBondContact O-CA 3.47Å; L978-Q983 WeakPolarHBondContact O-CB 3.14Å; L978-Q983 PolarHBondContact O-N 3.21Å; L978-K986 HydrophobicContact CD1-CB 4.29Å; L978-K986 HydrophobicContact CD2-CD 4.36Å; L978-V987 HydrophobicContact CB-CG2 3.95Å; L978-V987 HydrophobicContact CD1-CG2 3.82Å
979	L	93.1	Very high	94.5	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-46.5	176	-167.5	160.6	0	0	0	111.3	M926 R927 L930 A975 L976 R977 F981 R982 I984	M926-L979 HydrophobicContact CG-CD1 4.46Å; R927-L979 HydrophobicContact CB-CD1 4.16Å; R927-L979 HydrophobicContact CB-CD2 4.12Å; R927-L979 HydrophobicContact CG-CD2 4.09Å; R927-L979 VanDerWaalsContact NH2-CD2 3.26Å; L930-L979 HydrophobicContact CD1-CD1 3.83Å; A975-L979 WeakPolarHBondContact O-CB 3.42Å; A975-L979 PolarHBondContact O-N 3.22Å; L976-L979 PolarHBondContact O-N 2.94Å; R977-L979 VanDerWaalsContact C-N 3.32Å; R977-L979 PolarHBondContact O-N 3.33Å; L979-F981 VanDerWaalsContact C-N 3.31Å; L979-F981 PolarHBondContact O-N 3Å; L979-R982 WeakPolarHBondContact O-CA 3.31Å; L979-R982 PolarHBondContact O-N 3.45Å; L979-I984 HydrophobicContact CD1-CD1 3.82Å; L979-I984 HydrophobicContact CD1-CG1 4.32Å; L979-I984 HydrophobicContact CG-CB 4.41Å; L979-I984 HydrophobicContact CG-CD1 4.06Å; L979-I984 HydrophobicContact CG-CG1 4.32Å
980	A	93.1	Very high	94.3	Very high	60 Å²	60	56.9 Å²	56.9	50%	0.496	29%	0.289	S	S	.	.	H	α-helix	trans	-57.5	-41.5	176.1	0	0	0	0	0	112.6	L976 R977 R982	L976-A980 PolarHBondContact O-N 3.37Å; R977-A980 PolarHBondContact O-N 3.11Å; A980-R982 PolarHBondContact O-N 3.07Å
981	F	93.8	Very high	94	Very high	153 Å²	153	62.8 Å²	62.8	67%	0.671	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	12.6	173.7	-64.2	-61.1	0	0	0	114.4	R977 L978 L979 Q983	R977-F981 WeakPolarHBondContact O-CD2 3.37Å; R977-F981 PolarHBondContact O-N 2.86Å; L978-F981 CarbonylContact O-C 3.56Å; L978-F981 PolarHBondContact O-N 3.41Å; L979-F981 VanDerWaalsContact C-N 3.31Å; L979-F981 PolarHBondContact O-N 3Å; F981-Q983 VanDerWaalsContact C-N 3.26Å; F981-Q983 HydrophobicContact CB-CG 4.41Å; F981-Q983 PolarHBondContact O-N 2.93Å
982	R	90.4	Very high	93.7	Very high	171 Å²	171	64.6 Å²	64.6	65%	0.645	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	24.3	177.4	-51.7	-177.7	-178	-165.1	-1.6	115	L978 L979 A980	L978-R982 PolarHBondContact O-N 3.42Å; L979-R982 WeakPolarHBondContact O-CA 3.31Å; L979-R982 PolarHBondContact O-N 3.45Å; A980-R982 PolarHBondContact O-N 3.07Å
983	Q	92.6	Very high	93.3	Very high	65 Å²	65	66.8 Å²	66.8	30%	0.304	33%	0.332	S	S	.	.			trans	-98.4	24.4	177.7	-51.7	-170.7	20.7	0	0	112.5	L978 F981 H985 K986	L978-Q983 HydrophobicContact CB-CB 4.29Å; L978-Q983 HydrophobicContact CD2-CB 4.11Å; L978-Q983 WeakPolarHBondContact O-CA 3.47Å; L978-Q983 WeakPolarHBondContact O-CB 3.14Å; L978-Q983 PolarHBondContact O-N 3.21Å; F981-Q983 VanDerWaalsContact C-N 3.26Å; F981-Q983 HydrophobicContact CB-CG 4.41Å; F981-Q983 PolarHBondContact O-N 2.93Å; Q983-H985 PolarHBondContact O-N 3.15Å; Q983-K986 HydrophobicContact CB-CD 4.24Å; Q983-K986 HydrophobicContact CB-CG 4.49Å; Q983-K986 WeakPolarHBondContact O-CB 3.29Å; Q983-K986 PolarHBondContact O-N 3.33Å
984	I	93.4	Very high	92.6	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-53.2	-28.8	-179.3	-167	176.1	0	0	0	113.4	D669 H672 I673 L979 K986 V987 L988	D669-I984 HydrophobicContact CB-CD1 4.12Å; H672-I984 HydrophobicContact CB-CG2 3.84Å; I673-I984 HydrophobicContact CD1-CD1 3.88Å; I673-I984 HydrophobicContact CG1-CD1 3.9Å; L979-I984 HydrophobicContact CD1-CD1 3.82Å; L979-I984 HydrophobicContact CD1-CG1 4.32Å; L979-I984 HydrophobicContact CG-CB 4.41Å; L979-I984 HydrophobicContact CG-CD1 4.06Å; L979-I984 HydrophobicContact CG-CG1 4.32Å; I984-K986 PolarHBondContact O-N 3.1Å; I984-V987 WeakPolarHBondContact O-CB 3.46Å; I984-V987 PolarHBondContact O-N 2.83Å; I984-L988 HydrophobicContact CD1-CD1 4.34Å; I984-L988 HydrophobicContact CG1-CD1 4Å; I984-L988 HydrophobicContact CG1-CG 4.18Å; I984-L988 WeakPolarHBondContact O-CG 3.5Å; I984-L988 PolarHBondContact O-N 2.9Å
985	H	93.3	Very high	91.4	Very high	33 Å²	33	67.4 Å²	67.4	15%	0.153	36%	0.36	C	S	.	.	H	α-helix	trans	-54.3	-35.4	174.2	60.6	-99.6	0	0	0	113	Q983 L988 G989 M990	Q983-H985 PolarHBondContact O-N 3.15Å; H985-L988 PolarHBondContact O-N 3.37Å; H985-G989 PolarHBondContact O-N 2.89Å; H985-G989 VanDerWaalsContact O-N 3.08Å; H985-M990 CarbonylContact C-O 3.57Å; H985-M990 HydrophobicContact CB-CG 3.9Å; H985-M990 WeakPolarHBondContact CB-O 3.28Å; H985-M990 PolarHBondContact O-N 2.99Å; H985-M990 VanDerWaalsContact O-O 3.11Å
986	K	93.9	Very high	89.9	Confident	120 Å²	120	69.5 Å²	69.5	52%	0.522	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-44.1	175.3	-62.7	-175.2	175.6	176.1	0	112.1	L978 Q983 I984 L988 G989	L978-K986 HydrophobicContact CD1-CB 4.29Å; L978-K986 HydrophobicContact CD2-CD 4.36Å; Q983-K986 HydrophobicContact CB-CD 4.24Å; Q983-K986 HydrophobicContact CB-CG 4.49Å; Q983-K986 WeakPolarHBondContact O-CB 3.29Å; Q983-K986 PolarHBondContact O-N 3.33Å; I984-K986 PolarHBondContact O-N 3.1Å; K986-L988 VanDerWaalsContact C-N 3.33Å; K986-L988 PolarHBondContact O-N 3.3Å; K986-G989 PolarHBondContact O-N 3.19Å
987	V	93.6	Very high	87.8	Confident	20 Å²	20	76.6 Å²	76.6	12%	0.121	40%	0.403	C	S	.	.	H	α-helix	trans	-63.9	-40.7	178.1	-177.2	0	0	0	0	111	L890 R893 A975 L978 I984 G989	L890-V987 HydrophobicContact CD1-CG1 3.63Å; R893-V987 PolarHBondContact NH1-O 3.43Å; R893-V987 PolarHBondContact NH2-O 2.8Å; R893-V987 VanDerWaalsContact NH2-O 3.15Å; A975-V987 HydrophobicContact CB-CG1 3.9Å; A975-V987 HydrophobicContact CB-CG2 3.88Å; L978-V987 HydrophobicContact CB-CG2 3.95Å; L978-V987 HydrophobicContact CD1-CG2 3.82Å; I984-V987 WeakPolarHBondContact O-CB 3.46Å; I984-V987 PolarHBondContact O-N 2.83Å; V987-G989 PolarHBondContact O-N 3.33Å
988	L	93.6	Very high	85.7	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-76.4	-7.7	178.5	-60.8	174.1	0	0	0	113.6	H672 I673 K676 V886 R893 I984 H985 K986 M990	H672-L988 HydrophobicContact CB-CD1 3.81Å; I673-L988 HydrophobicContact CG1-CD1 4.13Å; K676-L988 HydrophobicContact CB-CB 4.37Å; K676-L988 HydrophobicContact CB-CD1 4.2Å; K676-L988 HydrophobicContact CB-CD2 4.48Å; K676-L988 HydrophobicContact CD-CB 4.32Å; K676-L988 WeakPolarHBondContact CD-O 3.3Å; K676-L988 WeakPolarHBondContact CE-O 3.05Å; K676-L988 HydrophobicContact CG-CB 4.12Å; K676-L988 HydrophobicContact CG-CD2 4.19Å; K676-L988 PolarHBondContact NZ-O 3.03Å; V886-L988 HydrophobicContact CG1-CD2 3.36Å; R893-L988 PolarHBondContact NH2-O 3.26Å; I984-L988 HydrophobicContact CD1-CD1 4.34Å; I984-L988 HydrophobicContact CG1-CD1 4Å; I984-L988 HydrophobicContact CG1-CG 4.18Å; I984-L988 WeakPolarHBondContact O-CG 3.5Å; I984-L988 PolarHBondContact O-N 2.9Å; H985-L988 PolarHBondContact O-N 3.37Å; K986-L988 VanDerWaalsContact C-N 3.33Å; K986-L988 PolarHBondContact O-N 3.3Å; L988-M990 HydrophobicContact CB-CG 3.97Å; L988-M990 HydrophobicContact CB-SD 4.04Å; L988-M990 HydrophobicContact CD1-SD 3.95Å
989	G	92.2	Very high	83.4	Confident	49 Å²	49	76.9 Å²	76.9	51%	0.505	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	47.5	-176.9	0	0	0	0	0	112.2	H985 K986 V987	H985-G989 PolarHBondContact O-N 2.89Å; H985-G989 VanDerWaalsContact O-N 3.08Å; K986-G989 PolarHBondContact O-N 3.19Å; V987-G989 PolarHBondContact O-N 3.33Å
990	M	91.8	Very high	81	Confident	46 Å²	46	80 Å²	80	23%	0.227	45%	0.45	C	S	.	.	S	Bend	trans	-139.6	162.4	-179	68.6	179.6	-64.7	0	0	111.7	H672 A675 K676 H985 L988 L993	H672-M990 HydrophobicContact CB-SD 4.22Å; A675-M990 HydrophobicContact CB-CE 4.04Å; K676-M990 HydrophobicContact CB-SD 4.05Å; H985-M990 CarbonylContact C-O 3.57Å; H985-M990 HydrophobicContact CB-CG 3.9Å; H985-M990 WeakPolarHBondContact CB-O 3.28Å; H985-M990 PolarHBondContact O-N 2.99Å; H985-M990 VanDerWaalsContact O-O 3.11Å; L988-M990 HydrophobicContact CB-CG 3.97Å; L988-M990 HydrophobicContact CB-SD 4.04Å; L988-M990 HydrophobicContact CD1-SD 3.95Å; M990-L993 HydrophobicContact CE-CD1 4.35Å; M990-L993 HydrophobicContact CE-CD2 3.83Å; M990-L993 HydrophobicContact CE-CG 3.86Å
991	E	89.9	Confident	78.8	Confident	173 Å²	173	87.8 Å²	87.8	81%	0.808	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-66.3	154	169.9	-63.7	-175	173	0	0	112.1	L993	E991-L993 PolarHBondContact O-N 3.01Å
992	S	89.8	Confident	76.4	Confident	75 Å²	75	87.9 Å²	87.9	52%	0.524	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-68.8	117.6	175.1	-179.1	0	0	0	0	110.4
993	L	88.1	Confident	74.4	Confident	46 Å²	46	89.9 Å²	89.9	24%	0.241	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-59.3	144.1	177.4	-67.2	177.9	0	0	0	111.3	R671 H672 A675 M990 E991 A995	R671-L993 HydrophobicContact CB-CD1 4.11Å; R671-L993 WeakPolarHBondContact O-CD1 3.16Å; H672-L993 HydrophobicContact CB-CD1 4.43Å; H672-L993 PolarHBondContact NE2-N 2.89Å; A675-L993 HydrophobicContact CB-CD1 3.81Å; A675-L993 HydrophobicContact CB-CD2 4.2Å; M990-L993 HydrophobicContact CE-CD1 4.35Å; M990-L993 HydrophobicContact CE-CD2 3.83Å; M990-L993 HydrophobicContact CE-CG 3.86Å; E991-L993 PolarHBondContact O-N 3.01Å; L993-A995 PolarHBondContact O-N 2.65Å
994	P	82.4	Confident	72.3	Confident	106 Å²	106	96 Å²	96	69%	0.688	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-54.8	133.7	179.9	19.6	-31.4	0	0	0	111.7	R671 S996	R671-P994 PolarHBondContact NH1-O 3.22Å; R671-P994 VanDerWaalsContact NH1-O 3.12Å; P994-S996 PolarHBondContact O-N 3.49Å
995	A	71.6	Confident	70	Confident	88 Å²	88	107.3 Å²	107.3	73%	0.727	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-62.3	125	179.6	0	0	0	0	0	109.9	L993 K997	L993-A995 PolarHBondContact O-N 2.65Å; A995-K997 PolarHBondContact O-N 3.08Å
996	S	62.8	Low	67.5	Low	50 Å²	50	115.8 Å²	115.8	35%	0.35	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-57.2	124.2	178.3	176.3	0	0	0	0	110.3	P994 A998 N999	P994-S996 PolarHBondContact O-N 3.49Å; S996-A998 PolarHBondContact O-N 3.01Å; S996-N999 PolarHBondContact O-N 3.28Å
997	K	53.3	Low	64.6	Low	184 Å²	184	121.6 Å²	121.6	80%	0.8	60%	0.599	S	S	*	*	H	α-helix	trans	-59.6	-16.3	-179	-65.5	-177.3	179.6	179.1	0	112.9	A995 A1000 R1001	A995-K997 PolarHBondContact O-N 3.08Å; K997-A1000 PolarHBondContact O-N 3.24Å; K997-R1001 PolarHBondContact O-N 3.37Å
998	A	52.3	Low	61.7	Low	65 Å²	65	125.5 Å²	125.5	54%	0.537	62%	0.619	S	S	.	*	H	α-helix	trans	-60.4	-44.7	168.8	0	0	0	0	0	112.4	S996 A1000 R1001	S996-A998 PolarHBondContact O-N 3.01Å; A998-A1000 VanDerWaalsContact C-N 3.32Å; A998-A1000 PolarHBondContact O-N 3.31Å; A998-R1001 PolarHBondContact O-N 3.47Å
999	N	47.2	Very low	59.2	Low	105 Å²	105	132.6 Å²	132.6	56%	0.561	66%	0.663	S	S	*	*	H	α-helix	trans	-72.9	-24.7	-179.8	-70.2	-7.9	0	0	0	112.6	S996 N1002	S996-N999 PolarHBondContact O-N 3.28Å; N999-N1002 PolarHBondContact O-N 2.95Å
1000	A	42.8	Very low	56.4	Low	67 Å²	67	135.5 Å²	135.5	55%	0.554	68%	0.675	S	S	*	*	H	α-helix	trans	-66.5	-39	174.7	0	0	0	0	0	112	K997 A998 N1002 R1003	K997-A1000 PolarHBondContact O-N 3.24Å; A998-A1000 VanDerWaalsContact C-N 3.32Å; A998-A1000 PolarHBondContact O-N 3.31Å; A1000-N1002 VanDerWaalsContact C-N 3.3Å; A1000-N1002 PolarHBondContact O-N 3.42Å; A1000-R1003 PolarHBondContact O-N 2.92Å
1001	R	46.9	Very low	53.5	Low	223 Å²	223	140.6 Å²	140.6	84%	0.842	70%	0.704	S	S	*	*	H	α-helix	trans	-65.3	-31.9	176.7	-73.8	-175.5	172.2	174.3	-2	112.9	K997 A998 R1003	K997-R1001 PolarHBondContact O-N 3.37Å; A998-R1001 PolarHBondContact O-N 3.47Å; R1001-R1003 VanDerWaalsContact C-N 3.3Å; R1001-R1003 PolarHBondContact O-N 2.99Å
1002	N	42.8	Very low	50.9	Low	155 Å²	155	139 Å²	139	83%	0.829	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	0.2	180	-137.1	27.3	0	0	0	114.2	N999 A1000	N999-N1002 PolarHBondContact O-N 2.95Å; A1000-N1002 VanDerWaalsContact C-N 3.3Å; A1000-N1002 PolarHBondContact O-N 3.42Å
1003	R	47.6	Very low	48.1	Very low	214 Å²	214	138.8 Å²	138.8	81%	0.808	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	1	176.9	-92.8	-175.9	167.7	179.7	-5.2	114.7	A1000 R1001 R1005	A1000-R1003 PolarHBondContact O-N 2.92Å; R1001-R1003 VanDerWaalsContact C-N 3.3Å; R1001-R1003 PolarHBondContact O-N 2.99Å; R1003-R1005 PolarHBondContact O-N 2.76Å
1004	K	48.9	Very low	45.5	Very low	194 Å²	194	146 Å²	146	84%	0.843	75%	0.748	S	S	*	*			trans	-97.1	63.7	-176.7	-156.7	171.6	-174.3	177.3	0	113.6
1005	R	45	Very low	43	Very low	238 Å²	238	144.7 Å²	144.7	90%	0.898	75%	0.753	S	S	*	*	S	Bend	trans	-139.1	138.3	159.1	-85.5	-168.8	170.1	-174.7	-3.5	109.9	R1003	R1003-R1005 PolarHBondContact O-N 2.76Å
1006	R	41.9	Very low	41.2	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	76%	0.764	S	S	*	*			trans	30.7	95.6	176.6	-69.3	-169	178.5	-89.3	4.6	116.8	D1008	R1006-D1008 IonicContact NH1-OD1 3.7Å; R1006-D1008 PolarHBondContact NH1-OD1 3.3Å
1007	R	32.5	Very low	39.8	Very low	242 Å²	242	151.5 Å²	151.5	91%	0.913	79%	0.785	S	S	*	*			trans	-106.6	117.6	132	174.1	177.2	-73.4	-178.9	-8.5	104.7
1008	D	33.2	Very low	38.9	Very low	102 Å²	102	152.7 Å²	152.7	55%	0.545	79%	0.793	S	S	.	*			trans	-74.9	160.4	176.9	-62.7	-74.9	0	0	0	110.2	R1006	R1006-D1008 IonicContact NH1-OD1 3.7Å; R1006-D1008 PolarHBondContact NH1-OD1 3.3Å
1009	V	40.1	Very low	37.9	Very low	151 Å²	151	153 Å²	153	92%	0.915	80%	0.802	S	S	*	*			trans	-99.2	97.2	-170.6	178.4	0	0	0	0	109.4
1010	S	33.4	Very low	37.4	Very low	110 Å²	110	157.3 Å²	157.3	77%	0.769	82%	0.816	S	S	*	*			trans	-163	78.3	169.5	60.4	0	0	0	0	110.7
1011	D	31.2	Very low	37	Very low	154 Å²	154	162.3 Å²	162.3	82%	0.824	83%	0.825	S	S	*	*			trans	-157.7	128.1	139.5	-149.5	-13.4	0	0	0	110
1012	T	34.8	Very low	36.4	Very low	140 Å²	140	157.4 Å²	157.4	86%	0.859	82%	0.816	S	S	*	*			trans	-126.9	70.1	173.8	45.1	0	0	0	0	107.6
1013	G	30.7	Very low	36.1	Very low	69 Å²	69	158 Å²	158	71%	0.711	81%	0.811	S	S	*	*			trans	-71.7	130.3	171.6	0	0	0	0	0	111
1014	E	33.6	Very low	35.6	Very low	199 Å²	199	156 Å²	156	93%	0.93	81%	0.808	S	S	*	*			trans	-74.1	159.1	-176.3	-63.3	168.5	151.4	0	0	112
1015	G	29.5	Very low	34.9	Very low	78 Å²	78	152 Å²	152	80%	0.804	80%	0.796	S	S	*	*			trans	-170.6	48.4	-171.3	0	0	0	0	0	113.8
1016	E	34.1	Very low	34.5	Very low	206 Å²	206	148.5 Å²	148.5	96%	0.963	79%	0.79	S	S	*	*			trans	-70.7	142.1	166.6	-64	-164.9	137.7	0	0	110.6
1017	G	33.5	Very low	34.5	Very low	75 Å²	75	146.9 Å²	146.9	77%	0.773	82%	0.821	S	S	*	*			trans	176	89.3	-176.1	0	0	0	0	0	112
1018	E	33.9	Very low	34.6	Very low	209 Å²	209	142.1 Å²	142.1	98%	0.977	82%	0.817	S	S	*	*			trans	-64.5	149.3	177.5	-66.6	-170.8	88.6	0	0	113.2
1019	G	32.9	Very low	34.7	Very low	71 Å²	71	144.2 Å²	144.2	73%	0.732	83%	0.831	S	S	*	*			trans	-176	69.6	176.7	0	0	0	0	0	116.4
1020	K	36	Very low	34.4	Very low	195 Å²	195	143.8 Å²	143.8	85%	0.848	83%	0.826	S	S	*	*			trans	24.4	124.2	148.2	-76.3	167.1	-175.5	167.4	0	118.7
1021	K	35.1	Very low	34.4	Very low	173 Å²	173	145.8 Å²	145.8	75%	0.752	83%	0.829	S	S	*	*				56.5	134.3	96.9	-81.1	-178.5	140.2	-109.7	0	114.8
1022	D	34	Very low	34.6	Very low	119 Å²	119	145.3 Å²	145.3	64%	0.636	83%	0.83	S	S	*	*			cis	-153.1	148.6	14.5	-108.7	-47.1	0	0	0	112.2
1023	K	35.4	Very low	34.6	Very low	168 Å²	168	145.7 Å²	145.7	73%	0.73	83%	0.828	S	S	*	*			trans	21.4	123.9	140.9	-175.9	176.3	-177.7	176.6	0	121.1	D1025	K1023-D1025 WeakPolarHBondContact CE-OD2 3.15Å
1024	K	37.3	Very low	34.9	Very low	172 Å²	172	151.1 Å²	151.1	75%	0.748	84%	0.836	S	S	*	*				-149.5	141.2	118.7	-152.2	-165.5	168.3	-146.6	0	112.4	E1026	K1024-E1026 IonicContact NZ-OE2 2.74Å; K1024-E1026 PolarHBondContact NZ-OE2 3.31Å
1025	D	35.5	Very low	35	Very low	111 Å²	111	147.5 Å²	147.5	59%	0.594	83%	0.829	S	S	*	*			trans	-84.1	-172.7	175.3	-48.7	-92.3	0	0	0	113	K1023	K1023-D1025 WeakPolarHBondContact CE-OD2 3.15Å
1026	E	35.1	Very low	35.4	Very low	164 Å²	164	153.3 Å²	153.3	77%	0.766	83%	0.831	S	S	*	*			trans	82	114.3	-178.2	-52.3	177.7	104.3	0	0	114.4	K1024	K1024-E1026 IonicContact NZ-OE2 2.74Å; K1024-E1026 PolarHBondContact NZ-OE2 3.31Å
1027	A	42.5	Very low	35.6	Very low	176 Å²	176	148.5 Å²	148.5	100%	1.455	82%	0.819	S	S	*	*			cis	-152.1	0	-2	0	0	0	0	0	112

Retrieved 1,027 of 1,027 residues in 244.8 ms (Link to these results)

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