A0A3Q0KSK4_SCHMA Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSK4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,035 aa.

						>A0A3Q0KSK4_SCHMA|A0A3Q0KSK4
MMINSNGDRKPRRSSLKFTFDPVNDASDGIVSSRGLNRRVSFSQYVFVLGDEDDGSQMCVSRFNSNISVEDEFSVNSNITTTTNDINNNSNNNNGSINDNNSNSSNVNDNMESVTSISDVSMELSHDSCLKVEHGESFNEQQNTNMEIDDNSDDSRTLSPKCSSLESITISSVDEMIVQNELSYTPRHHHDVSDMEVQSSICPLPVPLNEELCNMSIISTDELNLSTNNDGNIDKNVPDDSLPNKKHSQSLYHNDVSKSTPTIENNEDVNLEKIGTPPFRSPHFLPSTNTMMTDVLVNPLLSCKRPVSVVKMPLINLNLSNSLPLTRRQCNINSNLQSDADKTPKPSESERITFISLINTPLRQANIGDNTSVNLTSVKKVVRPKTFRDVNEYKPERLLSSTRRLHNHLHNQLVESQLEAVIDYIKYDFSDIKSIMNFLHKNEYIDFNLEKLDKSTLLTDLDRYGSDEYLQLQNQLNLHLYDKLVKRRFAIETENMNRLEFWKRLYLKRISTVLISPQLKSVIKNVSEMNLIEHLKCIAGTVQLYHTCSKFAQQEIYQIVDENISARNLELNLEIDDLQQLNDYLEFMISQKQSELRKKRQEQEQLLELEMYAKEALQKLDRIKQEVDETTQRQIVIRQSNEKLFKRKQYLEKKLKELSERKRQEELYYSGTLLNRSVGCTELFPIPISETPINNDNKLKPTSTGKLINLFSPCRIICTSFEKDNHIYEVSTLFGLMNFILTCQVCNMLVDDTDRKNNHNHNQCNENIDDNDGDGDDDEKEEGEDDDDDNDDMQITISPENLKVISVQVIAPSDVECPVECPPVESVARTFIEYLNTAGSEILRTRCIGFTMADVIETIETIIVPFMVLASDLRCLWLAKYDVNFGMTSIDDQLFTACYFTPKKLRHLIGQTPRSTAVQSSHRTPFQSKQLHQQSFIGESIIPVKKSLSFYEYLTPSGPFSITVRVSTRNYRIMVRFTLMSLDYMDSSQGSVEYEVLRGNLSTEKLEEYFKTCKPTCGNLYSIISNLQLFLSSTI
					

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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	25.4	Very low	31.8	Very low	240 Å²	240	154.8 Å²	154.8	100%	1.182	82%	0.818	S	S	*	*				0	135.4	0	-125	170.7	174.1	0	0	106.1
2	M	23.9	Very low	31.2	Very low	171 Å²	171	162.8 Å²	162.8	84%	0.842	83%	0.828	S	S	*	*			cis	-117	140.1	41.8	-73.1	175	169.7	0	0	113.9
3	I	25.2	Very low	30.7	Very low	120 Å²	120	166.5 Å²	166.5	62%	0.615	83%	0.826	S	S	*	*			trans	-106.9	115.7	163	-63.3	167.8	0	0	0	103.2
4	N	40.7	Very low	30.2	Very low	125 Å²	125	162.9 Å²	162.9	67%	0.668	83%	0.825	S	S	*	*			trans	-93.9	156.4	171.5	-79.3	-0.7	0	0	0	109.9	N6 G7	N4-N6 PolarHBondContact O-N 3.29Å; N4-G7 PolarHBondContact O-N 3.35Å
5	S	42.1	Very low	29.8	Very low	123 Å²	123	156 Å²	156	86%	0.86	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	18.7	-157.6	43.5	0	0	0	0	117.7
6	N	44.5	Very low	29.3	Very low	158 Å²	158	153.3 Å²	153.3	85%	0.845	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.8	21.9	167.7	-85.5	-13.4	0	0	0	114.4	N4 D8	N4-N6 PolarHBondContact O-N 3.29Å; N6-D8 PolarHBondContact O-N 3.5Å
7	G	29.7	Very low	29	Very low	57 Å²	57	154.4 Å²	154.4	59%	0.588	78%	0.783	S	S	*	*			trans	75.6	-16.4	146.6	0	0	0	0	0	120.8	N4	N4-G7 PolarHBondContact O-N 3.35Å
8	D	33.9	Very low	28.7	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	76%	0.758	S	S	*	*			trans	-86.7	121.9	-174.8	-77.6	-27.6	0	0	0	114.3	N6	N6-D8 PolarHBondContact O-N 3.5Å
9	R	29.7	Very low	28.4	Very low	208 Å²	208	147.2 Å²	147.2	79%	0.785	75%	0.749	S	S	*	*			trans	-103.4	107.4	176.3	-68.4	-177.8	178.5	-177.7	1.9	110.3
10	K	26.8	Very low	28.2	Very low	213 Å²	213	146.8 Å²	146.8	93%	0.926	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-100.5	122.6	165.1	-80.1	-177.1	178.3	174.8	0	110.9
11	P	27.7	Very low	28.1	Very low	126 Å²	126	147.4 Å²	147.4	82%	0.818	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-96	145.5	164	25.2	-12.3	0	0	0	112.5
12	R	25.3	Very low	28.1	Very low	250 Å²	250	142 Å²	142	94%	0.943	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-76.6	148.6	-171.6	-121.5	172.9	165.3	149.6	-4.4	113.6
13	R	23.9	Very low	28.2	Very low	212 Å²	212	138.7 Å²	138.7	80%	0.8	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-78.3	147.8	168.1	-86.2	178.5	159.7	-159.7	-4.9	112.4
14	S	23.5	Very low	28.2	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	73%	0.727	S	S	*	*			trans	-152	133.4	154.5	55.1	0	0	0	0	109.6
15	S	25.5	Very low	27.5	Very low	59 Å²	59	141.8 Å²	141.8	41%	0.413	74%	0.737	S	S	.	*			trans	-128.2	172.8	171.5	39.8	0	0	0	0	108.9	Y45	S15-Y45 VanDerWaalsContact C-OH 3.22Å; S15-Y45 WeakPolarHBondContact CB-OH 3.48Å; S15-Y45 WeakPolarHBondContact O-CD2 3.41Å; S15-Y45 WeakPolarHBondContact O-CE2 3.43Å; S15-Y45 VanDerWaalsContact O-CZ 3.28Å; S15-Y45 WeakPolarHBondContact OG-CE1 3.35Å; S15-Y45 PolarHBondContact OG-OH 3.03Å
16	L	21.2	Very low	26.6	Very low	113 Å²	113	140.1 Å²	140.1	59%	0.592	73%	0.731	S	S	*	*			trans	-155.7	139.3	-164	-141	68.4	0	0	0	110.5	F42 Y45	L16-F42 HydrophobicContact CB-CD1 3.86Å; L16-F42 HydrophobicContact CB-CE1 3.5Å; L16-F42 VanDerWaalsContact CB-CE1 3.5Å; L16-F42 HydrophobicContact CB-CZ 4.2Å; L16-F42 HydrophobicContact CD1-CD1 4.42Å; L16-F42 HydrophobicContact CD2-CD1 3.48Å; L16-F42 VanDerWaalsContact CD2-CD1 3.48Å; L16-F42 HydrophobicContact CD2-CD2 3.65Å; L16-F42 HydrophobicContact CD2-CE1 3.14Å; L16-F42 HydrophobicContact CD2-CE2 3.36Å; L16-F42 HydrophobicContact CD2-CG 3.68Å; L16-F42 HydrophobicContact CD2-CZ 3.06Å; L16-F42 HydrophobicContact CG-CB 4.27Å; L16-F42 HydrophobicContact CG-CD1 3.23Å; L16-F42 HydrophobicContact CG-CD2 4.22Å; L16-F42 HydrophobicContact CG-CE1 3.23Å; L16-F42 HydrophobicContact CG-CE2 4.26Å; L16-F42 HydrophobicContact CG-CG 3.71Å; L16-F42 HydrophobicContact CG-CZ 3.77Å; L16-Y45 PolarHBondContact N-OH 3.27Å
17	K	24.2	Very low	25.7	Very low	172 Å²	172	137.8 Å²	137.8	75%	0.748	73%	0.727	S	S	*	*			trans	-149.2	161.6	173.4	-156.1	175.1	-179.9	-177	0	111.9	F42 S43	K17-F42 WeakPolarHBondContact O-CD1 3.19Å; K17-S43 PolarHBondContact O-N 3.4Å
18	F	23	Very low	25.5	Very low	76 Å²	76	143 Å²	143	33%	0.333	74%	0.741	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.3	152.3	-153.6	-74	-82.8	0	0	0	115.4	V40 S41 F42	F18-V40 HydrophobicContact CB-CG1 3.49Å; F18-V40 VanDerWaalsContact CB-CG1 3.49Å; F18-V40 HydrophobicContact CD1-CB 3.72Å; F18-V40 HydrophobicContact CD1-CG1 3.05Å; F18-V40 HydrophobicContact CD2-CB 4.49Å; F18-V40 HydrophobicContact CD2-CG1 3.52Å; F18-V40 VanDerWaalsContact CE1-C 3.44Å; F18-V40 HydrophobicContact CE1-CB 3.41Å; F18-V40 VanDerWaalsContact CE1-CB 3.41Å; F18-V40 HydrophobicContact CE1-CG1 3.29Å; F18-V40 HydrophobicContact CE2-CB 4.19Å; F18-V40 HydrophobicContact CE2-CG1 3.67Å; F18-V40 HydrophobicContact CG-CB 4.22Å; F18-V40 HydrophobicContact CG-CG1 3.15Å; F18-V40 HydrophobicContact CZ-CB 3.61Å; F18-V40 HydrophobicContact CZ-CG1 3.53Å; F18-V40 HydrophobicContact CZ-CG2 4.48Å; F18-S41 VanDerWaalsContact CD1-N 3.27Å; F18-S41 WeakPolarHBondContact CD1-O 3.39Å; F18-S41 VanDerWaalsContact CE1-CA 3.43Å; F18-F42 HydrophobicContact CD1-CB 4.09Å; F18-F42 AromaticContact CD1-CD1 3.39Å; F18-F42 HydrophobicContact CD1-CD1 3.39Å; F18-F42 AromaticContact CD1-CD2 3.75Å; F18-F42 HydrophobicContact CD1-CD2 3.75Å; F18-F42 AromaticContact CD1-CE1 3.83Å; F18-F42 HydrophobicContact CD1-CE1 3.83Å; F18-F42 HydrophobicContact CD1-CE2 4.11Å; F18-F42 AromaticContact CD1-CG 3.4Å; F18-F42 HydrophobicContact CD1-CG 3.4Å; F18-F42 VanDerWaalsContact CD1-CG 3.4Å; F18-F42 HydrophobicContact CD1-CZ 4.18Å; F18-F42 AromaticContact CD2-CD1 3.46Å; F18-F42 HydrophobicContact CD2-CD1 3.46Å; F18-F42 VanDerWaalsContact CD2-CD1 3.46Å; F18-F42 AromaticContact CD2-CE1 3.22Å; F18-F42 HydrophobicContact CD2-CE1 3.22Å; F18-F42 HydrophobicContact CD2-CG 4.31Å; F18-F42 AromaticContact CD2-CZ 3.84Å; F18-F42 HydrophobicContact CD2-CZ 3.84Å; F18-F42 HydrophobicContact CE1-CB 4.3Å; F18-F42 AromaticContact CE1-CD1 3.46Å; F18-F42 HydrophobicContact CE1-CD1 3.46Å; F18-F42 VanDerWaalsContact CE1-CD1 3.46Å; F18-F42 AromaticContact CE1-CD2 3.1Å; F18-F42 HydrophobicContact CE1-CD2 3.1Å; F18-F42 AromaticContact CE1-CE1 3.56Å; F18-F42 HydrophobicContact CE1-CE1 3.56Å; F18-F42 AromaticContact CE1-CE2 3.15Å; F18-F42 HydrophobicContact CE1-CE2 3.15Å; F18-F42 AromaticContact CE1-CG 3.29Å; F18-F42 HydrophobicContact CE1-CG 3.29Å; F18-F42 AromaticContact CE1-CZ 3.41Å; F18-F42 HydrophobicContact CE1-CZ 3.41Å; F18-F42 VanDerWaalsContact CE1-CZ 3.41Å; F18-F42 AromaticContact CE2-CD1 3.56Å; F18-F42 HydrophobicContact CE2-CD1 3.56Å; F18-F42 HydrophobicContact CE2-CD2 4.29Å; F18-F42 AromaticContact CE2-CE1 2.9Å; F18-F42 HydrophobicContact CE2-CE1 2.9Å; F18-F42 AromaticContact CE2-CE2 3.73Å; F18-F42 HydrophobicContact CE2-CE2 3.73Å; F18-F42 HydrophobicContact CE2-CG 4.24Å; F18-F42 AromaticContact CE2-CZ 3.01Å; F18-F42 HydrophobicContact CE2-CZ 3.01Å; F18-F42 AromaticContact CG-CD1 3.44Å; F18-F42 HydrophobicContact CG-CD1 3.44Å; F18-F42 VanDerWaalsContact CG-CD1 3.44Å; F18-F42 AromaticContact CG-CE1 3.73Å; F18-F42 HydrophobicContact CG-CE1 3.73Å; F18-F42 AromaticContact CG-CG 3.96Å; F18-F42 HydrophobicContact CG-CG 3.96Å; F18-F42 HydrophobicContact CG-CZ 4.4Å; F18-F42 AromaticContact CZ-CD1 3.6Å; F18-F42 HydrophobicContact CZ-CD1 3.6Å; F18-F42 AromaticContact CZ-CD2 3.49Å; F18-F42 HydrophobicContact CZ-CD2 3.49Å; F18-F42 VanDerWaalsContact CZ-CD2 3.49Å; F18-F42 AromaticContact CZ-CE1 3.14Å; F18-F42 HydrophobicContact CZ-CE1 3.14Å; F18-F42 AromaticContact CZ-CE2 2.96Å; F18-F42 HydrophobicContact CZ-CE2 2.96Å; F18-F42 AromaticContact CZ-CG 3.8Å; F18-F42 HydrophobicContact CZ-CG 3.8Å; F18-F42 AromaticContact CZ-CZ 2.79Å; F18-F42 HydrophobicContact CZ-CZ 2.79Å
19	T	24.1	Very low	25.1	Very low	96 Å²	96	138.7 Å²	138.7	59%	0.589	74%	0.735	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-139.9	161	173.4	37	0	0	0	0	112.1	S41	T19-S41 PolarHBondContact N-O 3.34Å
20	F	24.7	Very low	24.7	Very low	138 Å²	138	136.6 Å²	136.6	61%	0.605	74%	0.738	S	S	*	*			trans	-136.4	140.8	-170.7	-67.7	-91.5	0	0	0	112.6	R39 V40	F20-R39 VanDerWaalsContact CE1-O 3.32Å; F20-R39 WeakPolarHBondContact CE1-O 3.32Å; F20-V40 HydrophobicContact CE1-CB 4.41Å; F20-V40 HydrophobicContact CE1-CG1 4.27Å; F20-V40 HydrophobicContact CE2-CG1 3.93Å; F20-V40 HydrophobicContact CZ-CB 3.99Å; F20-V40 HydrophobicContact CZ-CG1 3.49Å; F20-V40 VanDerWaalsContact CZ-CG1 3.49Å; F20-V40 HydrophobicContact CZ-CG2 4.12Å
21	D	24.7	Very low	24.5	Very low	161 Å²	161	132.8 Å²	132.8	86%	0.861	73%	0.732	S	S	*	*			trans	-108.6	148.1	174.8	-83.4	-33.1	0	0	0	112.8
22	P	25.9	Very low	24.2	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	73%	0.728	S	S	*	*			trans	-91.8	157.7	-172.3	35.7	-34.2	0	0	0	114.8
23	V	27	Very low	24.3	Very low	102 Å²	102	125.3 Å²	125.3	62%	0.618	72%	0.721	S	S	*	*			trans	-115.5	121.8	-176.7	173.6	0	0	0	0	110.7	R38	V23-R38 VanDerWaalsContact CG2-NH1 3.25Å
24	N	23.7	Very low	24.2	Very low	145 Å²	145	127 Å²	127	78%	0.775	73%	0.727	S	S	*	*			trans	-69	134.7	161.8	-76.4	-24.6	0	0	0	110.2
25	D	26.8	Very low	24.2	Very low	166 Å²	166	125.1 Å²	125.1	89%	0.888	73%	0.726	S	S	*	*				-172.8	146.3	121.5	-96.3	-24.1	0	0	0	112.7
26	A	23.4	Very low	24.1	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	74%	0.743	S	S	*	*			trans	-80.6	172.2	-172.7	0	0	0	0	0	114.1
27	S	26.4	Very low	24.1	Very low	109 Å²	109	132 Å²	132	76%	0.762	76%	0.758	S	S	*	*			trans	87.5	115.4	162	69.3	0	0	0	0	119.2
28	D	25.1	Very low	24.1	Very low	166 Å²	166	132.4 Å²	132.4	89%	0.888	76%	0.755	S	S	*	*			trans	49.9	124.8	136.1	-62.8	-22.1	0	0	0	121.7
29	G	24.5	Very low	23.9	Very low	71 Å²	71	140.1 Å²	140.1	73%	0.732	78%	0.782	S	S	*	*			trans	110.9	93.1	141.2	0	0	0	0	0	117.5
30	I	22.3	Very low	23.7	Very low	165 Å²	165	139 Å²	139	85%	0.846	78%	0.775	S	S	*	*			trans	37.2	109.9	130.1	-57.6	178.4	0	0	0	118
31	V	22.5	Very low	23.6	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	77%	0.774	S	S	*	*			trans	76.3	114.4	150.2	-176.2	0	0	0	0	118.5
32	S	21.6	Very low	23.4	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	75%	0.753	S	S	*	*				158.3	143.2	112.7	-164.5	0	0	0	0	112.8	R34	S32-R34 PolarHBondContact O-N 2.93Å
33	S	27	Very low	23.2	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	74%	0.743	S	S	*	*			trans	-60.9	110.2	172.8	27.8	0	0	0	0	112.8
34	R	21.8	Very low	22.9	Very low	249 Å²	249	135.6 Å²	135.6	94%	0.94	76%	0.755	S	S	*	*			trans	-161.6	131	153.4	-113.2	173.7	-175.3	-173.9	2.1	110.8	S32	S32-R34 PolarHBondContact O-N 2.93Å
35	G	22.7	Very low	22.8	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	74%	0.738	S	S	*	*			trans	-67.8	156.6	-165.2	0	0	0	0	0	116.9
36	L	24.7	Very low	22.7	Very low	148 Å²	148	132.2 Å²	132.2	78%	0.775	74%	0.735	S	S	*	*			trans	-122.2	96.3	158.4	-81.9	164.8	0	0	0	108.5	R38	L36-R38 PolarHBondContact O-N 2.84Å
37	N	20.5	Very low	22.5	Very low	169 Å²	169	133.3 Å²	133.3	90%	0.904	72%	0.723	S	S	*	*			trans	-47.3	120.5	152.2	-81.1	-37.9	0	0	0	109
38	R	23.8	Very low	22.4	Very low	179 Å²	179	134.5 Å²	134.5	68%	0.675	73%	0.726	S	S	*	*			trans	-131.1	131.6	162	-81.4	-171	175.4	172.6	-0.3	112.4	V23 L36	V23-R38 VanDerWaalsContact CG2-NH1 3.25Å; L36-R38 PolarHBondContact O-N 2.84Å
39	R	19.9	Very low	22.2	Very low	239 Å²	239	134.3 Å²	134.3	90%	0.902	72%	0.724	S	S	*	*			trans	-88.4	162.2	-168.9	-106.5	175.4	164.9	-176.5	-4.2	111.9	F20	F20-R39 VanDerWaalsContact CE1-O 3.32Å; F20-R39 WeakPolarHBondContact CE1-O 3.32Å
40	V	19.9	Very low	22.3	Very low	73 Å²	73	134.4 Å²	134.4	44%	0.442	73%	0.725	S	S	.	*			trans	-95.4	147.6	-171.4	-146.5	0	0	0	0	112.9	F18 F20	F18-V40 HydrophobicContact CB-CG1 3.49Å; F18-V40 VanDerWaalsContact CB-CG1 3.49Å; F18-V40 HydrophobicContact CD1-CB 3.72Å; F18-V40 HydrophobicContact CD1-CG1 3.05Å; F18-V40 HydrophobicContact CD2-CB 4.49Å; F18-V40 HydrophobicContact CD2-CG1 3.52Å; F18-V40 VanDerWaalsContact CE1-C 3.44Å; F18-V40 HydrophobicContact CE1-CB 3.41Å; F18-V40 VanDerWaalsContact CE1-CB 3.41Å; F18-V40 HydrophobicContact CE1-CG1 3.29Å; F18-V40 HydrophobicContact CE2-CB 4.19Å; F18-V40 HydrophobicContact CE2-CG1 3.67Å; F18-V40 HydrophobicContact CG-CB 4.22Å; F18-V40 HydrophobicContact CG-CG1 3.15Å; F18-V40 HydrophobicContact CZ-CB 3.61Å; F18-V40 HydrophobicContact CZ-CG1 3.53Å; F18-V40 HydrophobicContact CZ-CG2 4.48Å; F20-V40 HydrophobicContact CE1-CB 4.41Å; F20-V40 HydrophobicContact CE1-CG1 4.27Å; F20-V40 HydrophobicContact CE2-CG1 3.93Å; F20-V40 HydrophobicContact CZ-CB 3.99Å; F20-V40 HydrophobicContact CZ-CG1 3.49Å; F20-V40 VanDerWaalsContact CZ-CG1 3.49Å; F20-V40 HydrophobicContact CZ-CG2 4.12Å
41	S	21	Very low	22.5	Very low	85 Å²	85	134 Å²	134	59%	0.594	73%	0.725	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-149.8	142.3	165.9	53.2	0	0	0	0	116.2	F18 T19	F18-S41 VanDerWaalsContact CD1-N 3.27Å; F18-S41 WeakPolarHBondContact CD1-O 3.39Å; F18-S41 VanDerWaalsContact CE1-CA 3.43Å; T19-S41 PolarHBondContact N-O 3.34Å
42	F	20.3	Very low	22.6	Very low	97 Å²	97	136.1 Å²	136.1	43%	0.425	73%	0.726	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.7	157.9	-155.2	-63.9	-86.2	0	0	0	116.7	L16 K17 F18	L16-F42 HydrophobicContact CB-CD1 3.86Å; L16-F42 HydrophobicContact CB-CE1 3.5Å; L16-F42 VanDerWaalsContact CB-CE1 3.5Å; L16-F42 HydrophobicContact CB-CZ 4.2Å; L16-F42 HydrophobicContact CD1-CD1 4.42Å; L16-F42 HydrophobicContact CD2-CD1 3.48Å; L16-F42 VanDerWaalsContact CD2-CD1 3.48Å; L16-F42 HydrophobicContact CD2-CD2 3.65Å; L16-F42 HydrophobicContact CD2-CE1 3.14Å; L16-F42 HydrophobicContact CD2-CE2 3.36Å; L16-F42 HydrophobicContact CD2-CG 3.68Å; L16-F42 HydrophobicContact CD2-CZ 3.06Å; L16-F42 HydrophobicContact CG-CB 4.27Å; L16-F42 HydrophobicContact CG-CD1 3.23Å; L16-F42 HydrophobicContact CG-CD2 4.22Å; L16-F42 HydrophobicContact CG-CE1 3.23Å; L16-F42 HydrophobicContact CG-CE2 4.26Å; L16-F42 HydrophobicContact CG-CG 3.71Å; L16-F42 HydrophobicContact CG-CZ 3.77Å; K17-F42 WeakPolarHBondContact O-CD1 3.19Å; F18-F42 HydrophobicContact CD1-CB 4.09Å; F18-F42 AromaticContact CD1-CD1 3.39Å; F18-F42 HydrophobicContact CD1-CD1 3.39Å; F18-F42 AromaticContact CD1-CD2 3.75Å; F18-F42 HydrophobicContact CD1-CD2 3.75Å; F18-F42 AromaticContact CD1-CE1 3.83Å; F18-F42 HydrophobicContact CD1-CE1 3.83Å; F18-F42 HydrophobicContact CD1-CE2 4.11Å; F18-F42 AromaticContact CD1-CG 3.4Å; F18-F42 HydrophobicContact CD1-CG 3.4Å; F18-F42 VanDerWaalsContact CD1-CG 3.4Å; F18-F42 HydrophobicContact CD1-CZ 4.18Å; F18-F42 AromaticContact CD2-CD1 3.46Å; F18-F42 HydrophobicContact CD2-CD1 3.46Å; F18-F42 VanDerWaalsContact CD2-CD1 3.46Å; F18-F42 AromaticContact CD2-CE1 3.22Å; F18-F42 HydrophobicContact CD2-CE1 3.22Å; F18-F42 HydrophobicContact CD2-CG 4.31Å; F18-F42 AromaticContact CD2-CZ 3.84Å; F18-F42 HydrophobicContact CD2-CZ 3.84Å; F18-F42 HydrophobicContact CE1-CB 4.3Å; F18-F42 AromaticContact CE1-CD1 3.46Å; F18-F42 HydrophobicContact CE1-CD1 3.46Å; F18-F42 VanDerWaalsContact CE1-CD1 3.46Å; F18-F42 AromaticContact CE1-CD2 3.1Å; F18-F42 HydrophobicContact CE1-CD2 3.1Å; F18-F42 AromaticContact CE1-CE1 3.56Å; F18-F42 HydrophobicContact CE1-CE1 3.56Å; F18-F42 AromaticContact CE1-CE2 3.15Å; F18-F42 HydrophobicContact CE1-CE2 3.15Å; F18-F42 AromaticContact CE1-CG 3.29Å; F18-F42 HydrophobicContact CE1-CG 3.29Å; F18-F42 AromaticContact CE1-CZ 3.41Å; F18-F42 HydrophobicContact CE1-CZ 3.41Å; F18-F42 VanDerWaalsContact CE1-CZ 3.41Å; F18-F42 AromaticContact CE2-CD1 3.56Å; F18-F42 HydrophobicContact CE2-CD1 3.56Å; F18-F42 HydrophobicContact CE2-CD2 4.29Å; F18-F42 AromaticContact CE2-CE1 2.9Å; F18-F42 HydrophobicContact CE2-CE1 2.9Å; F18-F42 AromaticContact CE2-CE2 3.73Å; F18-F42 HydrophobicContact CE2-CE2 3.73Å; F18-F42 HydrophobicContact CE2-CG 4.24Å; F18-F42 AromaticContact CE2-CZ 3.01Å; F18-F42 HydrophobicContact CE2-CZ 3.01Å; F18-F42 AromaticContact CG-CD1 3.44Å; F18-F42 HydrophobicContact CG-CD1 3.44Å; F18-F42 VanDerWaalsContact CG-CD1 3.44Å; F18-F42 AromaticContact CG-CE1 3.73Å; F18-F42 HydrophobicContact CG-CE1 3.73Å; F18-F42 AromaticContact CG-CG 3.96Å; F18-F42 HydrophobicContact CG-CG 3.96Å; F18-F42 HydrophobicContact CG-CZ 4.4Å; F18-F42 AromaticContact CZ-CD1 3.6Å; F18-F42 HydrophobicContact CZ-CD1 3.6Å; F18-F42 AromaticContact CZ-CD2 3.49Å; F18-F42 HydrophobicContact CZ-CD2 3.49Å; F18-F42 VanDerWaalsContact CZ-CD2 3.49Å; F18-F42 AromaticContact CZ-CE1 3.14Å; F18-F42 HydrophobicContact CZ-CE1 3.14Å; F18-F42 AromaticContact CZ-CE2 2.96Å; F18-F42 HydrophobicContact CZ-CE2 2.96Å; F18-F42 AromaticContact CZ-CG 3.8Å; F18-F42 HydrophobicContact CZ-CG 3.8Å; F18-F42 AromaticContact CZ-CZ 2.79Å; F18-F42 HydrophobicContact CZ-CZ 2.79Å
43	S	22.2	Very low	23.2	Very low	86 Å²	86	138 Å²	138	60%	0.601	73%	0.727	S	S	*	*			trans	-172.1	153.8	152.7	62	0	0	0	0	111.1	K17	K17-S43 PolarHBondContact O-N 3.4Å
44	Q	21.4	Very low	23.2	Very low	186 Å²	186	140.7 Å²	140.7	87%	0.869	73%	0.733	S	S	*	*			cis	-158.9	139.1	-27.3	-168.3	172.2	10.5	0	0	105.6
45	Y	22	Very low	23.3	Very low	104 Å²	104	132.4 Å²	132.4	41%	0.408	73%	0.725	S	S	.	*			trans	-75.8	150	-179.8	-82.5	-107.8	0	0	0	112.4	S15 L16 F47	S15-Y45 VanDerWaalsContact C-OH 3.22Å; S15-Y45 WeakPolarHBondContact CB-OH 3.48Å; S15-Y45 WeakPolarHBondContact O-CD2 3.41Å; S15-Y45 WeakPolarHBondContact O-CE2 3.43Å; S15-Y45 VanDerWaalsContact O-CZ 3.28Å; S15-Y45 WeakPolarHBondContact OG-CE1 3.35Å; S15-Y45 PolarHBondContact OG-OH 3.03Å; L16-Y45 PolarHBondContact N-OH 3.27Å; Y45-F47 HydrophobicContact CD1-CD2 4Å; Y45-F47 AromaticContact CD1-CE2 3.26Å; Y45-F47 HydrophobicContact CD1-CE2 3.26Å; Y45-F47 AromaticContact CD1-CZ 3.67Å; Y45-F47 HydrophobicContact CD1-CZ 3.67Å; Y45-F47 AromaticContact CE1-CE2 3.98Å; Y45-F47 HydrophobicContact CE1-CE2 3.98Å; Y45-F47 AromaticContact CE1-CZ 3.94Å; Y45-F47 HydrophobicContact CE1-CZ 3.94Å; Y45-F47 HydrophobicContact CG-CE2 4.04Å
46	V	23.4	Very low	23.4	Very low	135 Å²	135	134.8 Å²	134.8	82%	0.818	73%	0.729	S	S	*	*			trans	-133.9	115.5	149.3	-177.2	0	0	0	0	109.1	V48	V46-V48 HydrophobicContact CG1-CG2 4.41Å
47	F	20.6	Very low	23.3	Very low	111 Å²	111	136.5 Å²	136.5	49%	0.487	73%	0.733	S	S	.	*			trans	-91	129.8	166.8	-71.7	-90.5	0	0	0	107.9	Y45	Y45-F47 HydrophobicContact CD1-CD2 4Å; Y45-F47 AromaticContact CD1-CE2 3.26Å; Y45-F47 HydrophobicContact CD1-CE2 3.26Å; Y45-F47 AromaticContact CD1-CZ 3.67Å; Y45-F47 HydrophobicContact CD1-CZ 3.67Å; Y45-F47 AromaticContact CE1-CE2 3.98Å; Y45-F47 HydrophobicContact CE1-CE2 3.98Å; Y45-F47 AromaticContact CE1-CZ 3.94Å; Y45-F47 HydrophobicContact CE1-CZ 3.94Å; Y45-F47 HydrophobicContact CG-CE2 4.04Å
48	V	24.1	Very low	23.3	Very low	135 Å²	135	136.7 Å²	136.7	82%	0.818	73%	0.731	S	S	*	*			trans	-106	107.8	163.7	-177.1	0	0	0	0	107.2	V46	V46-V48 HydrophobicContact CG1-CG2 4.41Å
49	L	21	Very low	23.2	Very low	162 Å²	162	133.6 Å²	133.6	85%	0.848	74%	0.736	S	S	*	*			trans	-87.3	117.1	163.5	-74.5	158.9	0	0	0	106
50	G	24.8	Very low	23.3	Very low	73 Å²	73	127.8 Å²	127.8	75%	0.753	73%	0.726	S	S	*	*			trans	-109.6	111.9	163.3	0	0	0	0	0	107.1
51	D	27.3	Very low	23.4	Very low	157 Å²	157	129.4 Å²	129.4	84%	0.84	74%	0.741	S	S	*	*			trans	-66.9	165.3	172.8	-84.1	-35.2	0	0	0	111
52	E	25.6	Very low	23.5	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	75%	0.754	S	S	*	*	S	Bend	trans	-44	147.6	176	-59.8	178.3	153.8	0	0	114.3
53	D	33.5	Very low	23.5	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	77%	0.773	S	S	*	*	S	Bend	trans	73.4	129.8	164.1	-57.9	-28.1	0	0	0	118.6
54	D	26.3	Very low	23.6	Very low	169 Å²	169	144 Å²	144	90%	0.904	78%	0.784	S	S	*	*			trans	80.6	115.9	174.3	-58.9	-25.3	0	0	0	118.5
55	G	23.8	Very low	23.6	Very low	75 Å²	75	139.5 Å²	139.5	77%	0.773	77%	0.773	S	S	*	*			trans	-73.6	147.9	-172.5	0	0	0	0	0	115.3
56	S	24.8	Very low	23.7	Very low	125 Å²	125	142.5 Å²	142.5	87%	0.874	80%	0.796	S	S	*	*			trans	-175.5	137.4	135.4	18.1	0	0	0	0	109.7
57	Q	22.5	Very low	23.5	Very low	184 Å²	184	143 Å²	143	86%	0.86	79%	0.793	S	S	*	*			trans	-62.5	146.5	178.1	-67	167.8	-14.7	0	0	112.2
58	M	21.1	Very low	23.6	Very low	173 Å²	173	143.4 Å²	143.4	85%	0.852	81%	0.809	S	S	*	*			trans	-146.7	117.8	139.3	-83.8	-154.2	82.6	0	0	110.7
59	C	21.4	Very low	23.5	Very low	115 Å²	115	142.8 Å²	142.8	78%	0.777	81%	0.805	S	S	*	*			trans	-72.7	126.8	163.2	-65.4	0	0	0	0	109
60	V	23.3	Very low	23.6	Very low	116 Å²	116	143.2 Å²	143.2	70%	0.703	80%	0.803	S	S	*	*			trans	-113	93.4	163	-176	0	0	0	0	107.5	R62	V60-R62 HydrophobicContact CG1-CG 4.24Å; V60-R62 PolarHBondContact O-N 3.4Å
61	S	20.6	Very low	23.6	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	80%	0.802	S	S	*	*			trans	-62.2	117.8	158.7	30.8	0	0	0	0	108.6
62	R	24	Very low	23.3	Very low	233 Å²	233	147.6 Å²	147.6	88%	0.879	80%	0.803	S	S	*	*			trans	-130.8	104.4	159.6	-86.8	-168.4	176.6	167.4	0.4	109.9	V60	V60-R62 HydrophobicContact CG1-CG 4.24Å; V60-R62 PolarHBondContact O-N 3.4Å
63	F	20.7	Very low	23.1	Very low	188 Å²	188	147.7 Å²	147.7	83%	0.825	80%	0.801	S	S	*	*			trans	-37.3	136.1	148.9	-84.4	-105.3	0	0	0	111.9
64	N	23.5	Very low	22.6	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	81%	0.805	S	S	*	*				-160.5	119.4	122.8	-102	-2.5	0	0	0	111.2
65	S	21.4	Very low	22.5	Very low	90 Å²	90	144.2 Å²	144.2	63%	0.629	80%	0.796	S	S	*	*			trans	-55.5	128.7	163.7	43.5	0	0	0	0	112.5
66	N	23.7	Very low	22.5	Very low	167 Å²	167	148.2 Å²	148.2	89%	0.893	80%	0.8	S	S	*	*			trans	-121	88.7	156	-83.6	-10.4	0	0	0	107.4
67	I	20.3	Very low	22.4	Very low	146 Å²	146	147 Å²	147	75%	0.749	79%	0.792	S	S	*	*			trans	-77.8	120.3	160.2	-73.8	169.7	0	0	0	105.9	V69	I67-V69 HydrophobicContact CG2-CB 4.49Å; I67-V69 HydrophobicContact CG2-CG2 3.73Å
68	S	22.2	Very low	22.4	Very low	120 Å²	120	145.7 Å²	145.7	84%	0.839	79%	0.79	S	S	*	*			trans	-104.8	107.2	163.5	57.4	0	0	0	0	107.6
69	V	21.6	Very low	22.6	Very low	121 Å²	121	145 Å²	145	73%	0.733	79%	0.789	S	S	*	*			trans	-120.3	147	164.5	173.8	0	0	0	0	105.4	I67	I67-V69 HydrophobicContact CG2-CB 4.49Å; I67-V69 HydrophobicContact CG2-CG2 3.73Å
70	E	23.8	Very low	22.6	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	79%	0.792	S	S	*	*			trans	114.9	119.8	-176	-68	178.9	-166.2	0	0	110.8
71	D	24.9	Very low	22.6	Very low	136 Å²	136	146.5 Å²	146.5	73%	0.727	80%	0.795	S	S	*	*			cis	-158.2	126.7	5.4	-94.9	-32.9	0	0	0	110
72	E	19.9	Very low	22.6	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	80%	0.795	S	S	*	*			trans	-88.4	95	152.3	-87.8	-173.4	147.8	0	0	107.5
73	F	21.7	Very low	22.5	Very low	179 Å²	179	142.7 Å²	142.7	79%	0.785	79%	0.793	S	S	*	*			trans	-158.8	96.7	153.6	-94.1	-70.3	0	0	0	110.1	V75	F73-V75 HydrophobicContact CD1-CG2 3.83Å; F73-V75 HydrophobicContact CE1-CG2 4.08Å
74	S	23.4	Very low	22.5	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	79%	0.79	S	S	*	*			trans	-122.7	75.8	152.5	58.8	0	0	0	0	108.1	N76	S74-N76 PolarHBondContact O-N 2.94Å
75	V	23.8	Very low	22.4	Very low	119 Å²	119	139.9 Å²	139.9	72%	0.721	79%	0.787	S	S	*	*			trans	-74.1	105.7	162.6	170.3	0	0	0	0	106.8	F73 S77	F73-V75 HydrophobicContact CD1-CG2 3.83Å; F73-V75 HydrophobicContact CE1-CG2 4.08Å; V75-S77 PolarHBondContact O-N 3.49Å
76	N	23.7	Very low	22.6	Very low	159 Å²	159	143.4 Å²	143.4	85%	0.85	80%	0.797	S	S	*	*			trans	-61.7	111.6	164.9	-100	-17.8	0	0	0	108.9	S74 N78	S74-N76 PolarHBondContact O-N 2.94Å; N76-N78 PolarHBondContact O-N 3.46Å
77	S	23	Very low	22.4	Very low	101 Å²	101	141.8 Å²	141.8	71%	0.706	79%	0.788	S	S	*	*			trans	-62.6	106.1	163.1	51.6	0	0	0	0	110	V75	V75-S77 PolarHBondContact O-N 3.49Å
78	N	22.3	Very low	22.5	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	79%	0.785	S	S	*	*			trans	-178.1	62.2	149.8	-93.2	-11.6	0	0	0	111.4	N76	N76-N78 PolarHBondContact O-N 3.46Å
79	I	25.6	Very low	22.4	Very low	159 Å²	159	142.5 Å²	142.5	82%	0.815	78%	0.784	S	S	*	*			trans	-136.8	92.1	150.2	-58.3	-177.9	0	0	0	107.4	T81	I79-T81 PolarHBondContact O-N 3Å
80	T	20.1	Very low	22.5	Very low	140 Å²	140	141.5 Å²	141.5	86%	0.859	78%	0.783	S	S	*	*			trans	-67.3	110.2	159.9	21.5	0	0	0	0	109.6
81	T	23.5	Very low	22.3	Very low	122 Å²	122	140 Å²	140	75%	0.748	78%	0.78	S	S	*	*			trans	-142.4	104	150.2	5.6	0	0	0	0	109.6	I79	I79-T81 PolarHBondContact O-N 3Å
82	T	20.5	Very low	22.2	Very low	123 Å²	123	139.8 Å²	139.8	76%	0.755	78%	0.779	S	S	*	*			trans	-42.6	132.5	157.9	42.4	0	0	0	0	113
83	T	22.4	Very low	22.3	Very low	137 Å²	137	137 Å²	137	84%	0.84	77%	0.77	S	S	*	*				175	142.6	95.8	30.8	0	0	0	0	111.4
84	N	20.9	Very low	22.3	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	77%	0.774	S	S	*	*			trans	-56.7	159.2	173.7	-67.9	-16.4	0	0	0	115.5
85	D	21	Very low	22.2	Very low	143 Å²	143	133.7 Å²	133.7	77%	0.765	77%	0.768	S	S	*	*			trans	63.1	127.5	143.6	-60.6	-30.1	0	0	0	120.3
86	I	25.6	Very low	22.1	Very low	164 Å²	164	133.6 Å²	133.6	84%	0.841	77%	0.772	S	S	*	*			trans	159.4	93.3	144.3	-77.9	150.2	0	0	0	104.4
87	N	20.9	Very low	22.3	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	77%	0.774	S	S	*	*				58	121	67.7	-147.4	11.8	0	0	0	115.2
88	N	21.5	Very low	22.2	Very low	127 Å²	127	135.6 Å²	135.6	68%	0.679	77%	0.773	S	S	*	*			trans	66.4	113	153.4	-77.4	-25.3	0	0	0	121.4
89	N	20.4	Very low	22.4	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	77%	0.765	S	S	*	*				70.4	141.9	106.6	-142.8	7.7	0	0	0	119.4
90	S	23.9	Very low	22.2	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	76%	0.764	S	S	*	*			trans	88.3	99.7	163.8	-157.9	0	0	0	0	118.2
91	N	20	Very low	22.5	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	76%	0.764	S	S	*	*				26.9	136.1	112.9	-91.3	-9	0	0	0	119.3
92	N	21.8	Very low	22.6	Very low	130 Å²	130	133.5 Å²	133.5	70%	0.695	76%	0.761	S	S	*	*			trans	92.1	115.3	148.8	-72.5	-15.8	0	0	0	119.2
93	N	21.7	Very low	22.8	Very low	129 Å²	129	134.7 Å²	134.7	69%	0.69	76%	0.763	S	S	*	*				77.3	127.5	127.1	-72.2	-14.6	0	0	0	120.4
94	N	22.4	Very low	22.8	Very low	161 Å²	161	133.2 Å²	133.2	86%	0.861	76%	0.758	S	S	*	*			trans	76.8	121.1	142.4	-67.8	-14.3	0	0	0	118.6
95	G	21.1	Very low	23	Very low	70 Å²	70	132.2 Å²	132.2	72%	0.722	76%	0.762	S	S	*	*			trans	143.4	81.4	141.9	0	0	0	0	0	115.9
96	S	22.6	Very low	23.1	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	77%	0.768	S	S	*	*			trans	28.4	99.8	132.4	169.2	0	0	0	0	117.5
97	I	27.2	Very low	23.1	Very low	173 Å²	173	130.9 Å²	130.9	89%	0.887	76%	0.761	S	S	*	*			trans	-133.6	135.7	137.5	-64.2	-174.9	0	0	0	108.5
98	N	21.6	Very low	23.1	Very low	130 Å²	130	132.2 Å²	132.2	70%	0.695	77%	0.768	S	S	*	*			trans	-86	169	-167	-130.3	16.4	0	0	0	112.4
99	D	24.8	Very low	23.2	Very low	123 Å²	123	132.6 Å²	132.6	66%	0.658	77%	0.77	S	S	*	*			trans	87.4	102.7	151	-56.4	-26.1	0	0	0	119.8
100	N	22.4	Very low	23.4	Very low	150 Å²	150	132.3 Å²	132.3	80%	0.802	77%	0.768	S	S	*	*				56.9	83	129.8	-62.9	-22.8	0	0	0	117.5
101	N	26.9	Very low	23.3	Very low	160 Å²	160	135 Å²	135	86%	0.856	77%	0.772	S	S	*	*				-146.2	138.8	128.7	-134	-10.4	0	0	0	112.2
102	S	25	Very low	23.5	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	77%	0.774	S	S	*	*			trans	-50.9	134.7	-174.8	11.4	0	0	0	0	115.8
103	N	23.7	Very low	23.6	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	77%	0.773	S	S	*	*			trans	48.2	102.5	134.6	-74.3	-3.7	0	0	0	119.9
104	S	23.7	Very low	23.8	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	78%	0.777	S	S	*	*				57.3	90.2	121.8	68.3	0	0	0	0	118.4
105	S	25.2	Very low	23.8	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	78%	0.775	S	S	*	*				-178.7	78.9	115.5	37.5	0	0	0	0	109.5
106	N	22.2	Very low	23.9	Very low	167 Å²	167	134.8 Å²	134.8	89%	0.893	77%	0.773	S	S	*	*			trans	-66.3	123.1	144.2	-99.5	-9.4	0	0	0	106.4
107	V	25.1	Very low	23.9	Very low	112 Å²	112	137.4 Å²	137.4	68%	0.679	78%	0.776	S	S	*	*				-163.4	100.6	122.4	172.3	0	0	0	0	105.8	D109	V107-D109 HydrophobicContact CG1-CB 3.6Å; V107-D109 WeakPolarHBondContact CG1-OD2 3.36Å
108	N	21.6	Very low	23.7	Very low	161 Å²	161	133.7 Å²	133.7	86%	0.861	77%	0.765	S	S	*	*			trans	-91.7	87.3	156.5	-159.2	27.6	0	0	0	104.5
109	D	24.4	Very low	23.8	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	77%	0.77	S	S	*	*			trans	-97.1	109	169.3	-87.5	-19.2	0	0	0	108	V107 M111	V107-D109 HydrophobicContact CG1-CB 3.6Å; V107-D109 WeakPolarHBondContact CG1-OD2 3.36Å; D109-M111 PolarHBondContact O-N 3.05Å
110	N	23.4	Very low	23.6	Very low	149 Å²	149	135.1 Å²	135.1	80%	0.797	78%	0.778	S	S	*	*			trans	-45.8	114.9	150.4	-92.3	-8.1	0	0	0	109.5
111	M	22.9	Very low	23.5	Very low	156 Å²	156	132.7 Å²	132.7	77%	0.768	77%	0.772	S	S	*	*			trans	-134.6	70.3	150.5	-91.2	-71.1	-119.5	0	0	107.9	D109	D109-M111 PolarHBondContact O-N 3.05Å
112	E	23.8	Very low	23.2	Very low	172 Å²	172	133.4 Å²	133.4	80%	0.804	77%	0.773	S	S	*	*			trans	-65	143.3	138.8	-127.8	174.8	178	0	0	107.5
113	S	24.8	Very low	23.1	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	78%	0.782	S	S	*	*			trans	88.8	77.3	176.5	79.9	0	0	0	0	118.7
114	V	25	Very low	23	Very low	125 Å²	125	138.6 Å²	138.6	76%	0.758	79%	0.786	S	S	*	*			trans	-139.7	73.6	135.9	-169.7	0	0	0	0	109.1
115	T	22.3	Very low	23	Very low	136 Å²	136	138.3 Å²	138.3	83%	0.834	78%	0.784	S	S	*	*			trans	-83.4	102.4	152	42.8	0	0	0	0	108
116	S	23.2	Very low	23.2	Very low	96 Å²	96	141.1 Å²	141.1	67%	0.671	78%	0.783	S	S	*	*			trans	-178.7	77.6	153.2	52.2	0	0	0	0	109.6
117	I	22.8	Very low	23.3	Very low	171 Å²	171	140.3 Å²	140.3	88%	0.877	78%	0.779	S	S	*	*			trans	-94.4	97	149	-62.8	178	0	0	0	104.2	D119	I117-D119 PolarHBondContact O-N 3.13Å
118	S	23.4	Very low	23.3	Very low	95 Å²	95	140.6 Å²	140.6	66%	0.664	79%	0.786	S	S	*	*			trans	-57.2	123.9	171.2	28.7	0	0	0	0	109.5	V120	S118-V120 PolarHBondContact O-N 3.23Å
119	D	22.3	Very low	23.3	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	79%	0.787	S	S	*	*			trans	-55.3	108	168.2	-71.6	-47.7	0	0	0	109.5	I117 S121	I117-D119 PolarHBondContact O-N 3.13Å; D119-S121 PolarHBondContact O-N 3.47Å; D119-S121 PolarHBondContact O-OG 2.87Å
120	V	20.9	Very low	23.2	Very low	135 Å²	135	140.9 Å²	140.9	82%	0.818	80%	0.796	S	S	*	*			trans	-70.7	89.4	167.3	180	0	0	0	0	107.1	S118 M122	S118-V120 PolarHBondContact O-N 3.23Å; V120-M122 HydrophobicContact CG1-CG 4.5Å; V120-M122 PolarHBondContact O-N 3.12Å
121	S	21.6	Very low	23	Very low	99 Å²	99	142.5 Å²	142.5	69%	0.692	80%	0.796	S	S	*	*			trans	-77.6	110.3	170.9	-50.3	0	0	0	0	107.9	D119 E123	D119-S121 PolarHBondContact O-N 3.47Å; D119-S121 PolarHBondContact O-OG 2.87Å; S121-E123 PolarHBondContact O-N 2.96Å
122	M	20.7	Very low	23	Very low	176 Å²	176	140.5 Å²	140.5	87%	0.867	79%	0.792	S	S	*	*			trans	-84	95.7	169.4	-66.9	-154.3	-62.1	0	0	109	V120	V120-M122 HydrophobicContact CG1-CG 4.5Å; V120-M122 PolarHBondContact O-N 3.12Å
123	E	22.3	Very low	22.8	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	79%	0.791	S	S	*	*			trans	-83.7	115.2	165.1	-80.7	-173.1	156.7	0	0	109.6	S121 S125	S121-E123 PolarHBondContact O-N 2.96Å; E123-S125 PolarHBondContact O-N 3.49Å
124	L	22.1	Very low	22.7	Very low	170 Å²	170	143.7 Å²	143.7	89%	0.89	80%	0.796	S	S	*	*			trans	-76.8	94.3	171.6	-76.2	157.6	0	0	0	108.8
125	S	23.9	Very low	22.5	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	80%	0.798	S	S	*	*			trans	-81.5	121	162.9	56.8	0	0	0	0	109.4	E123 D127	E123-S125 PolarHBondContact O-N 3.49Å; S125-D127 PolarHBondContact O-N 2.84Å
126	H	28	Very low	22.6	Very low	179 Å²	179	144 Å²	144	83%	0.829	80%	0.8	S	S	*	*	S	Bend	trans	-59.2	128	169.3	-76.6	-93.6	0	0	0	109.1
127	D	24.3	Very low	22.5	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	80%	0.803	S	S	*	*	S	Bend	trans	89.6	83.4	178.2	-52.6	-23	0	0	0	116.7	S125	S125-D127 PolarHBondContact O-N 2.84Å
128	S	25.6	Very low	22.5	Very low	118 Å²	118	146.4 Å²	146.4	83%	0.825	81%	0.806	S	S	*	*				169.9	143.4	126	43.4	0	0	0	0	112.3
129	C	22.1	Very low	22.3	Very low	131 Å²	131	149 Å²	149	89%	0.885	81%	0.813	S	S	*	*			trans	-50.8	133	-174.8	-68.1	0	0	0	0	114.6	K131	C129-K131 PolarHBondContact O-N 3.2Å; C129-K131 VanDerWaalsContact O-N 3.09Å
130	L	21.6	Very low	22.3	Very low	171 Å²	171	151.5 Å²	151.5	90%	0.895	82%	0.819	S	S	*	*			trans	-54.9	107.2	170.1	-71.4	160.1	0	0	0	111.1
131	K	20.2	Very low	22.2	Very low	183 Å²	183	153.6 Å²	153.6	80%	0.796	82%	0.82	S	S	*	*			trans	-104.1	107.5	156.3	-127.4	-177.1	-179.6	-171.4	0	106.8	C129 E133	C129-K131 PolarHBondContact O-N 3.2Å; C129-K131 VanDerWaalsContact O-N 3.09Å; K131-E133 PolarHBondContact O-N 3.3Å
132	V	21.3	Very low	22.4	Very low	113 Å²	113	158.1 Å²	158.1	69%	0.685	83%	0.831	S	S	*	*			trans	-77.8	99.8	175.4	178.7	0	0	0	0	106.9
133	E	20.6	Very low	22.4	Very low	169 Å²	169	156.7 Å²	156.7	79%	0.79	83%	0.826	S	S	*	*			trans	-88.6	118.5	168.3	-73.5	-165.5	166.7	0	0	109.3	K131 G135	K131-E133 PolarHBondContact O-N 3.3Å; E133-G135 PolarHBondContact O-N 3.43Å
134	H	22.4	Very low	22.4	Very low	167 Å²	167	153.6 Å²	153.6	77%	0.773	82%	0.82	S	S	*	*			trans	-72.6	107.5	173.5	-74.2	-76.8	0	0	0	109.3	E136	H134-E136 PolarHBondContact O-N 3.26Å; H134-E136 VanDerWaalsContact O-N 3.08Å
135	G	21.4	Very low	22.3	Very low	78 Å²	78	152.8 Å²	152.8	80%	0.804	82%	0.817	S	S	*	*			trans	-74.2	88.6	168.1	0	0	0	0	0	110.8	E133	E133-G135 PolarHBondContact O-N 3.43Å
136	E	23.5	Very low	22.2	Very low	190 Å²	190	156.4 Å²	156.4	89%	0.888	83%	0.825	S	S	*	*			trans	-81.9	106.5	157.9	-77.9	-175.3	159.5	0	0	108.6	H134	H134-E136 PolarHBondContact O-N 3.26Å; H134-E136 VanDerWaalsContact O-N 3.08Å
137	S	21.9	Very low	21.7	Very low	105 Å²	105	157 Å²	157	73%	0.734	83%	0.828	S	S	*	*			trans	-99.1	99.8	169.9	58.7	0	0	0	0	109.5
138	F	22	Very low	21.8	Very low	212 Å²	212	157.6 Å²	157.6	93%	0.93	83%	0.83	S	S	*	*			trans	-136.8	125.8	151.9	-96	-80.3	0	0	0	110.5
139	N	19.9	Very low	21.7	Very low	151 Å²	151	159.6 Å²	159.6	81%	0.807	83%	0.831	S	S	*	*			trans	-49.6	143.4	173.4	-77.3	-45.1	0	0	0	113.2
140	E	22	Very low	21.7	Very low	199 Å²	199	160.3 Å²	160.3	93%	0.93	83%	0.826	S	S	*	*				-155.1	129.8	129	-114.2	173.1	-166.1	0	0	111.6
141	Q	19.3	Very low	21.7	Very low	180 Å²	180	159.5 Å²	159.5	84%	0.841	82%	0.823	S	S	*	*			trans	-76	144	176.8	-63.6	163.8	-29.3	0	0	110.3
142	Q	24.8	Very low	21.9	Very low	194 Å²	194	156.6 Å²	156.6	91%	0.907	83%	0.825	S	S	*	*			trans	-173.1	99.6	140.6	-104.8	170.1	35.4	0	0	113
143	N	20.5	Very low	22.1	Very low	146 Å²	146	158.6 Å²	158.6	78%	0.781	83%	0.832	S	S	*	*				33.8	138.3	124.8	-84.9	-8.2	0	0	0	124
144	T	23.7	Very low	22.3	Very low	120 Å²	120	157.9 Å²	157.9	74%	0.736	83%	0.834	S	S	*	*			trans	92.1	108	137.7	52.5	0	0	0	0	122.2
145	N	18.7	Very low	22.4	Very low	152 Å²	152	155.2 Å²	155.2	81%	0.813	83%	0.834	S	S	*	*				32.8	125.2	127.3	-64.7	-6.3	0	0	0	120.5
146	M	21.7	Very low	22.4	Very low	176 Å²	176	162.7 Å²	162.7	87%	0.867	84%	0.838	S	S	*	*				-177.7	130.8	120.1	-91.5	-99.7	-72.3	0	0	110.7
147	E	17.8	Very low	22.5	Very low	191 Å²	191	160.7 Å²	160.7	89%	0.893	84%	0.838	S	S	*	*			trans	-65.3	138.1	166.8	-72.2	168.8	140.6	0	0	110.8
148	I	27.8	Very low	22.5	Very low	164 Å²	164	164.2 Å²	164.2	84%	0.841	85%	0.848	S	S	*	*			trans	-138.1	132.7	157.9	-62.5	-176.2	0	0	0	108.9
149	D	23.3	Very low	22.5	Very low	159 Å²	159	159.2 Å²	159.2	85%	0.85	84%	0.839	S	S	*	*			trans	-55.1	156.4	-170.6	-81.4	-50.6	0	0	0	119.2
150	D	20.8	Very low	22.5	Very low	147 Å²	147	158 Å²	158	79%	0.786	84%	0.84	S	S	*	*			trans	-60.6	136.4	160.6	-75.3	-42.9	0	0	0	114.2
151	N	21.9	Very low	22.3	Very low	154 Å²	154	157.9 Å²	157.9	82%	0.824	84%	0.836	S	S	*	*			trans	138.7	112	136.9	-76.2	-52.4	0	0	0	113.3
152	S	25.4	Very low	22.3	Very low	122 Å²	122	154.6 Å²	154.6	85%	0.853	83%	0.832	S	S	*	*				158.1	140.2	121	52.2	0	0	0	0	111.9
153	D	25.6	Very low	22	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	82%	0.824	S	S	*	*			trans	-64.9	166	-178.3	-67.2	-58.6	0	0	0	114.9
154	D	24	Very low	22	Very low	155 Å²	155	148.5 Å²	148.5	83%	0.829	82%	0.822	S	S	*	*			trans	77.8	89	164.2	-66.7	-26.6	0	0	0	118.8
155	S	24.1	Very low	21.9	Very low	110 Å²	110	151 Å²	151	77%	0.769	83%	0.83	S	S	*	*				159.5	126.8	100.6	54	0	0	0	0	113.4
156	R	21.4	Very low	21.9	Very low	236 Å²	236	152 Å²	152	89%	0.891	83%	0.83	S	S	*	*			trans	53	93.6	148.1	-64.8	179.2	173.8	178.1	-1.7	118.2
157	T	25.1	Very low	21.8	Very low	147 Å²	147	148.5 Å²	148.5	90%	0.902	82%	0.823	S	S	*	*				-155.6	93.9	123.1	22.7	0	0	0	0	108.3	S159	T157-S159 PolarHBondContact O-N 3.38Å
158	L	22	Very low	22	Very low	179 Å²	179	147.6 Å²	147.6	94%	0.937	82%	0.823	S	S	*	*			trans	-75.3	106.1	174.4	-79.8	158.7	0	0	0	109
159	S	21.7	Very low	21.4	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	82%	0.816	S	S	*	*			trans	-138.5	114.6	144.7	59.6	0	0	0	0	107.4	T157	T157-S159 PolarHBondContact O-N 3.38Å
160	P	21.8	Very low	21.2	Very low	126 Å²	126	144.9 Å²	144.9	82%	0.818	81%	0.812	S	S	*	*			trans	-82	128.3	-167.8	31	-31.2	0	0	0	110.9
161	K	16.9	Very low	21.1	Very low	196 Å²	196	142.4 Å²	142.4	85%	0.852	81%	0.807	S	S	*	*			trans	-77.1	163.9	152.5	-88.4	178.1	172.5	175.4	0	110.3
162	C	19.3	Very low	21	Very low	112 Å²	112	139.7 Å²	139.7	76%	0.757	80%	0.8	S	S	*	*			trans	93.4	114.6	162.1	-60	0	0	0	0	114.9
163	S	18.3	Very low	20.7	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	80%	0.795	S	S	*	*				73.3	141.4	59.1	75.6	0	0	0	0	114.4
164	S	21.2	Very low	20.5	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	79%	0.786	S	S	*	*			trans	85.4	117.6	173.5	75.1	0	0	0	0	118
165	L	22	Very low	20.2	Very low	172 Å²	172	138.2 Å²	138.2	90%	0.901	78%	0.782	S	S	*	*				-175.7	119.9	106.8	-96.1	158.1	0	0	0	111.7
166	E	17.3	Very low	20	Very low	173 Å²	173	139.9 Å²	139.9	81%	0.808	78%	0.779	S	S	*	*			trans	-72.5	154.8	158.5	-71.9	174.9	134.2	0	0	111.2
167	S	19.6	Very low	19.9	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	77%	0.77	S	S	*	*			trans	61	120	150	67.6	0	0	0	0	119.9
168	I	21.6	Very low	19.8	Very low	173 Å²	173	134.1 Å²	134.1	89%	0.887	76%	0.763	S	S	*	*			trans	-142.4	130.6	132.1	-61.3	-173	0	0	0	109.4
169	T	16.8	Very low	19.7	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	76%	0.756	S	S	*	*			trans	-113.9	157.4	173.3	-14.2	0	0	0	0	108.5
170	I	18.8	Very low	19.8	Very low	149 Å²	149	136.6 Å²	136.6	76%	0.764	76%	0.763	S	S	*	*			trans	77.2	124.2	155.7	-4.2	-178.7	0	0	0	122.6
171	S	17.8	Very low	19.7	Very low	96 Å²	96	139.1 Å²	139.1	67%	0.671	76%	0.764	S	S	*	*				78.7	139.7	124.2	59.8	0	0	0	0	124.5
172	S	19.7	Very low	20.1	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	77%	0.77	S	S	*	*			trans	94.7	120.5	136.1	75.5	0	0	0	0	117
173	V	20.2	Very low	20.2	Very low	123 Å²	123	137.8 Å²	137.8	75%	0.745	77%	0.765	S	S	*	*				98.6	135.2	109.3	153.6	0	0	0	0	109.4
174	D	20	Very low	20.3	Very low	121 Å²	121	143.6 Å²	143.6	65%	0.647	77%	0.773	S	S	*	*			cis	-165.7	158.8	13	-115.8	-11.3	0	0	0	110.3
175	E	19.2	Very low	20.4	Very low	156 Å²	156	145 Å²	145	73%	0.729	78%	0.777	S	S	*	*			trans	60.5	132	134.9	-69.8	-173.5	151.1	0	0	126.1
176	M	19.8	Very low	20.3	Very low	145 Å²	145	142.9 Å²	142.9	71%	0.714	77%	0.774	S	S	*	*				103.6	103	128.2	-87	-179.2	76.7	0	0	121.6
177	I	19	Very low	20.3	Very low	138 Å²	138	145.7 Å²	145.7	71%	0.708	78%	0.777	S	S	*	*				50	121.8	120.5	-51.8	172	0	0	0	115.8
178	V	23.8	Very low	20.5	Very low	124 Å²	124	149.7 Å²	149.7	75%	0.752	78%	0.784	S	S	*	*				-167.1	141.1	88.7	166.4	0	0	0	0	110.8
179	Q	19	Very low	20.4	Very low	170 Å²	170	149 Å²	149	79%	0.794	78%	0.777	S	S	*	*			trans	-25.7	135.6	164.9	-64.8	158.9	-26.5	0	0	118.4
180	N	23.6	Very low	20.8	Very low	167 Å²	167	152.3 Å²	152.3	89%	0.893	78%	0.784	S	S	*	*				-164.2	137	119	-105.3	-12.2	0	0	0	112.5
181	E	20.6	Very low	21	Very low	180 Å²	180	151.5 Å²	151.5	84%	0.841	78%	0.781	S	S	*	*			trans	-75.9	135.2	-170.1	-60.2	174	142.5	0	0	113.1
182	L	25.2	Very low	21.2	Very low	184 Å²	184	152.7 Å²	152.7	96%	0.963	78%	0.784	S	S	*	*			trans	-144.2	92.1	153.7	-103.8	154.6	0	0	0	107.4
183	S	20.9	Very low	21.5	Very low	95 Å²	95	153.8 Å²	153.8	66%	0.664	79%	0.792	S	S	*	*			trans	-88.7	120.7	-168.3	49.7	0	0	0	0	112.4
184	Y	19.7	Very low	21.7	Very low	226 Å²	226	155.4 Å²	155.4	89%	0.886	80%	0.796	S	S	*	*			trans	-177.2	84.7	130.5	-100.8	-73.4	0	0	0	108.1
185	T	23.4	Very low	21.7	Very low	137 Å²	137	157.5 Å²	157.5	84%	0.84	80%	0.804	S	S	*	*			trans	-111.6	118.4	169.9	38.4	0	0	0	0	109.6
186	P	20.6	Very low	22.1	Very low	129 Å²	129	159.3 Å²	159.3	84%	0.838	81%	0.812	S	S	*	*			trans	-81.5	132	166.5	19.2	-7.7	0	0	0	110.6
187	R	16.8	Very low	22.3	Very low	232 Å²	232	158 Å²	158	88%	0.875	81%	0.812	S	S	*	*			trans	-73	136.1	158	-73.8	173.3	164.3	155.6	-4.7	109.6
188	H	23.4	Very low	22.4	Very low	185 Å²	185	160.2 Å²	160.2	86%	0.856	82%	0.82	S	S	*	*				176.8	145.4	123.1	-95.9	-66.1	0	0	0	112.8
189	H	20.1	Very low	22.3	Very low	159 Å²	159	159.4 Å²	159.4	74%	0.736	82%	0.82	S	S	*	*			trans	-59.1	157.6	178	-69.9	-100.8	0	0	0	115.3
190	H	25.7	Very low	22.4	Very low	186 Å²	186	156.5 Å²	156.5	86%	0.861	82%	0.818	S	S	*	*				-172.8	129.6	121.8	-91.6	-57	0	0	0	113.8
191	D	22.8	Very low	22.4	Very low	132 Å²	132	155.9 Å²	155.9	71%	0.706	81%	0.813	S	S	*	*			trans	-28.6	137	174.4	-67.5	-54.2	0	0	0	123.2
192	V	22.9	Very low	22.4	Very low	120 Å²	120	152.2 Å²	152.2	73%	0.727	81%	0.806	S	S	*	*			trans	59.3	95.5	131.3	-163.8	0	0	0	0	119.1
193	S	24.9	Very low	22.3	Very low	121 Å²	121	149.2 Å²	149.2	85%	0.846	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-86.1	137	145.6	-59.7	0	0	0	0	109.5
194	D	24.8	Very low	22.3	Very low	157 Å²	157	152.3 Å²	152.3	84%	0.84	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-52	143.4	176.8	-68.8	-55.1	0	0	0	114.1
195	M	20.5	Very low	22.5	Very low	164 Å²	164	147 Å²	147	81%	0.808	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-53.7	125.8	175.6	-74.8	162.6	51.8	0	0	113.5	V197	M195-V197 HydrophobicContact CE-CG2 3.93Å
196	E	27.3	Very low	22.5	Very low	195 Å²	195	146.5 Å²	146.5	91%	0.911	80%	0.795	S	S	*	*			trans	-121.7	124.1	131.3	-84.6	-175.7	168	0	0	107.4
197	V	24.2	Very low	22.7	Very low	118 Å²	118	145.4 Å²	145.4	72%	0.715	79%	0.788	S	S	*	*			trans	-70.7	134.6	-167	169.4	0	0	0	0	110.8	M195 S199	M195-V197 HydrophobicContact CE-CG2 3.93Å; V197-S199 PolarHBondContact O-N 3.33Å
198	Q	20.6	Very low	23	Very low	184 Å²	184	141.1 Å²	141.1	86%	0.86	78%	0.782	S	S	*	*			trans	-52.4	119	165.8	-65.9	170.1	-21.7	0	0	110.9
199	S	21.9	Very low	23	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	77%	0.773	S	S	*	*			trans	-89.4	111	150.7	53.1	0	0	0	0	108	V197 I201	V197-S199 PolarHBondContact O-N 3.33Å; S199-I201 PolarHBondContact O-N 3.15Å
200	S	20.4	Very low	23.4	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	77%	0.772	S	S	*	*			trans	-61.3	110.5	173	50.2	0	0	0	0	110.4
201	I	24.5	Very low	23.3	Very low	154 Å²	154	136.5 Å²	136.5	79%	0.79	77%	0.766	S	S	*	*			trans	-102.5	100	158.5	-63.8	171.5	0	0	0	105.8	S199	S199-I201 PolarHBondContact O-N 3.15Å
202	C	20.2	Very low	23.5	Very low	103 Å²	103	138.4 Å²	138.4	70%	0.696	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-55.4	142.4	165.4	-73.3	0	0	0	0	109.5	L204	C202-L204 PolarHBondContact O-N 3.18Å
203	P	22.8	Very low	23.6	Very low	121 Å²	121	138 Å²	138	79%	0.786	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70.8	121.4	-174.5	28.7	-31.6	0	0	0	109.8
204	L	21.5	Very low	23.5	Very low	160 Å²	160	139 Å²	139	84%	0.838	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.5	127.5	162.7	-89.7	148.7	0	0	0	108.3	C202 V206	C202-L204 PolarHBondContact O-N 3.18Å; L204-V206 PolarHBondContact O-N 3.03Å
205	P	22.6	Very low	23.5	Very low	116 Å²	116	140 Å²	140	75%	0.753	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-67.4	123.8	177.4	19.2	-18.3	0	0	0	109.4	P207	P205-P207 WeakPolarHBondContact O-CD 3.38Å
206	V	24.6	Very low	23.5	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57.6	122.4	167.9	177.6	0	0	0	0	108	L204 L208	L204-V206 PolarHBondContact O-N 3.03Å; V206-L208 PolarHBondContact O-N 3.04Å
207	P	24.4	Very low	23.3	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	76%	0.764	S	S	*	*			trans	-67.4	109.7	164.5	-7.8	23.6	0	0	0	106.9	P205 N209	P205-P207 WeakPolarHBondContact O-CD 3.38Å; P207-N209 PolarHBondContact O-N 3.3Å
208	L	22.4	Very low	23.2	Very low	142 Å²	142	136.9 Å²	136.9	74%	0.743	77%	0.768	S	S	*	*			trans	-57.2	83.4	159.8	-83.3	150.1	0	0	0	108.5	V206 E210	V206-L208 PolarHBondContact O-N 3.04Å; L208-E210 VanDerWaalsContact C-N 3.34Å; L208-E210 HydrophobicContact CD2-CG 4.44Å; L208-E210 PolarHBondContact O-N 2.89Å
209	N	24.7	Very low	23.2	Very low	125 Å²	125	132.3 Å²	132.3	67%	0.668	76%	0.756	S	S	*	*			trans	-89.4	86.5	157	-81.8	6.6	0	0	0	107.3	P207 E211	P207-N209 PolarHBondContact O-N 3.3Å; N209-E211 PolarHBondContact O-N 3.06Å
210	E	26.9	Very low	23.3	Very low	151 Å²	151	133 Å²	133	71%	0.706	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-60.6	13.2	163.3	-81.7	-178.4	143.1	0	0	113.5	L208 L212 C213	L208-E210 VanDerWaalsContact C-N 3.34Å; L208-E210 HydrophobicContact CD2-CG 4.44Å; L208-E210 PolarHBondContact O-N 2.89Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.07Å; E210-C213 PolarHBondContact O-N 3.32Å
211	E	25.3	Very low	23.5	Very low	157 Å²	157	135.1 Å²	135.1	73%	0.734	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-77.9	-5.3	-179.2	-73	-170.9	152.7	0	0	114.7	N209	N209-E211 PolarHBondContact O-N 3.06Å
212	L	26.5	Very low	23.4	Very low	173 Å²	173	135.8 Å²	135.8	91%	0.906	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-91	5.5	170.3	-75.5	173.1	0	0	0	114.5	E210	E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.07Å
213	C	23.9	Very low	23.5	Very low	111 Å²	111	138 Å²	138	75%	0.75	76%	0.763	S	S	*	*	S	Bend	trans	-103.5	4.2	174	-75.7	0	0	0	0	115	E210 M215	E210-C213 PolarHBondContact O-N 3.32Å; C213-M215 PolarHBondContact O-N 2.79Å
214	N	23.4	Very low	23.3	Very low	141 Å²	141	138.8 Å²	138.8	75%	0.754	76%	0.76	S	S	*	*			trans	-101.9	57.5	173.3	-72.8	-14.6	0	0	0	112.5
215	M	24.1	Very low	23.3	Very low	180 Å²	180	137.8 Å²	137.8	89%	0.887	76%	0.755	S	S	*	*			trans	-119	75.1	148.9	-79.3	-82.2	-79.1	0	0	106	C213 I217	C213-M215 PolarHBondContact O-N 2.79Å; M215-I217 PolarHBondContact O-N 2.76Å
216	S	22.4	Very low	23.2	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	75%	0.754	S	S	*	*			trans	-44.1	126.8	164.7	41.2	0	0	0	0	109.6	I218	S216-I218 PolarHBondContact O-N 2.83Å
217	I	21.2	Very low	23.1	Very low	153 Å²	153	136.8 Å²	136.8	79%	0.785	75%	0.751	S	S	*	*			trans	-25.5	107.9	159	-61.9	157.3	0	0	0	109.1	M215 S219	M215-I217 PolarHBondContact O-N 2.76Å; I217-S219 PolarHBondContact O-N 2.78Å
218	I	22.1	Very low	22.8	Very low	153 Å²	153	138.5 Å²	138.5	79%	0.785	76%	0.755	S	S	*	*			trans	-62.6	96.7	155.7	-64.6	172.6	0	0	0	103.9	S216 T220	S216-I218 PolarHBondContact O-N 2.83Å; I218-T220 PolarHBondContact O-N 2.97Å; I218-T220 VanDerWaalsContact O-N 3.15Å
219	S	22.2	Very low	22.8	Very low	87 Å²	87	139.5 Å²	139.5	61%	0.608	76%	0.761	S	S	*	*			trans	-52.8	118.5	158.9	-85.2	0	0	0	0	106.2	I217 D221	I217-S219 PolarHBondContact O-N 2.78Å; S219-D221 PolarHBondContact O-N 3.05Å
220	T	23	Very low	22.7	Very low	123 Å²	123	141.2 Å²	141.2	76%	0.755	77%	0.77	S	S	*	*	S	Bend	trans	-71.3	67	169.2	48.7	0	0	0	0	109.1	I218	I218-T220 PolarHBondContact O-N 2.97Å; I218-T220 VanDerWaalsContact O-N 3.15Å
221	D	24.6	Very low	22.4	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	77%	0.772	S	S	*	*			trans	-136	46.2	162.9	-83.8	-32.3	0	0	0	107.8	S219	S219-D221 PolarHBondContact O-N 3.05Å
222	E	22	Very low	22.2	Very low	168 Å²	168	136.6 Å²	136.6	79%	0.785	77%	0.773	S	S	*	*			trans	-157.8	44.9	166.1	-111.6	175.2	-144.2	0	0	110.3	N224	E222-N224 PolarHBondContact O-N 3.4Å
223	L	22.1	Very low	21.9	Very low	151 Å²	151	135 Å²	135	79%	0.791	76%	0.764	S	S	*	*			trans	-87.5	75.1	147.8	-85.6	166.9	0	0	0	107.2	L225	L223-L225 PolarHBondContact O-N 3.34Å
224	N	20.3	Very low	21.7	Very low	136 Å²	136	135.8 Å²	135.8	73%	0.727	76%	0.76	S	S	*	*			trans	-66.2	81.9	157.1	-85.1	-36.8	0	0	0	108	E222 S226	E222-N224 PolarHBondContact O-N 3.4Å; N224-S226 PolarHBondContact O-N 3.01Å
225	L	21.7	Very low	21.6	Very low	139 Å²	139	137 Å²	137	73%	0.728	76%	0.759	S	S	*	*			trans	-70.8	75.3	152.9	-87.1	153	0	0	0	107.1	L223 T227	L223-L225 PolarHBondContact O-N 3.34Å; L225-T227 PolarHBondContact O-N 2.83Å
226	S	20.1	Very low	21.4	Very low	105 Å²	105	135.3 Å²	135.3	73%	0.734	75%	0.754	S	S	*	*			trans	-71.6	78.1	161.7	61.2	0	0	0	0	108.4	N224 N228	N224-S226 PolarHBondContact O-N 3.01Å; S226-N228 VanDerWaalsContact C-N 3.31Å
227	T	21.6	Very low	21.3	Very low	115 Å²	115	136.8 Å²	136.8	71%	0.706	76%	0.758	S	S	*	*			trans	-91.8	76.6	151.3	49.7	0	0	0	0	106.9	L225	L225-T227 PolarHBondContact O-N 2.83Å
228	N	19.3	Very low	22.2	Very low	142 Å²	142	134.2 Å²	134.2	76%	0.759	75%	0.751	S	S	*	*			trans	-159.4	94.3	161.7	-90.7	-19.3	0	0	0	106.7	S226	S226-N228 VanDerWaalsContact C-N 3.31Å
229	N	21.8	Very low	22.1	Very low	164 Å²	164	133.7 Å²	133.7	88%	0.877	75%	0.75	S	S	*	*				-156.9	116.5	129.3	-99.1	-19.9	0	0	0	109	G231	N229-G231 PolarHBondContact O-N 3.41Å
230	D	21.5	Very low	22.1	Very low	160 Å²	160	135.7 Å²	135.7	86%	0.856	75%	0.754	S	S	*	*			trans	-41.7	119.4	161.3	-71.7	-54.2	0	0	0	110.7	N232	D230-N232 PolarHBondContact O-N 3.2Å
231	G	20.8	Very low	21.9	Very low	73 Å²	73	133.7 Å²	133.7	75%	0.753	74%	0.744	S	S	*	*			trans	-71.5	111.3	150.4	0	0	0	0	0	108.6	N229	N229-G231 PolarHBondContact O-N 3.41Å
232	N	21.5	Very low	21.7	Very low	139 Å²	139	133.4 Å²	133.4	74%	0.743	74%	0.742	S	S	*	*			trans	57.3	113.4	140.5	-104.1	-7.6	0	0	0	119.3	D230 D234	D230-N232 PolarHBondContact O-N 3.2Å; N232-D234 PolarHBondContact O-N 3.49Å
233	I	19.5	Very low	21.7	Very low	140 Å²	140	131.5 Å²	131.5	72%	0.718	74%	0.744	S	S	*	*				26.5	101.8	115.2	-50.7	173.8	0	0	0	114.2
234	D	20.9	Very low	21.6	Very low	126 Å²	126	130.6 Å²	130.6	67%	0.674	74%	0.74	S	S	*	*				-159.8	124.6	108.6	-116.5	-24	0	0	0	113.4	N232	N232-D234 PolarHBondContact O-N 3.49Å
235	K	20.7	Very low	22	Very low	168 Å²	168	133.6 Å²	133.6	73%	0.73	75%	0.747	S	S	*	*			trans	27.5	124.9	136.3	-66.7	174.6	-172.5	162.8	0	120.1
236	N	19.7	Very low	22.1	Very low	144 Å²	144	136 Å²	136	77%	0.77	75%	0.752	S	S	*	*				72.6	117.7	128.4	-69.9	-20.5	0	0	0	119.9
237	V	21	Very low	22.1	Very low	136 Å²	136	138.9 Å²	138.9	82%	0.824	75%	0.753	S	S	*	*			trans	92	142.4	132.2	170.8	0	0	0	0	116.3
238	P	39.4	Very low	22.3	Very low	98 Å²	98	139.5 Å²	139.5	64%	0.636	76%	0.762	S	S	*	*			trans	-114	169	-135.6	43.2	-34.6	0	0	0	113.1
239	D	19.7	Very low	22.2	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	77%	0.77	S	S	*	*			trans	174.8	153.6	136.2	-93.2	-25.4	0	0	0	111.7
240	D	22.2	Very low	22.2	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	77%	0.77	S	S	*	*			trans	72	97.6	147.7	-69.6	-18.6	0	0	0	122.2
241	S	20.3	Very low	22	Very low	80 Å²	80	139.6 Å²	139.6	56%	0.559	77%	0.765	S	S	*	*				46.4	116	120.1	57.9	0	0	0	0	120.3
242	L	19.8	Very low	22	Very low	145 Å²	145	146.7 Å²	146.7	76%	0.759	77%	0.771	S	S	*	*				-14.3	125.5	126.9	-87.1	145.7	0	0	0	113.5
243	P	21.6	Very low	21.8	Very low	128 Å²	128	146.6 Å²	146.6	83%	0.831	77%	0.766	S	S	*	*	S	Bend	trans	-87.1	79.5	141.8	33.3	-22.5	0	0	0	106.3
244	N	19.9	Very low	21.9	Very low	132 Å²	132	147.5 Å²	147.5	71%	0.706	77%	0.772	S	S	*	*	S	Bend		-61.5	122.7	85.1	-98.9	-14.6	0	0	0	111.7	K246	N244-K246 PolarHBondContact O-N 2.88Å
245	K	29.2	Very low	21.8	Very low	200 Å²	200	147.6 Å²	147.6	87%	0.87	77%	0.772	S	S	*	*	S	Bend	trans	-32.4	105.2	164.6	-73.5	171.9	172.3	174	0	110.1
246	K	23.1	Very low	21.7	Very low	190 Å²	190	146 Å²	146	83%	0.826	78%	0.776	S	S	*	*	S	Bend	trans	71.3	116.7	166.1	-53.5	-179.2	172.8	-173.8	0	117.5	N244	N244-K246 PolarHBondContact O-N 2.88Å
247	H	21	Very low	21.7	Very low	164 Å²	164	144.3 Å²	144.3	76%	0.759	78%	0.776	S	S	*	*			trans	60.2	137.5	140.7	-67.9	-50.9	0	0	0	125.4
248	S	24.7	Very low	21.6	Very low	129 Å²	129	147.8 Å²	147.8	90%	0.902	78%	0.78	S	S	*	*			trans	105.7	134.7	140.5	66.6	0	0	0	0	123.3
249	Q	17.9	Very low	20.6	Very low	198 Å²	198	148.4 Å²	148.4	93%	0.925	79%	0.787	S	S	*	*			trans	-86.5	155	-171.7	-67.3	165	-37.8	0	0	115.4
250	S	21.3	Very low	20.5	Very low	125 Å²	125	148 Å²	148	87%	0.874	79%	0.79	S	S	*	*			trans	-161.3	144.9	143.9	68.7	0	0	0	0	114.1
251	L	17.9	Very low	20.4	Very low	145 Å²	145	147 Å²	147	76%	0.759	79%	0.79	S	S	*	*			trans	-58.3	155.2	180	-109.9	72.4	0	0	0	116.3
252	Y	19.9	Very low	20.2	Very low	221 Å²	221	149.1 Å²	149.1	87%	0.867	80%	0.8	S	S	*	*			trans	167.2	106.8	135	-86.3	-67	0	0	0	108.3
253	H	18.4	Very low	20.2	Very low	138 Å²	138	149.6 Å²	149.6	64%	0.639	80%	0.802	S	S	*	*				52.6	121.5	90.9	-95.1	-64.2	0	0	0	117.4	D255	H253-D255 IonicContact CE1-OD2 2.76Å; H253-D255 IonicContact ND1-OD2 3.46Å; H253-D255 PolarHBondContact ND1-OD2 2.97Å
254	N	21.5	Very low	20.1	Very low	158 Å²	158	151.4 Å²	151.4	85%	0.845	80%	0.799	S	S	*	*			trans	159.6	90.5	141.2	-80.1	-14.1	0	0	0	106.7
255	D	18.6	Very low	20.1	Very low	128 Å²	128	152.7 Å²	152.7	68%	0.684	81%	0.806	S	S	*	*				52.7	135.6	66.4	-83.5	-37.5	0	0	0	116.8	H253	H253-D255 IonicContact CE1-OD2 2.76Å; H253-D255 IonicContact ND1-OD2 3.46Å; H253-D255 PolarHBondContact ND1-OD2 2.97Å
256	V	18.8	Very low	19.7	Very low	134 Å²	134	151 Å²	151	81%	0.812	81%	0.806	S	S	*	*			trans	89.5	120.7	165.1	-161.8	0	0	0	0	114.6
257	S	20.6	Very low	19.6	Very low	109 Å²	109	150.7 Å²	150.7	76%	0.762	81%	0.808	S	S	*	*			cis	-160.4	141.2	15.6	23.9	0	0	0	0	111.3
258	K	17.5	Very low	19.6	Very low	209 Å²	209	150.8 Å²	150.8	91%	0.909	81%	0.814	S	S	*	*			trans	-75.8	130.8	169.3	-69.9	172.2	174.6	176.3	0	110.9
259	S	18.5	Very low	19.5	Very low	112 Å²	112	151 Å²	151	78%	0.783	81%	0.81	S	S	*	*			trans	-151.8	102.3	146.9	60.9	0	0	0	0	109.5
260	T	17.3	Very low	19.7	Very low	134 Å²	134	149 Å²	149	82%	0.822	81%	0.806	S	S	*	*			trans	-81.2	122.4	165	-7.1	0	0	0	0	108.1
261	P	19.9	Very low	19.8	Very low	108 Å²	108	151.9 Å²	151.9	70%	0.701	81%	0.81	S	S	*	*			trans	-96.8	112.1	158.3	31	-20	0	0	0	108.7
262	T	17	Very low	20	Very low	125 Å²	125	154 Å²	154	77%	0.767	82%	0.816	S	S	*	*			trans	-70.2	118.3	157.9	-34.7	0	0	0	0	106.8
263	I	20.1	Very low	20	Very low	155 Å²	155	153.3 Å²	153.3	80%	0.795	82%	0.818	S	S	*	*			trans	-118.3	108.3	161.6	-64.4	178.8	0	0	0	105.8
264	E	18.9	Very low	20.3	Very low	166 Å²	166	154.9 Å²	154.9	78%	0.776	83%	0.829	S	S	*	*			trans	-67.4	146.2	166.4	-72.3	173.5	144	0	0	110.4
265	N	19.1	Very low	20.3	Very low	159 Å²	159	150.6 Å²	150.6	85%	0.85	82%	0.822	S	S	*	*			trans	-0.3	120.1	161.6	-59.1	-23.5	0	0	0	117.6
266	N	21.3	Very low	20.3	Very low	164 Å²	164	151.3 Å²	151.3	88%	0.877	83%	0.831	S	S	*	*			trans	-128.9	141.8	148.8	-93.6	-24.2	0	0	0	109.7
267	E	20.7	Very low	20.6	Very low	183 Å²	183	149.9 Å²	149.9	86%	0.855	83%	0.825	S	S	*	*			trans	-66.2	162.9	-158.2	-62.1	175	144.6	0	0	116.9	V269	E267-V269 PolarHBondContact O-N 2.88Å
268	D	20.9	Very low	20.6	Very low	167 Å²	167	150.6 Å²	150.6	89%	0.893	83%	0.826	S	S	*	*			trans	-35.6	118	166	-66.1	-55	0	0	0	114.8
269	V	23.7	Very low	21	Very low	134 Å²	134	150.7 Å²	150.7	81%	0.812	83%	0.827	S	S	*	*			trans	-140.3	108.1	155.7	-176.6	0	0	0	0	110.8	E267	E267-V269 PolarHBondContact O-N 2.88Å
270	N	22.6	Very low	21	Very low	156 Å²	156	156.1 Å²	156.1	83%	0.834	83%	0.831	S	S	*	*			trans	5	125.4	157.7	-68.1	-47.5	0	0	0	120.5	E272	N270-E272 PolarHBondContact O-N 2.99Å
271	L	22.3	Very low	21.5	Very low	185 Å²	185	155.5 Å²	155.5	97%	0.969	83%	0.832	S	S	*	*			trans	-68.5	115.5	158.9	-84.3	116.2	0	0	0	111.3
272	E	22.4	Very low	21.7	Very low	188 Å²	188	155.1 Å²	155.1	88%	0.879	83%	0.829	S	S	*	*			trans	-102.7	137.8	163.8	-116.2	-176.7	176.5	0	0	111.2	N270	N270-E272 PolarHBondContact O-N 2.99Å
273	K	20.3	Very low	21.8	Very low	208 Å²	208	157.9 Å²	157.9	90%	0.904	83%	0.833	S	S	*	*			trans	-72.2	132	-179.6	-73.9	171.5	172.2	176.2	0	112.1
274	I	25.1	Very low	21.9	Very low	171 Å²	171	160 Å²	160	88%	0.877	84%	0.837	S	S	*	*			trans	-142.1	125.9	158.5	-55.7	175.9	0	0	0	104.2
275	G	21.5	Very low	22.1	Very low	67 Å²	67	160 Å²	160	69%	0.691	84%	0.841	S	S	*	*			cis	126.8	98	31.3	0	0	0	0	0	106.4
276	T	18.5	Very low	22.5	Very low	143 Å²	143	157.3 Å²	157.3	88%	0.877	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-66.8	132.4	-179.1	14.6	0	0	0	0	112.1
277	P	23.4	Very low	22.4	Very low	105 Å²	105	154.8 Å²	154.8	68%	0.682	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-93.1	139.8	169.8	32.5	-27.6	0	0	0	112.1
278	P	21.7	Very low	22.4	Very low	123 Å²	123	153.2 Å²	153.2	80%	0.799	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-89.5	132.5	-172.6	34.1	-32.2	0	0	0	112.1
279	F	24.9	Very low	22.4	Very low	211 Å²	211	152.7 Å²	152.7	93%	0.925	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-102.9	120.1	173.6	-100.1	-86.2	0	0	0	113.1
280	R	19.1	Very low	22.3	Very low	227 Å²	227	153.1 Å²	153.1	86%	0.857	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-85	138.7	-172.9	-154.4	-180	-166.3	-176.7	3.5	110	P282	R280-P282 WeakPolarHBondContact O-CD 3.46Å
281	S	28.2	Very low	22.2	Very low	121 Å²	121	153.9 Å²	153.9	85%	0.846	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-74.4	136.7	163.1	-84.3	0	0	0	0	110.8
282	P	23.2	Very low	22	Very low	100 Å²	100	153.2 Å²	153.2	65%	0.649	83%	0.826	S	S	*	*			trans	-145.3	133.3	141	33.8	-15.7	0	0	0	115.1	R280	R280-P282 WeakPolarHBondContact O-CD 3.46Å
283	H	20	Very low	21.8	Very low	183 Å²	183	150.3 Å²	150.3	85%	0.847	82%	0.821	S	S	*	*				54.7	126.9	120.7	-61.4	-73.7	0	0	0	123.3
284	F	22.2	Very low	21.7	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.873	82%	0.818	S	S	*	*			trans	-27.9	146	152.7	-80.5	-98.8	0	0	0	118.1
285	L	23.1	Very low	21.6	Very low	167 Å²	167	146 Å²	146	87%	0.874	81%	0.814	S	S	*	*			trans	165.5	171.4	139.5	-88	158.4	0	0	0	109.9
286	P	26.7	Very low	21.6	Very low	102 Å²	102	150.8 Å²	150.8	66%	0.662	82%	0.823	S	S	*	*				-136.1	165.5	-65.6	36.8	-16.9	0	0	0	116.2
287	S	19	Very low	21.7	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	82%	0.818	S	S	*	*			trans	21.6	129.6	145.6	-35.9	0	0	0	0	124.4
288	T	22.3	Very low	21.7	Very low	149 Å²	149	152.1 Å²	152.1	91%	0.914	82%	0.823	S	S	*	*			trans	-147	136.3	137.5	41	0	0	0	0	112.6
289	N	19.7	Very low	21.7	Very low	156 Å²	156	152 Å²	152	83%	0.834	82%	0.823	S	S	*	*			trans	-78	155.2	179.5	-70.6	-33	0	0	0	113.1
290	T	22.7	Very low	21.5	Very low	144 Å²	144	149.4 Å²	149.4	88%	0.883	82%	0.818	S	S	*	*				-172.9	146.6	124.5	-53.7	0	0	0	0	111.4
291	M	19.4	Very low	21.7	Very low	172 Å²	172	146.2 Å²	146.2	85%	0.847	82%	0.817	S	S	*	*			trans	-46.2	149.2	-171.2	-59.2	176.1	157.4	0	0	121.6
292	M	17.6	Very low	21.4	Very low	171 Å²	171	145.2 Å²	145.2	84%	0.842	81%	0.81	S	S	*	*				152.9	131	125.1	-81	-91.1	-165	0	0	112.3
293	T	19.4	Very low	21.4	Very low	126 Å²	126	146.2 Å²	146.2	77%	0.773	82%	0.817	S	S	*	*			trans	64.3	113.4	163.4	46.5	0	0	0	0	121.3
294	D	18.5	Very low	21.4	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	82%	0.82	S	S	*	*			trans	25.4	99.5	142.6	-60.9	-24.9	0	0	0	120.8
295	V	21.9	Very low	21.3	Very low	131 Å²	131	150 Å²	150	79%	0.794	82%	0.824	S	S	*	*			trans	-179.6	108.1	143.5	174.8	0	0	0	0	104.2
296	L	21.9	Very low	21.2	Very low	168 Å²	168	147.6 Å²	147.6	88%	0.88	82%	0.818	S	S	*	*				65.9	64.6	54.4	-137.6	139	0	0	0	115.3
297	V	21.7	Very low	20.9	Very low	129 Å²	129	149.6 Å²	149.6	78%	0.782	83%	0.829	S	S	*	*			trans	-139.8	111	148.6	179.4	0	0	0	0	109.4
298	N	21.4	Very low	21	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	83%	0.825	S	S	*	*			trans	-57.4	133.9	165	-83.2	-29.8	0	0	0	111	L300	N298-L300 PolarHBondContact O-N 3.39Å
299	P	23.1	Very low	21	Very low	122 Å²	122	148 Å²	148	79%	0.792	82%	0.818	S	S	*	*			trans	-95.8	81.9	168.2	34.5	-26.6	0	0	0	109.6
300	L	20	Very low	21.1	Very low	156 Å²	156	146.6 Å²	146.6	82%	0.817	81%	0.814	S	S	*	*			trans	-156	142.6	169.2	-88.9	172.8	0	0	0	109	N298	N298-L300 PolarHBondContact O-N 3.39Å
301	L	23.3	Very low	21	Very low	160 Å²	160	148.9 Å²	148.9	84%	0.838	81%	0.812	S	S	*	*			trans	98	95.2	170.4	-64.7	148.6	0	0	0	117.6
302	S	21.3	Very low	21	Very low	100 Å²	100	148.9 Å²	148.9	70%	0.699	81%	0.812	S	S	*	*			trans	-28.5	143.2	133.1	48.2	0	0	0	0	115.7
303	C	23.2	Very low	21.2	Very low	120 Å²	120	145.9 Å²	145.9	81%	0.811	81%	0.805	S	S	*	*			trans	41.5	96.1	137.2	-60	0	0	0	0	118.9
304	K	21.1	Very low	21.4	Very low	208 Å²	208	147.8 Å²	147.8	90%	0.904	81%	0.81	S	S	*	*				-144.9	120.5	95.4	-86.4	-179.7	-176.1	179.6	0	106.7	P306	K304-P306 WeakPolarHBondContact O-CD 3.32Å
305	R	19.3	Very low	21.6	Very low	255 Å²	255	147.1 Å²	147.1	96%	0.962	81%	0.805	S	S	*	*			trans	-70.3	122.7	-178	-72.4	177.2	178.5	167.8	-0.8	110.2
306	P	21.6	Very low	21.6	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	80%	0.803	S	S	*	*			trans	-107.3	133.3	149.5	23.1	-3.4	0	0	0	109.4	K304 S308	K304-P306 WeakPolarHBondContact O-CD 3.32Å; P306-S308 PolarHBondContact O-N 3.29Å; P306-S308 VanDerWaalsContact O-N 3.15Å
307	V	20.5	Very low	21.7	Very low	145 Å²	145	146 Å²	146	88%	0.879	80%	0.795	S	S	*	*			trans	-55	110.5	170.6	177.1	0	0	0	0	109.2
308	S	22	Very low	21.8	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	79%	0.794	S	S	*	*			trans	-122	111.8	158.9	71.3	0	0	0	0	108.9	P306 V310	P306-S308 PolarHBondContact O-N 3.29Å; P306-S308 VanDerWaalsContact O-N 3.15Å; S308-V310 PolarHBondContact O-N 3.18Å
309	V	20.8	Very low	22	Very low	127 Å²	127	147.2 Å²	147.2	77%	0.77	80%	0.796	S	S	*	*			trans	-51.9	103.9	172.5	179.3	0	0	0	0	109.2	K311	V309-K311 PolarHBondContact O-N 2.98Å
310	V	21.6	Very low	21.9	Very low	125 Å²	125	146 Å²	146	76%	0.758	79%	0.79	S	S	*	*			trans	-74.6	106.5	167.5	177.5	0	0	0	0	106.8	S308 M312	S308-V310 PolarHBondContact O-N 3.18Å; V310-M312 PolarHBondContact O-N 3.1Å
311	K	20.4	Very low	22.1	Very low	192 Å²	192	146.6 Å²	146.6	84%	0.835	79%	0.794	S	S	*	*			trans	-52.8	107.6	161.5	-78.3	177.8	174.5	177.3	0	108.1	V309	V309-K311 PolarHBondContact O-N 2.98Å
312	M	20.4	Very low	22.1	Very low	173 Å²	173	144.8 Å²	144.8	85%	0.852	80%	0.795	S	S	*	*			trans	-78.3	119.5	168.2	-158.1	167.4	166.3	0	0	107.2	V310 L314	V310-M312 PolarHBondContact O-N 3.1Å; M312-L314 PolarHBondContact O-N 2.77Å
313	P	22	Very low	22.2	Very low	107 Å²	107	147.9 Å²	147.9	70%	0.695	80%	0.803	S	S	*	*			trans	-65.6	126.9	173.8	26	-29.3	0	0	0	108.2	I315	P313-I315 PolarHBondContact O-N 2.89Å
314	L	22.8	Very low	22.3	Very low	167 Å²	167	147.4 Å²	147.4	87%	0.874	80%	0.799	S	S	*	*			trans	-54.5	98.7	170.4	-73.7	154	0	0	0	108.9	M312 N316	M312-L314 PolarHBondContact O-N 2.77Å; L314-N316 VanDerWaalsContact C-N 3.28Å; L314-N316 PolarHBondContact O-N 2.92Å; L314-N316 VanDerWaalsContact O-N 3.07Å
315	I	22.9	Very low	22.3	Very low	142 Å²	142	146.1 Å²	146.1	73%	0.728	80%	0.801	S	S	*	*			trans	-74.3	96.4	158.6	-61.3	176.7	0	0	0	105.1	P313 L317	P313-I315 PolarHBondContact O-N 2.89Å; I315-L317 HydrophobicContact CG2-CD2 4.49Å; I315-L317 HydrophobicContact CG2-CG 4.34Å; I315-L317 PolarHBondContact O-N 3.42Å
316	N	22.6	Very low	22.5	Very low	140 Å²	140	140 Å²	140	75%	0.749	79%	0.792	S	S	*	*			trans	-53.9	100	164.5	-102.2	-23	0	0	0	108.6	L314 N318	L314-N316 VanDerWaalsContact C-N 3.28Å; L314-N316 PolarHBondContact O-N 2.92Å; L314-N316 VanDerWaalsContact O-N 3.07Å; N316-N318 VanDerWaalsContact C-N 3.35Å; N316-N318 PolarHBondContact O-N 2.86Å
317	L	23.8	Very low	22.5	Very low	136 Å²	136	145.4 Å²	145.4	71%	0.712	80%	0.797	S	S	*	*			trans	-87.3	81.1	163.5	-72.3	167.5	0	0	0	107.7	I315 L319	I315-L317 HydrophobicContact CG2-CD2 4.49Å; I315-L317 HydrophobicContact CG2-CG 4.34Å; I315-L317 PolarHBondContact O-N 3.42Å; L317-L319 PolarHBondContact O-N 3.36Å
318	N	23.4	Very low	22.4	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	80%	0.8	S	S	*	*			trans	-73.7	101.7	162.3	-104.4	-13.3	0	0	0	107.9	N316	N316-N318 VanDerWaalsContact C-N 3.35Å; N316-N318 PolarHBondContact O-N 2.86Å
319	L	25	Very low	22.2	Very low	157 Å²	157	153.3 Å²	153.3	82%	0.822	80%	0.803	S	S	*	*			trans	-103.3	74.5	176.3	-72.2	167.6	0	0	0	110.1	L317	L317-L319 PolarHBondContact O-N 3.36Å
320	S	22	Very low	22.1	Very low	96 Å²	96	152.4 Å²	152.4	67%	0.671	80%	0.801	S	S	*	*	S	Bend	trans	-153	111.4	156.3	46.1	0	0	0	0	110
321	N	24.4	Very low	22	Very low	170 Å²	170	153.6 Å²	153.6	91%	0.909	80%	0.803	S	S	*	*			trans	32.9	96.4	160.6	-61.8	-19.9	0	0	0	118.2
322	S	23.3	Very low	22	Very low	122 Å²	122	151.9 Å²	151.9	85%	0.853	80%	0.802	S	S	*	*			trans	-142.5	136	151.2	53.9	0	0	0	0	112.7
323	L	23.9	Very low	22	Very low	164 Å²	164	150.9 Å²	150.9	86%	0.859	80%	0.799	S	S	*	*			trans	-57.6	159	179.5	-88	102.7	0	0	0	113.6
324	P	24.9	Very low	21.8	Very low	111 Å²	111	150.2 Å²	150.2	72%	0.721	80%	0.798	S	S	*	*			trans	-77.8	132.5	-166.2	31.1	-33.4	0	0	0	112.6	T326	P324-T326 PolarHBondContact O-N 3.25Å
325	L	21.1	Very low	21.7	Very low	181 Å²	181	150 Å²	150	95%	0.948	80%	0.797	S	S	*	*			trans	-63.3	100.3	169.4	-82.1	153.5	0	0	0	110.3	R327	L325-R327 PolarHBondContact O-N 2.9Å
326	T	23.8	Very low	21.6	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	80%	0.803	S	S	*	*			trans	-79.1	109.2	164.5	26.6	0	0	0	0	109.8	P324 R328	P324-T326 PolarHBondContact O-N 3.25Å; T326-R328 PolarHBondContact O-N 2.66Å
327	R	19.9	Very low	21.5	Very low	227 Å²	227	152.9 Å²	152.9	86%	0.857	81%	0.807	S	S	*	*			trans	8.4	101.5	142.1	-141.7	179.9	-166.3	-171.2	3.4	115.2	L325	L325-R327 PolarHBondContact O-N 2.9Å
328	R	19	Very low	21.4	Very low	249 Å²	249	150.9 Å²	150.9	94%	0.94	81%	0.805	S	S	*	*			trans	-117.9	119.5	148.5	-84.4	-169.3	176.2	-179.1	0.3	109.3	T326	T326-R328 PolarHBondContact O-N 2.66Å
329	Q	18	Very low	21.5	Very low	162 Å²	162	151.2 Å²	151.2	76%	0.757	81%	0.807	S	S	*	*			trans	-74.9	153.1	172.9	-91.9	176.9	-28.8	0	0	111.5
330	C	18.2	Very low	21.4	Very low	109 Å²	109	147.7 Å²	147.7	74%	0.736	80%	0.8	S	S	*	*			trans	88.2	121	150.3	-68.8	0	0	0	0	120.7
331	N	20.5	Very low	21.5	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	81%	0.807	S	S	*	*			trans	86.9	100.9	138.2	-71.3	-5.6	0	0	0	120.1	N333	N331-N333 PolarHBondContact O-N 3.49Å
332	I	19.6	Very low	21.6	Very low	157 Å²	157	152.2 Å²	152.2	81%	0.805	81%	0.807	S	S	*	*			trans	-21.2	112.2	131.7	-57	164.4	0	0	0	111.1
333	N	20.2	Very low	21.5	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	81%	0.808	S	S	*	*			trans	-152.8	120.9	133	-111.6	-9.1	0	0	0	110.1	N331	N331-N333 PolarHBondContact O-N 3.49Å
334	S	19.2	Very low	21.5	Very low	94 Å²	94	150.8 Å²	150.8	66%	0.657	80%	0.802	S	S	*	*			trans	-53.9	128.9	160.3	47.2	0	0	0	0	110.4
335	N	20.9	Very low	21.4	Very low	161 Å²	161	154.7 Å²	154.7	86%	0.861	81%	0.808	S	S	*	*			trans	-160.2	114.1	136.5	-94	-24	0	0	0	109.8
336	L	20.6	Very low	21.5	Very low	162 Å²	162	151.2 Å²	151.2	85%	0.848	80%	0.796	S	S	*	*			trans	-50.9	134.2	147	-76.8	120.3	0	0	0	109.2
337	Q	20.5	Very low	21.6	Very low	181 Å²	181	151 Å²	151	85%	0.846	80%	0.799	S	S	*	*				174.6	136.4	120.1	-99.7	167.6	-17.7	0	0	111.8
338	S	21.6	Very low	21.8	Very low	95 Å²	95	148.3 Å²	148.3	66%	0.664	80%	0.797	S	S	*	*			trans	57.6	107.4	144.9	61.6	0	0	0	0	119.5
339	D	25.5	Very low	22	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	79%	0.786	S	S	*	*				174.3	108.3	104.6	-87.1	-22.8	0	0	0	107.4
340	A	21.8	Very low	22.2	Very low	82 Å²	82	142.6 Å²	142.6	68%	0.678	79%	0.792	S	S	*	*				70.3	128.3	82.5	0	0	0	0	0	112.7
341	D	24.4	Very low	22.4	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	79%	0.794	S	S	*	*			trans	79.7	80.2	168.2	-59.1	-22	0	0	0	119.4
342	K	27.5	Very low	22.7	Very low	209 Å²	209	147.4 Å²	147.4	91%	0.909	79%	0.793	S	S	*	*				-176.2	97.4	123.4	-96.5	162.2	-171	-177.7	0	111.2
343	T	21.2	Very low	22.8	Very low	141 Å²	141	145.4 Å²	145.4	87%	0.865	79%	0.789	S	S	*	*			trans	-92.5	127.2	153.3	39.7	0	0	0	0	108.2
344	P	23.5	Very low	22.9	Very low	114 Å²	114	146.4 Å²	146.4	74%	0.74	79%	0.786	S	S	*	*				-137.2	157.5	84.5	38	-25	0	0	0	111.1
345	K	21.8	Very low	23.1	Very low	193 Å²	193	149.3 Å²	149.3	84%	0.839	79%	0.793	S	S	*	*			cis	-163	163.3	-1.4	-112.6	178.4	-178.5	179.9	0	103.9	S347	K345-S347 PolarHBondContact O-N 3.5Å
346	P	24.8	Very low	23.3	Very low	108 Å²	108	145 Å²	145	70%	0.701	78%	0.775	S	S	*	*			trans	-70.2	129.7	-159.3	31.1	-33.1	0	0	0	111.4	E348	P346-E348 VanDerWaalsContact C-N 3.29Å; P346-E348 PolarHBondContact O-N 2.95Å
347	S	25	Very low	23.5	Very low	122 Å²	122	144.2 Å²	144.2	85%	0.853	77%	0.771	S	S	*	*			trans	-68.5	100.5	152.9	36.4	0	0	0	0	106.4	K345 S349	K345-S347 PolarHBondContact O-N 3.5Å; S347-S349 PolarHBondContact O-N 3.24Å
348	E	23.4	Very low	23.8	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	76%	0.764	S	S	*	*			trans	-46.5	128	167	-72.3	177.8	155.2	0	0	108.5	P346 E350	P346-E348 VanDerWaalsContact C-N 3.29Å; P346-E348 PolarHBondContact O-N 2.95Å; E348-E350 VanDerWaalsContact C-N 3.27Å; E348-E350 PolarHBondContact O-N 3.31Å
349	S	23.3	Very low	23.9	Very low	103 Å²	103	144.9 Å²	144.9	72%	0.72	77%	0.772	S	S	*	*			trans	-54.3	96.2	162	50.9	0	0	0	0	108.3	S347 R351	S347-S349 PolarHBondContact O-N 3.24Å; S349-R351 PolarHBondContact O-N 3.1Å
350	E	23.7	Very low	24	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	77%	0.766	S	S	*	*			trans	-64.6	84.1	153	-88.3	-173.6	161.6	0	0	106.4	E348 I352	E348-E350 VanDerWaalsContact C-N 3.27Å; E348-E350 PolarHBondContact O-N 3.31Å; E350-I352 PolarHBondContact O-N 2.99Å
351	R	22.6	Very low	24.1	Very low	207 Å²	207	144.7 Å²	144.7	78%	0.781	77%	0.77	S	S	*	*			trans	-45.1	113.9	147.3	-77.4	-178.2	177.1	-158.2	-0.9	106	S349 T353	S349-R351 PolarHBondContact O-N 3.1Å; R351-T353 PolarHBondContact O-N 3.36Å; R351-T353 PolarHBondContact O-OG1 2.89Å
352	I	25.1	Very low	24.1	Very low	152 Å²	152	144.9 Å²	144.9	78%	0.779	77%	0.77	S	S	*	*			trans	-39.9	94.6	159.1	-61.1	160.6	0	0	0	107	E350 F354	E350-I352 PolarHBondContact O-N 2.99Å; I352-F354 HydrophobicContact CG2-CD2 4.46Å; I352-F354 HydrophobicContact CG2-CE2 4.38Å
353	T	22.6	Very low	23.9	Very low	116 Å²	116	146.5 Å²	146.5	71%	0.712	77%	0.77	S	S	*	*			trans	-95.9	104.2	179.2	-45.4	0	0	0	0	104.9	R351 I355	R351-T353 PolarHBondContact O-N 3.36Å; R351-T353 PolarHBondContact O-OG1 2.89Å; T353-I355 PolarHBondContact O-N 2.9Å
354	F	22	Very low	24	Very low	171 Å²	171	148.3 Å²	148.3	75%	0.75	77%	0.769	S	S	*	*			trans	-50.3	97.2	169.8	-82.8	-104.1	0	0	0	109.7	I352 S356	I352-F354 HydrophobicContact CG2-CD2 4.46Å; I352-F354 HydrophobicContact CG2-CE2 4.38Å; F354-S356 PolarHBondContact O-N 3.49Å
355	I	24	Very low	24	Very low	155 Å²	155	147.3 Å²	147.3	80%	0.795	77%	0.77	S	S	*	*			trans	-77.7	88.2	163.4	-66.6	179.6	0	0	0	107	T353	T353-I355 PolarHBondContact O-N 2.9Å
356	S	23.8	Very low	24.1	Very low	71 Å²	71	145.7 Å²	145.7	50%	0.497	77%	0.771	S	S	.	*			trans	56.8	84	138.7	61	0	0	0	0	118.4	F354 I358	F354-S356 PolarHBondContact O-N 3.49Å; S356-I358 PolarHBondContact O-N 3.4Å
357	L	26.2	Very low	24	Very low	145 Å²	145	148.2 Å²	148.2	76%	0.759	78%	0.777	S	S	*	*			trans	-47.9	37.9	138.5	-90.1	146	0	0	0	115.3
358	I	26	Very low	24	Very low	137 Å²	137	145.6 Å²	145.6	70%	0.703	77%	0.769	S	S	*	*			trans	-90.1	-13.9	-172.8	-69.5	176.8	0	0	0	114.6	S356	S356-I358 PolarHBondContact O-N 3.4Å
359	N	24.4	Very low	24	Very low	154 Å²	154	144 Å²	144	82%	0.824	77%	0.766	S	S	*	*	S	Bend	trans	-112.7	20.4	-171	-75.5	-12	0	0	0	117.3
360	T	27.9	Very low	24	Very low	113 Å²	113	146.1 Å²	146.1	69%	0.693	77%	0.77	S	S	*	*			trans	-125.4	112.3	172.6	40.5	0	0	0	0	111.9
361	P	23.6	Very low	24	Very low	116 Å²	116	143.8 Å²	143.8	75%	0.753	77%	0.768	S	S	*	*			trans	-76.9	128.9	178.9	29.1	-29.8	0	0	0	111.6
362	L	23.6	Very low	24	Very low	156 Å²	156	139.7 Å²	139.7	82%	0.817	77%	0.771	S	S	*	*			trans	64.5	79	142.9	-73	151.6	0	0	0	118.7
363	R	23.7	Very low	24	Very low	243 Å²	243	138.1 Å²	138.1	92%	0.917	77%	0.769	S	S	*	*				-143.7	104.3	125.8	-69.1	-168.1	176.6	-158.5	-1.2	105.2
364	Q	24.2	Very low	23.8	Very low	179 Å²	179	140.5 Å²	140.5	84%	0.836	78%	0.777	S	S	*	*				-164.3	113.8	79.4	-82	161.5	-6.9	0	0	107.8	N366	Q364-N366 PolarHBondContact O-N 3.43Å; Q364-N366 VanDerWaalsContact O-N 3.1Å
365	A	22.2	Very low	24	Very low	93 Å²	93	140 Å²	140	77%	0.769	78%	0.781	S	S	*	*			trans	-71.2	96.8	161.8	0	0	0	0	0	107.3
366	N	24	Very low	23.9	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	78%	0.779	S	S	*	*			trans	-97	107.9	155.8	-111.6	-4.8	0	0	0	107.2	Q364	Q364-N366 PolarHBondContact O-N 3.43Å; Q364-N366 VanDerWaalsContact O-N 3.1Å
367	I	22.4	Very low	23.9	Very low	160 Å²	160	140.5 Å²	140.5	82%	0.821	79%	0.794	S	S	*	*			trans	-57.3	129.6	172.2	-65	162.1	0	0	0	107.9
368	G	25.1	Very low	23.8	Very low	68 Å²	68	140.3 Å²	140.3	70%	0.701	80%	0.798	S	S	*	*			trans	-167.2	75.3	179	0	0	0	0	0	110.7
369	D	24.4	Very low	23.6	Very low	137 Å²	137	142.9 Å²	142.9	73%	0.733	80%	0.804	S	S	*	*			trans	37.2	119.4	152.8	-59.9	-21.1	0	0	0	121.2
370	N	22.5	Very low	23.6	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	81%	0.806	S	S	*	*			trans	65.2	84.2	147	-60.9	-21.4	0	0	0	117.6
371	T	24.8	Very low	23.4	Very low	139 Å²	139	145.6 Å²	145.6	85%	0.853	81%	0.809	S	S	*	*				-169.3	124.2	113.4	25.6	0	0	0	0	110.1	V373	T371-V373 PolarHBondContact O-N 2.79Å
372	S	22.6	Very low	23.4	Very low	120 Å²	120	145.8 Å²	145.8	84%	0.839	81%	0.808	S	S	*	*			trans	-61.5	114.9	176	51.4	0	0	0	0	111.8
373	V	23.2	Very low	23.4	Very low	120 Å²	120	148.6 Å²	148.6	73%	0.727	81%	0.808	S	S	*	*			trans	-130.5	103.5	153.4	-176.8	0	0	0	0	108.3	T371 L375	T371-V373 PolarHBondContact O-N 2.79Å; V373-L375 HydrophobicContact CG1-CD1 4.46Å; V373-L375 HydrophobicContact CG1-CG 4.46Å; V373-L375 PolarHBondContact O-N 3.34Å
374	N	20.4	Very low	23.5	Very low	166 Å²	166	142.3 Å²	142.3	89%	0.888	80%	0.799	S	S	*	*			trans	-60.9	117.9	163	-86.5	-26.7	0	0	0	109
375	L	24.5	Very low	23.7	Very low	159 Å²	159	142.5 Å²	142.5	83%	0.832	80%	0.797	S	S	*	*			trans	-125.2	116.2	157.8	-89.5	162.4	0	0	0	109.2	V373	V373-L375 HydrophobicContact CG1-CD1 4.46Å; V373-L375 HydrophobicContact CG1-CG 4.46Å; V373-L375 PolarHBondContact O-N 3.34Å
376	T	22.5	Very low	23.8	Very low	124 Å²	124	142.7 Å²	142.7	76%	0.761	79%	0.788	S	S	*	*			trans	-54.5	138.8	-175.3	37.3	0	0	0	0	114.5	V378	T376-V378 PolarHBondContact O-N 2.95Å
377	S	23.6	Very low	24.1	Very low	114 Å²	114	143 Å²	143	80%	0.797	78%	0.783	S	S	*	*			trans	-39.9	113.5	172	51.3	0	0	0	0	115.3	K379	S377-K379 PolarHBondContact O-N 3.35Å
378	V	24.1	Very low	24.3	Very low	141 Å²	141	146 Å²	146	86%	0.855	78%	0.783	S	S	*	*			trans	-76.8	113.5	161.3	178.9	0	0	0	0	108	T376 K380	T376-V378 PolarHBondContact O-N 2.95Å; V378-K380 PolarHBondContact O-N 3.31Å
379	K	21.8	Very low	24.4	Very low	190 Å²	190	147.2 Å²	147.2	83%	0.826	77%	0.774	S	S	*	*			trans	-54.3	120.6	174.5	-81.1	178.3	172.3	178.2	0	110.2	S377 V381	S377-K379 PolarHBondContact O-N 3.35Å; K379-V381 PolarHBondContact O-N 2.81Å; K379-V381 VanDerWaalsContact O-N 3.12Å
380	K	25	Very low	24.8	Very low	197 Å²	197	144.1 Å²	144.1	86%	0.857	76%	0.76	S	S	*	*			trans	-55.1	110.3	168.4	-100.7	179.4	173.2	177.1	0	109.6	V378 V382	V378-K380 PolarHBondContact O-N 3.31Å; K380-V382 HydrophobicContact CB-CG2 4.42Å; K380-V382 PolarHBondContact O-N 3.34Å
381	V	22.1	Very low	25.1	Very low	127 Å²	127	142.3 Å²	142.3	77%	0.77	75%	0.75	S	S	*	*			trans	-81.7	96.6	159.8	179.4	0	0	0	0	106.4	K379 R383	K379-V381 PolarHBondContact O-N 2.81Å; K379-V381 VanDerWaalsContact O-N 3.12Å; V381-R383 PolarHBondContact O-N 3.48Å; V381-R383 VanDerWaalsContact O-N 3.1Å
382	V	23.8	Very low	25.3	Very low	121 Å²	121	142 Å²	142	73%	0.733	74%	0.739	S	S	*	*			trans	-74	94.8	169.4	-179.1	0	0	0	0	106.9	K380	K380-V382 HydrophobicContact CB-CG2 4.42Å; K380-V382 PolarHBondContact O-N 3.34Å
383	R	23.4	Very low	26.1	Very low	215 Å²	215	143.5 Å²	143.5	81%	0.811	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76.7	131.1	160.6	-94.5	-173.8	179.2	140.7	-0.1	108	V381 K385	V381-R383 PolarHBondContact O-N 3.48Å; V381-R383 VanDerWaalsContact O-N 3.1Å; R383-K385 PolarHBondContact O-N 3.39Å
384	P	26.8	Very low	27.1	Very low	111 Å²	111	141.9 Å²	141.9	72%	0.721	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.3	170.6	-6.6	20.6	0	0	0	107.8	T386	P384-T386 PolarHBondContact O-N 3.19Å; P384-T386 VanDerWaalsContact O-N 3.16Å
385	K	27.9	Very low	28.2	Very low	182 Å²	182	136 Å²	136	79%	0.791	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-61.4	116.1	172.5	-70.7	177.1	177.3	177.5	0	107.6	R383	R383-K385 PolarHBondContact O-N 3.39Å
386	T	24.1	Very low	29.1	Very low	97 Å²	97	135.1 Å²	135.1	60%	0.595	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-75	143.6	172.5	46	0	0	0	0	108.7	P384 R388 D389	P384-T386 PolarHBondContact O-N 3.19Å; P384-T386 VanDerWaalsContact O-N 3.16Å; T386-R388 PolarHBondContact O-N 2.79Å; T386-D389 PolarHBondContact O-N 3.34Å
387	F	30.6	Very low	30.1	Very low	168 Å²	168	137.5 Å²	137.5	74%	0.737	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-6.8	-171.6	-134	-89.1	0	0	0	115.4	D389	F387-D389 VanDerWaalsContact C-N 3.32Å
388	R	26.8	Very low	30.9	Very low	221 Å²	221	134.1 Å²	134.1	83%	0.834	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-28.5	171	-85.3	-169.7	-179.3	-166.1	0.3	112.8	T386 V390	T386-R388 PolarHBondContact O-N 2.79Å; R388-V390 VanDerWaalsContact C-N 3.33Å; R388-V390 PolarHBondContact O-N 2.85Å
389	D	27.7	Very low	31.7	Very low	95 Å²	95	130.8 Å²	130.8	51%	0.508	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-16.1	-172.1	-66.7	-18.8	0	0	0	114.1	T386 F387	T386-D389 PolarHBondContact O-N 3.34Å; F387-D389 VanDerWaalsContact C-N 3.32Å
390	V	32.8	Very low	32.9	Very low	71 Å²	71	126.2 Å²	126.2	43%	0.43	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.2	-24.7	-176.3	-170	0	0	0	0	112.5	R388 R397	R388-V390 VanDerWaalsContact C-N 3.33Å; R388-V390 PolarHBondContact O-N 2.85Å; V390-R397 PolarHBondContact O-NH1 3.22Å
391	N	29.3	Very low	33.4	Very low	111 Å²	111	119.6 Å²	119.6	59%	0.594	59%	0.589	S	S	*	*			trans	-102.2	2.6	-168.1	-71.3	-13	0	0	0	114.8	Y393	N391-Y393 PolarHBondContact O-N 3.38Å
392	E	28.6	Very low	34.3	Very low	132 Å²	132	114.6 Å²	114.6	62%	0.617	56%	0.558	S	S	*	*	S	Bend	trans	-64.2	126.6	169.2	-130.9	174.5	-160.4	0	0	108.7	K394	E392-K394 PolarHBondContact O-N 3.26Å
393	Y	38.8	Very low	35.3	Very low	151 Å²	151	114.2 Å²	114.2	59%	0.592	54%	0.544	S	S	*	.			trans	-57.9	102	170.8	176.1	-97.3	0	0	0	108.3	N391 P395 H406	N391-Y393 PolarHBondContact O-N 3.38Å; Y393-P395 HydrophobicContact CE1-CB 4.29Å; Y393-P395 WeakPolarHBondContact O-CD 3.44Å; Y393-H406 AromaticContact CE1-CE1 3.64Å; Y393-H406 AromaticContact CE1-NE2 3.99Å; Y393-H406 AromaticContact CZ-CE1 3.78Å; Y393-H406 PolarHBondContact OH-CE1 3Å; Y393-H406 PolarHBondContact OH-ND1 3.34Å; Y393-H406 VanDerWaalsContact OH-ND1 3.09Å
394	K	44.7	Very low	36.5	Very low	86 Å²	86	113.8 Å²	113.8	37%	0.374	54%	0.542	S	S	.	.			trans	-102.7	105.4	177	-70.5	-169.3	-178.1	-173.2	0	108.8	E392 E396 R397	E392-K394 PolarHBondContact O-N 3.26Å; K394-E396 PolarHBondContact O-N 2.87Å; K394-R397 HydrophobicContact CB-CG 4.48Å; K394-R397 PolarHBondContact O-N 3.42Å
395	P	44	Very low	37.3	Very low	43 Å²	43	112 Å²	112	28%	0.279	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-60.4	-13.4	177.6	22.1	-31.5	0	0	0	113.2	Y393 R397 L398	Y393-P395 HydrophobicContact CE1-CB 4.29Å; Y393-P395 WeakPolarHBondContact O-CD 3.44Å; P395-R397 PolarHBondContact O-N 3.48Å; P395-L398 HydrophobicContact CB-CD1 4.09Å; P395-L398 WeakPolarHBondContact O-CB 3.41Å; P395-L398 PolarHBondContact O-N 3.23Å
396	E	42.5	Very low	38.5	Very low	140 Å²	140	105.6 Å²	105.6	65%	0.654	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-62.4	-25	170.9	-60.3	178	169.5	0	0	114.1	K394	K394-E396 PolarHBondContact O-N 2.87Å
397	R	43.1	Very low	39.9	Very low	174 Å²	174	104 Å²	104	66%	0.657	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-82.8	-9.8	178.9	-68.2	-178.2	172.4	165	-2	113.7	V390 K394 P395	V390-R397 PolarHBondContact O-NH1 3.22Å; K394-R397 HydrophobicContact CB-CG 4.48Å; K394-R397 PolarHBondContact O-N 3.42Å; P395-R397 PolarHBondContact O-N 3.48Å
398	L	41.7	Very low	40.8	Very low	44 Å²	44	100.9 Å²	100.9	23%	0.23	47%	0.474	C	S	.	.	S	Bend	trans	-70.4	144.6	178.5	-62.8	170	0	0	0	110.7	P395 T402 R403 H406	P395-L398 HydrophobicContact CB-CD1 4.09Å; P395-L398 WeakPolarHBondContact O-CB 3.41Å; P395-L398 PolarHBondContact O-N 3.23Å; L398-T402 HydrophobicContact CB-CG2 4.23Å; L398-T402 HydrophobicContact CD1-CG2 4.49Å; L398-T402 HydrophobicContact CD2-CG2 4.04Å; L398-T402 HydrophobicContact CG-CG2 4.49Å; L398-R403 HydrophobicContact CB-CB 4.06Å; L398-H406 HydrophobicContact CD1-CB 3.69Å
399	L	40.7	Very low	41.5	Very low	71 Å²	71	94 Å²	94	37%	0.372	45%	0.453	S	S	.	.			trans	-48	145.8	169.5	-64.8	169	0	0	0	110.3	S401 T402 R403	L399-S401 VanDerWaalsContact C-N 3.28Å; L399-S401 PolarHBondContact O-N 3.3Å; L399-S401 VanDerWaalsContact O-N 3.16Å; L399-T402 CarbonylContact O-C 3.45Å; L399-T402 WeakPolarHBondContact O-CA 3.3Å; L399-T402 WeakPolarHBondContact O-CB 3.44Å; L399-T402 PolarHBondContact O-N 3.3Å; L399-R403 WeakPolarHBondContact O-CB 3.46Å; L399-R403 PolarHBondContact O-N 3Å
400	S	46.1	Very low	42.6	Very low	93 Å²	93	93.5 Å²	93.5	65%	0.65	45%	0.448	S	S	*	.	H	α-helix	trans	-56.1	-38.7	-172.8	64.3	0	0	0	0	114	R404	S400-R404 WeakPolarHBondContact O-CB 3.47Å; S400-R404 PolarHBondContact O-N 2.97Å
401	S	37	Very low	43.4	Very low	59 Å²	59	94.8 Å²	94.8	41%	0.413	45%	0.452	S	S	.	.	H	α-helix	trans	-66.1	-44.2	173.1	52.7	0	0	0	0	112	L399 R404 L405	L399-S401 VanDerWaalsContact C-N 3.28Å; L399-S401 PolarHBondContact O-N 3.3Å; L399-S401 VanDerWaalsContact O-N 3.16Å; S401-R404 PolarHBondContact O-N 3.43Å; S401-L405 PolarHBondContact O-N 2.89Å
402	T	40	Very low	43.9	Very low	21 Å²	21	94.1 Å²	94.1	13%	0.129	45%	0.446	C	S	.	.	H	α-helix	trans	-69.1	-36.2	177.2	-54.6	0	0	0	0	111.9	L398 L399 L405 H406 R498	L398-T402 HydrophobicContact CB-CG2 4.23Å; L398-T402 HydrophobicContact CD1-CG2 4.49Å; L398-T402 HydrophobicContact CD2-CG2 4.04Å; L398-T402 HydrophobicContact CG-CG2 4.49Å; L399-T402 CarbonylContact O-C 3.45Å; L399-T402 WeakPolarHBondContact O-CA 3.3Å; L399-T402 WeakPolarHBondContact O-CB 3.44Å; L399-T402 PolarHBondContact O-N 3.3Å; T402-L405 PolarHBondContact O-N 3.42Å; T402-H406 WeakPolarHBondContact O-CB 3.39Å; T402-H406 PolarHBondContact O-N 2.96Å; T402-R498 PolarHBondContact OG1-NH2 3.47Å
403	R	45.9	Very low	44.3	Very low	113 Å²	113	91.3 Å²	91.3	43%	0.426	43%	0.434	S	S	.	.	H	α-helix	trans	-68	-41.4	173.8	-175.2	178.2	173.3	-170.7	-0.6	111	L398 L399 H406 N407	L398-R403 HydrophobicContact CB-CB 4.06Å; L399-R403 WeakPolarHBondContact O-CB 3.46Å; L399-R403 PolarHBondContact O-N 3Å; R403-H406 PolarHBondContact O-N 3.41Å; R403-N407 VanDerWaalsContact O-CB 3.23Å; R403-N407 WeakPolarHBondContact O-CB 2.99Å; R403-N407 PolarHBondContact O-N 2.91Å; R403-N407 PolarHBondContact O-OD1 3.14Å
404	R	47.7	Very low	44.3	Very low	207 Å²	207	87.3 Å²	87.3	78%	0.781	43%	0.425	S	S	*	.	H	α-helix	trans	-60.2	-45.1	172	-94.3	-178.7	159.2	-178.4	-4.8	111.4	S400 S401 H408	S400-R404 WeakPolarHBondContact O-CB 3.47Å; S400-R404 PolarHBondContact O-N 2.97Å; S401-R404 PolarHBondContact O-N 3.43Å; R404-H408 VanDerWaalsContact O-CB 3.25Å; R404-H408 WeakPolarHBondContact O-CB 3.39Å; R404-H408 PolarHBondContact O-N 3.05Å
405	L	44.2	Very low	44.1	Very low	73 Å²	73	90.9 Å²	90.9	38%	0.382	44%	0.444	S	S	.	.	H	α-helix	trans	-67.6	-45.5	176.7	-176	66.7	0	0	0	111.9	S401 T402 N407 H408 L409	S401-L405 PolarHBondContact O-N 2.89Å; T402-L405 PolarHBondContact O-N 3.42Å; L405-N407 VanDerWaalsContact C-N 3.35Å; L405-N407 PolarHBondContact O-N 3.31Å; L405-H408 CarbonylContact O-C 3.6Å; L405-H408 PolarHBondContact O-N 2.87Å; L405-H408 VanDerWaalsContact O-N 3.16Å; L405-L409 HydrophobicContact CD1-CD1 4.25Å; L405-L409 HydrophobicContact CD1-CG 4.26Å; L405-L409 HydrophobicContact CD2-CD1 4.43Å; L405-L409 HydrophobicContact CG-CD1 3.88Å; L405-L409 HydrophobicContact CG-CG 4.31Å; L405-L409 WeakPolarHBondContact O-CB 3.38Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.22Å; L405-L409 PolarHBondContact O-N 2.84Å
406	H	52.2	Low	43.8	Very low	48 Å²	48	92 Å²	92	22%	0.222	45%	0.453	C	S	.	.	H	α-helix	trans	-57.8	-46.8	175.2	176.3	82.3	0	0	0	110.8	Y393 L398 T402 R403 H408 L409 H410	Y393-H406 AromaticContact CE1-CE1 3.64Å; Y393-H406 AromaticContact CE1-NE2 3.99Å; Y393-H406 AromaticContact CZ-CE1 3.78Å; Y393-H406 PolarHBondContact OH-CE1 3Å; Y393-H406 PolarHBondContact OH-ND1 3.34Å; Y393-H406 VanDerWaalsContact OH-ND1 3.09Å; L398-H406 HydrophobicContact CD1-CB 3.69Å; T402-H406 WeakPolarHBondContact O-CB 3.39Å; T402-H406 PolarHBondContact O-N 2.96Å; R403-H406 PolarHBondContact O-N 3.41Å; H406-H408 PolarHBondContact O-N 3.35Å; H406-L409 PolarHBondContact O-N 2.92Å; H406-H410 WeakPolarHBondContact O-CB 3.49Å; H406-H410 PolarHBondContact O-N 3.36Å
407	N	54.1	Low	43.5	Very low	62 Å²	62	93.4 Å²	93.4	33%	0.332	46%	0.459	S	S	.	.	H	α-helix	trans	-65.3	-38.7	175.4	-71	-5.7	0	0	0	111.9	R403 L405 N411	R403-N407 VanDerWaalsContact O-CB 3.23Å; R403-N407 WeakPolarHBondContact O-CB 2.99Å; R403-N407 PolarHBondContact O-N 2.91Å; R403-N407 PolarHBondContact O-OD1 3.14Å; L405-N407 VanDerWaalsContact C-N 3.35Å; L405-N407 PolarHBondContact O-N 3.31Å; N407-N411 WeakPolarHBondContact O-CB 3.23Å; N407-N411 PolarHBondContact O-N 2.93Å; N407-N411 PolarHBondContact O-ND2 3.44Å; N407-N411 PolarHBondContact O-OD1 3.16Å
408	H	48.6	Very low	43	Very low	103 Å²	103	89 Å²	89	48%	0.477	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-43	176.2	-174.2	66.7	0	0	0	111.7	R404 L405 H406 Q412	R404-H408 VanDerWaalsContact O-CB 3.25Å; R404-H408 WeakPolarHBondContact O-CB 3.39Å; R404-H408 PolarHBondContact O-N 3.05Å; L405-H408 CarbonylContact O-C 3.6Å; L405-H408 PolarHBondContact O-N 2.87Å; L405-H408 VanDerWaalsContact O-N 3.16Å; H406-H408 PolarHBondContact O-N 3.35Å; H408-Q412 PolarHBondContact NE2-NE2 3.41Å; H408-Q412 WeakPolarHBondContact O-CB 3.13Å; H408-Q412 WeakPolarHBondContact O-CG 3.5Å; H408-Q412 PolarHBondContact O-N 3.45Å
409	L	42.7	Very low	42.4	Very low	77 Å²	77	92 Å²	92	40%	0.403	46%	0.461	S	S	.	.	H	α-helix	trans	-69.2	-42.3	176.2	-71.9	171.1	0	0	0	111.8	L405 H406 Q412 L413	L405-L409 HydrophobicContact CD1-CD1 4.25Å; L405-L409 HydrophobicContact CD1-CG 4.26Å; L405-L409 HydrophobicContact CD2-CD1 4.43Å; L405-L409 HydrophobicContact CG-CD1 3.88Å; L405-L409 HydrophobicContact CG-CG 4.31Å; L405-L409 WeakPolarHBondContact O-CB 3.38Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.22Å; L405-L409 PolarHBondContact O-N 2.84Å; H406-L409 PolarHBondContact O-N 2.92Å; L409-Q412 CarbonylContact O-C 3.6Å; L409-Q412 PolarHBondContact O-N 3.4Å; L409-L413 VanDerWaalsContact O-CB 3.29Å; L409-L413 WeakPolarHBondContact O-CB 3.39Å; L409-L413 WeakPolarHBondContact O-CD1 3.34Å; L409-L413 VanDerWaalsContact O-CG 3.27Å; L409-L413 WeakPolarHBondContact O-CG 3.26Å; L409-L413 PolarHBondContact O-N 2.9Å
410	H	49.7	Very low	42	Very low	85 Å²	85	91.8 Å²	91.8	39%	0.394	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-45	175.2	-174.3	58.2	0	0	0	110.4	H406 Q412 L413 V414	H406-H410 WeakPolarHBondContact O-CB 3.49Å; H406-H410 PolarHBondContact O-N 3.36Å; H410-Q412 PolarHBondContact O-N 3.25Å; H410-L413 PolarHBondContact O-N 3.36Å; H410-V414 WeakPolarHBondContact O-CB 3.16Å; H410-V414 VanDerWaalsContact O-CG2 3.24Å; H410-V414 WeakPolarHBondContact O-CG2 3.45Å; H410-V414 PolarHBondContact O-N 2.91Å
411	N	50.1	Low	41.2	Very low	97 Å²	97	90.8 Å²	90.8	52%	0.519	46%	0.459	S	S	.	.	H	α-helix	trans	-62.7	-41.3	173.2	-69.6	-9.8	0	0	0	112	N407 V414 E415	N407-N411 WeakPolarHBondContact O-CB 3.23Å; N407-N411 PolarHBondContact O-N 2.93Å; N407-N411 PolarHBondContact O-ND2 3.44Å; N407-N411 PolarHBondContact O-OD1 3.16Å; N411-V414 PolarHBondContact O-N 2.96Å; N411-E415 WeakPolarHBondContact O-CB 3.48Å; N411-E415 WeakPolarHBondContact O-CG 3.29Å; N411-E415 PolarHBondContact O-N 3.5Å
412	Q	40	Very low	40.9	Very low	98 Å²	98	93.7 Å²	93.7	46%	0.458	47%	0.469	S	S	.	.	H	α-helix	trans	-66.3	-37.1	174.9	-79.1	-157.8	12.8	0	0	112.7	H408 L409 H410 E415 S416	H408-Q412 PolarHBondContact NE2-NE2 3.41Å; H408-Q412 WeakPolarHBondContact O-CB 3.13Å; H408-Q412 WeakPolarHBondContact O-CG 3.5Å; H408-Q412 PolarHBondContact O-N 3.45Å; L409-Q412 CarbonylContact O-C 3.6Å; L409-Q412 PolarHBondContact O-N 3.4Å; H410-Q412 PolarHBondContact O-N 3.25Å; Q412-E415 PolarHBondContact O-N 2.95Å; Q412-S416 WeakPolarHBondContact O-CB 3.44Å; Q412-S416 PolarHBondContact O-N 2.96Å; Q412-S416 PolarHBondContact O-OG 2.94Å
413	L	36.6	Very low	40.5	Very low	72 Å²	72	99.2 Å²	99.2	38%	0.377	50%	0.498	S	S	.	.	H	α-helix	trans	-68.1	-39	176.8	-80.1	161.5	0	0	0	111.7	L409 H410 S416 Q417 L418	L409-L413 VanDerWaalsContact O-CB 3.29Å; L409-L413 WeakPolarHBondContact O-CB 3.39Å; L409-L413 WeakPolarHBondContact O-CD1 3.34Å; L409-L413 VanDerWaalsContact O-CG 3.27Å; L409-L413 WeakPolarHBondContact O-CG 3.26Å; L409-L413 PolarHBondContact O-N 2.9Å; H410-L413 PolarHBondContact O-N 3.36Å; L413-S416 WeakPolarHBondContact CA-OG 3.44Å; L413-S416 PolarHBondContact O-N 3.04Å; L413-S416 PolarHBondContact O-OG 3.09Å; L413-Q417 PolarHBondContact O-N 3.28Å; L413-L418 HydrophobicContact CD2-CB 4.12Å; L413-L418 HydrophobicContact CD2-CD2 4.37Å; L413-L418 PolarHBondContact O-N 2.92Å
414	V	39.6	Very low	39.6	Very low	67 Å²	67	103.7 Å²	103.7	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-44.8	172	171.7	0	0	0	0	110.5	H410 N411 S416 Q417	H410-V414 WeakPolarHBondContact O-CB 3.16Å; H410-V414 VanDerWaalsContact O-CG2 3.24Å; H410-V414 WeakPolarHBondContact O-CG2 3.45Å; H410-V414 PolarHBondContact O-N 2.91Å; N411-V414 PolarHBondContact O-N 2.96Å; V414-S416 VanDerWaalsContact C-N 3.31Å; V414-S416 PolarHBondContact O-N 2.75Å; V414-Q417 PolarHBondContact O-N 3.35Å
415	E	39.2	Very low	38.7	Very low	162 Å²	162	97.3 Å²	97.3	76%	0.757	50%	0.497	S	S	*	.	H	α-helix	trans	-64.9	-32.1	175.7	-79.7	-175.6	169.8	0	0	113	N411 Q412 Q417	N411-E415 WeakPolarHBondContact O-CB 3.48Å; N411-E415 WeakPolarHBondContact O-CG 3.29Å; N411-E415 PolarHBondContact O-N 3.5Å; Q412-E415 PolarHBondContact O-N 2.95Å; E415-Q417 VanDerWaalsContact C-N 3.28Å; E415-Q417 PolarHBondContact O-N 3.47Å
416	S	39.2	Very low	38.1	Very low	67 Å²	67	103.6 Å²	103.6	47%	0.469	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	10.3	177.6	48.9	0	0	0	0	114.2	Q412 L413 V414 L418	Q412-S416 WeakPolarHBondContact O-CB 3.44Å; Q412-S416 PolarHBondContact O-N 2.96Å; Q412-S416 PolarHBondContact O-OG 2.94Å; L413-S416 WeakPolarHBondContact CA-OG 3.44Å; L413-S416 PolarHBondContact O-N 3.04Å; L413-S416 PolarHBondContact O-OG 3.09Å; V414-S416 VanDerWaalsContact C-N 3.31Å; V414-S416 PolarHBondContact O-N 2.75Å; S416-L418 PolarHBondContact O-N 3.23Å
417	Q	36.3	Very low	37.2	Very low	169 Å²	169	106 Å²	106	79%	0.79	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	23.6	177.4	-60.9	-173.3	-5.1	0	0	114.4	L413 V414 E415 E419	L413-Q417 PolarHBondContact O-N 3.28Å; V414-Q417 PolarHBondContact O-N 3.35Å; E415-Q417 VanDerWaalsContact C-N 3.28Å; E415-Q417 PolarHBondContact O-N 3.47Å; Q417-E419 VanDerWaalsContact C-N 3.33Å; Q417-E419 PolarHBondContact O-N 3.06Å
418	L	30.7	Very low	36.3	Very low	80 Å²	80	108.4 Å²	108.4	42%	0.419	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.8	-175.4	-126.8	97.9	0	0	0	113.9	L413 S416 A420 V421	L413-L418 HydrophobicContact CD2-CB 4.12Å; L413-L418 HydrophobicContact CD2-CD2 4.37Å; L413-L418 PolarHBondContact O-N 2.92Å; S416-L418 PolarHBondContact O-N 3.23Å; L418-A420 PolarHBondContact O-N 3.16Å; L418-V421 HydrophobicContact CG-CB 4.3Å; L418-V421 HydrophobicContact CG-CG2 4.08Å; L418-V421 WeakPolarHBondContact O-CB 3.29Å; L418-V421 PolarHBondContact O-N 2.92Å
419	E	30.3	Very low	35.8	Very low	109 Å²	109	109.9 Å²	109.9	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-59.1	-33	176.9	-152.6	162.6	-148.2	0	0	111.2	Q417 V421 I422 D423	Q417-E419 VanDerWaalsContact C-N 3.33Å; Q417-E419 PolarHBondContact O-N 3.06Å; E419-V421 PolarHBondContact O-N 2.82Å; E419-I422 PolarHBondContact O-N 2.96Å; E419-D423 PolarHBondContact O-N 2.7Å
420	A	31.3	Very low	35.8	Very low	66 Å²	66	111.1 Å²	111.1	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-20.6	174	0	0	0	0	0	114.2	L418 Y424	L418-A420 PolarHBondContact O-N 3.16Å; A420-Y424 WeakPolarHBondContact O-CB 3.47Å
421	V	30.9	Very low	35.3	Very low	72 Å²	72	111.3 Å²	111.3	44%	0.436	57%	0.566	S	S	.	*	H	α-helix	trans	-85.1	-31.3	-179.8	-177.7	0	0	0	0	111.4	L418 E419 I425	L418-V421 HydrophobicContact CG-CB 4.3Å; L418-V421 HydrophobicContact CG-CG2 4.08Å; L418-V421 WeakPolarHBondContact O-CB 3.29Å; L418-V421 PolarHBondContact O-N 2.92Å; E419-V421 PolarHBondContact O-N 2.82Å; V421-I425 HydrophobicContact CG1-CD1 3.86Å; V421-I425 WeakPolarHBondContact O-CD1 2.99Å; V421-I425 VanDerWaalsContact O-CG1 3.29Å; V421-I425 WeakPolarHBondContact O-CG1 3.25Å
422	I	29.9	Very low	35.1	Very low	120 Å²	120	112.6 Å²	112.6	62%	0.615	57%	0.571	S	S	*	*	H	α-helix	trans	-76.9	-37.3	179.2	-62.7	176.5	0	0	0	110.5	E419	E419-I422 PolarHBondContact O-N 2.96Å
423	D	31.8	Very low	35.3	Very low	137 Å²	137	115 Å²	115	73%	0.733	58%	0.58	S	S	*	*	H	α-helix	trans	-72.9	-26.5	177.8	-83.4	-12.3	0	0	0	113.8	E419	E419-D423 PolarHBondContact O-N 2.7Å
424	Y	26.8	Very low	35.7	Very low	206 Å²	206	113.6 Å²	113.6	81%	0.808	58%	0.576	S	S	*	*	H	α-helix	trans	-86.7	-10.4	-177.2	-110.5	-87.2	0	0	0	115.2	A420 K426	A420-Y424 WeakPolarHBondContact O-CB 3.47Å; Y424-K426 PolarHBondContact O-N 2.97Å
425	I	29.1	Very low	36	Very low	74 Å²	74	113 Å²	113	38%	0.379	57%	0.571	S	S	.	*			trans	-102.8	76.4	-176.4	-58.7	176.9	0	0	0	109	V421 Y427	V421-I425 HydrophobicContact CG1-CD1 3.86Å; V421-I425 WeakPolarHBondContact O-CD1 2.99Å; V421-I425 VanDerWaalsContact O-CG1 3.29Å; V421-I425 WeakPolarHBondContact O-CG1 3.25Å; I425-Y427 HydrophobicContact CB-CD2 4.41Å; I425-Y427 HydrophobicContact CG2-CD2 2.92Å; I425-Y427 HydrophobicContact CG2-CE2 3.09Å; I425-Y427 HydrophobicContact CG2-CG 3.68Å; I425-Y427 PolarHBondContact O-N 3.41Å
426	K	30.4	Very low	36.2	Very low	205 Å²	205	108 Å²	108	89%	0.891	55%	0.548	S	S	*	.			trans	-63	73.2	152.6	-79.5	-179.2	174	178.2	0	108.6	Y424 D428	Y424-K426 PolarHBondContact O-N 2.97Å; K426-D428 PolarHBondContact O-N 3.44Å
427	Y	34.4	Very low	36.5	Very low	98 Å²	98	109.1 Å²	109.1	38%	0.384	55%	0.549	S	S	.	.			trans	-71.8	119.5	157.9	-85.6	-57.3	0	0	0	106.6	I425 F429 F438	I425-Y427 HydrophobicContact CB-CD2 4.41Å; I425-Y427 HydrophobicContact CG2-CD2 2.92Å; I425-Y427 HydrophobicContact CG2-CE2 3.09Å; I425-Y427 HydrophobicContact CG2-CG 3.68Å; I425-Y427 PolarHBondContact O-N 3.41Å; Y427-F429 VanDerWaalsContact C-N 3.28Å; Y427-F429 WeakPolarHBondContact O-CD2 3.42Å; Y427-F429 WeakPolarHBondContact O-CE2 3.29Å; Y427-F429 PolarHBondContact O-N 3.39Å; Y427-F438 HydrophobicContact CD2-CD2 4Å; Y427-F438 AromaticContact CE2-CD2 3.66Å; Y427-F438 HydrophobicContact CE2-CD2 3.66Å; Y427-F438 HydrophobicContact CE2-CE2 4.23Å
428	D	35	Very low	37.1	Very low	113 Å²	113	104.7 Å²	104.7	60%	0.604	53%	0.527	S	S	*	.			trans	-66.4	94.7	166.4	-160.8	-5.9	0	0	0	107	K426 S430	K426-D428 PolarHBondContact O-N 3.44Å; D428-S430 PolarHBondContact O-N 3.5Å; D428-S430 VanDerWaalsContact OD1-CB 3.26Å; D428-S430 WeakPolarHBondContact OD1-CB 3.37Å; D428-S430 PolarHBondContact OD1-OG 3.16Å
429	F	37.3	Very low	37.7	Very low	133 Å²	133	103.2 Å²	103.2	58%	0.583	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	7.5	177.8	-68.7	-83.1	0	0	0	112.5	Y427 D431 I435	Y427-F429 VanDerWaalsContact C-N 3.28Å; Y427-F429 WeakPolarHBondContact O-CD2 3.42Å; Y427-F429 WeakPolarHBondContact O-CE2 3.29Å; Y427-F429 PolarHBondContact O-N 3.39Å; F429-D431 VanDerWaalsContact C-N 3.29Å; F429-D431 PolarHBondContact O-N 2.86Å; F429-I435 HydrophobicContact CB-CD1 4.3Å; F429-I435 HydrophobicContact CD1-CD1 4.05Å; F429-I435 HydrophobicContact CD1-CG1 3.88Å
430	S	44.1	Very low	38.3	Very low	104 Å²	104	101.9 Å²	101.9	73%	0.727	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.4	176.5	-54.7	0	0	0	0	113.2	D428	D428-S430 PolarHBondContact O-N 3.5Å; D428-S430 VanDerWaalsContact OD1-CB 3.26Å; D428-S430 WeakPolarHBondContact OD1-CB 3.37Å; D428-S430 PolarHBondContact OD1-OG 3.16Å
431	D	39.2	Very low	39.2	Very low	89 Å²	89	106.9 Å²	106.9	48%	0.476	52%	0.522	S	S	.	.			trans	-106.5	113.3	180	-167.2	-7.7	0	0	0	110.6	F429 K433 S434 I435	F429-D431 VanDerWaalsContact C-N 3.29Å; F429-D431 PolarHBondContact O-N 2.86Å; D431-K433 PolarHBondContact O-N 3.41Å; D431-K433 WeakPolarHBondContact OD1-CB 3.47Å; D431-K433 PolarHBondContact OD1-N 2.82Å; D431-K433 VanDerWaalsContact OD1-N 3.12Å; D431-S434 WeakPolarHBondContact O-CB 3.23Å; D431-S434 PolarHBondContact O-N 2.85Å; D431-I435 PolarHBondContact O-N 3.35Å
432	I	44.9	Very low	39.9	Very low	123 Å²	123	106.9 Å²	106.9	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-49.9	-31.9	175.9	-68.6	171.7	0	0	0	110.7	S434 I435 M436	I432-S434 VanDerWaalsContact C-N 3.34Å; I432-S434 PolarHBondContact O-N 3.04Å; I432-I435 PolarHBondContact O-N 3.43Å; I432-M436 HydrophobicContact CG2-CG 4.19Å; I432-M436 WeakPolarHBondContact O-CG 3.26Å; I432-M436 PolarHBondContact O-N 3.04Å
433	K	44.1	Very low	40.5	Very low	149 Å²	149	109.2 Å²	109.2	65%	0.648	53%	0.528	S	S	*	.	H	α-helix	trans	-64.6	-36.4	178.6	-148.4	174.5	-172.7	178.8	0	112.8	D431 N437	D431-K433 PolarHBondContact O-N 3.41Å; D431-K433 WeakPolarHBondContact OD1-CB 3.47Å; D431-K433 PolarHBondContact OD1-N 2.82Å; D431-K433 VanDerWaalsContact OD1-N 3.12Å; K433-N437 WeakPolarHBondContact O-CB 3.49Å; K433-N437 PolarHBondContact O-N 2.87Å
434	S	44.7	Very low	40.8	Very low	42 Å²	42	108.7 Å²	108.7	29%	0.294	52%	0.517	S	S	.	.	H	α-helix	trans	-69.7	-38.6	176.1	-64.1	0	0	0	0	111.8	D431 I432 N437 F438	D431-S434 WeakPolarHBondContact O-CB 3.23Å; D431-S434 PolarHBondContact O-N 2.85Å; I432-S434 VanDerWaalsContact C-N 3.34Å; I432-S434 PolarHBondContact O-N 3.04Å; S434-N437 PolarHBondContact O-N 3.15Å; S434-F438 WeakPolarHBondContact O-CB 3.33Å; S434-F438 PolarHBondContact O-N 2.83Å
435	I	47	Very low	41	Very low	55 Å²	55	101.8 Å²	101.8	28%	0.282	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-51	175	-54.4	-171.7	0	0	0	110.2	F429 D431 I432 N437 F438 L439	F429-I435 HydrophobicContact CB-CD1 4.3Å; F429-I435 HydrophobicContact CD1-CD1 4.05Å; F429-I435 HydrophobicContact CD1-CG1 3.88Å; D431-I435 PolarHBondContact O-N 3.35Å; I432-I435 PolarHBondContact O-N 3.43Å; I435-N437 VanDerWaalsContact C-N 3.31Å; I435-N437 PolarHBondContact O-N 3.22Å; I435-F438 PolarHBondContact O-N 3.34Å; I435-L439 HydrophobicContact CG2-CD1 3.87Å; I435-L439 HydrophobicContact CG2-CG 4.45Å; I435-L439 VanDerWaalsContact O-CG 3.31Å; I435-L439 WeakPolarHBondContact O-CG 3.5Å; I435-L439 PolarHBondContact O-N 3.3Å
436	M	43.8	Very low	41.2	Very low	57 Å²	57	104.1 Å²	104.1	28%	0.281	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-38.6	179.7	-68	-59.8	-71.9	0	0	111.8	I432 L439 H440 I445 L449	I432-M436 HydrophobicContact CG2-CG 4.19Å; I432-M436 WeakPolarHBondContact O-CG 3.26Å; I432-M436 PolarHBondContact O-N 3.04Å; M436-L439 PolarHBondContact O-N 3.44Å; M436-H440 VanDerWaalsContact O-CB 3.32Å; M436-H440 WeakPolarHBondContact O-CB 3.46Å; M436-H440 PolarHBondContact O-N 2.89Å; M436-I445 HydrophobicContact CE-CD1 4.39Å; M436-I445 HydrophobicContact SD-CD1 4.47Å; M436-L449 HydrophobicContact CE-CD1 3.66Å
437	N	45.3	Very low	41.3	Very low	91 Å²	91	99.5 Å²	99.5	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-40.3	174.5	-85.4	-13.9	0	0	0	113.1	K433 S434 I435 H440 K441	K433-N437 WeakPolarHBondContact O-CB 3.49Å; K433-N437 PolarHBondContact O-N 2.87Å; S434-N437 PolarHBondContact O-N 3.15Å; I435-N437 VanDerWaalsContact C-N 3.31Å; I435-N437 PolarHBondContact O-N 3.22Å; N437-H440 PolarHBondContact O-N 3.38Å; N437-K441 VanDerWaalsContact O-CB 3.25Å; N437-K441 WeakPolarHBondContact O-CB 3.37Å; N437-K441 PolarHBondContact O-N 3.5Å
438	F	49.1	Very low	41.2	Very low	75 Å²	75	101.6 Å²	101.6	33%	0.329	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.5	173.8	-95	0	0	0	111.6	Y427 S434 I435 K441 N442	Y427-F438 HydrophobicContact CD2-CD2 4Å; Y427-F438 AromaticContact CE2-CD2 3.66Å; Y427-F438 HydrophobicContact CE2-CD2 3.66Å; Y427-F438 HydrophobicContact CE2-CE2 4.23Å; S434-F438 WeakPolarHBondContact O-CB 3.33Å; S434-F438 PolarHBondContact O-N 2.83Å; I435-F438 PolarHBondContact O-N 3.34Å; F438-K441 PolarHBondContact O-N 2.87Å; F438-N442 WeakPolarHBondContact CE2-ND2 3.37Å; F438-N442 WeakPolarHBondContact CZ-ND2 3.33Å; F438-N442 PolarHBondContact O-N 2.95Å; F438-N442 PolarHBondContact O-ND2 3.28Å
439	L	42.1	Very low	41.4	Very low	49 Å²	49	99.5 Å²	99.5	26%	0.257	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-41.1	177.9	-67.4	171.3	0	0	0	111.3	I435 M436 E443 Y444 I445	I435-L439 HydrophobicContact CG2-CD1 3.87Å; I435-L439 HydrophobicContact CG2-CG 4.45Å; I435-L439 VanDerWaalsContact O-CG 3.31Å; I435-L439 WeakPolarHBondContact O-CG 3.5Å; I435-L439 PolarHBondContact O-N 3.3Å; M436-L439 PolarHBondContact O-N 3.44Å; L439-E443 PolarHBondContact O-N 3.47Å; L439-Y444 HydrophobicContact CD2-CD2 4.2Å; L439-Y444 WeakPolarHBondContact O-CB 3.28Å; L439-Y444 PolarHBondContact O-N 2.93Å; L439-I445 HydrophobicContact CB-CD1 3.96Å; L439-I445 HydrophobicContact CB-CG1 4.21Å; L439-I445 HydrophobicContact CD1-CD1 3.76Å; L439-I445 HydrophobicContact CG-CD1 4.44Å
440	H	42.8	Very low	41.1	Very low	82 Å²	82	102.7 Å²	102.7	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-66.6	-45.7	175.9	-178.6	26.4	0	0	0	112.7	M436 N437 N442 E443 I445 F447	M436-H440 VanDerWaalsContact O-CB 3.32Å; M436-H440 WeakPolarHBondContact O-CB 3.46Å; M436-H440 PolarHBondContact O-N 2.89Å; N437-H440 PolarHBondContact O-N 3.38Å; H440-N442 PolarHBondContact O-N 2.77Å; H440-E443 WeakPolarHBondContact O-CA 3.44Å; H440-E443 PolarHBondContact O-N 3.37Å; H440-I445 PolarHBondContact ND1-O 3.4Å; H440-F447 HydrophobicContact CB-CD2 4.02Å; H440-F447 HydrophobicContact CB-CE2 3.93Å; H440-F447 AromaticContact CD2-CD2 3.25Å; H440-F447 WeakPolarHBondContact CD2-CD2 3.22Å; H440-F447 AromaticContact CD2-CE2 3.55Å; H440-F447 AromaticContact CG-CD2 3.58Å; H440-F447 AromaticContact CG-CE2 3.9Å; H440-F447 AromaticContact NE2-CD2 3.74Å
441	K	49.9	Very low	40.7	Very low	171 Å²	171	107.3 Å²	107.3	74%	0.743	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-25.8	-177.5	-164.3	179	-176.8	-175.5	0	113	N437 F438	N437-K441 VanDerWaalsContact O-CB 3.25Å; N437-K441 WeakPolarHBondContact O-CB 3.37Å; N437-K441 PolarHBondContact O-N 3.5Å; F438-K441 PolarHBondContact O-N 2.87Å
442	N	46.4	Very low	40.6	Very low	71 Å²	71	108.3 Å²	108.3	38%	0.38	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	14.1	175.1	-64.9	-49.8	0	0	0	113.1	F438 H440 Y444	F438-N442 WeakPolarHBondContact CE2-ND2 3.37Å; F438-N442 WeakPolarHBondContact CZ-ND2 3.33Å; F438-N442 PolarHBondContact O-N 2.95Å; F438-N442 PolarHBondContact O-ND2 3.28Å; H440-N442 PolarHBondContact O-N 2.77Å; N442-Y444 HydrophobicContact CB-CD2 3.37Å; N442-Y444 HydrophobicContact CB-CE2 3.2Å; N442-Y444 HydrophobicContact CB-CG 4.4Å; N442-Y444 PolarHBondContact O-N 2.97Å
443	E	42.2	Very low	40	Very low	169 Å²	169	107.6 Å²	107.6	79%	0.79	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	24.8	178.3	-57.2	179.5	164.1	0	0	114.4	L439 H440	L439-E443 PolarHBondContact O-N 3.47Å; H440-E443 WeakPolarHBondContact O-CA 3.44Å; H440-E443 PolarHBondContact O-N 3.37Å
444	Y	37.7	Very low	39.4	Very low	126 Å²	126	108.8 Å²	108.8	49%	0.494	52%	0.524	S	S	.	.	S	Bend	trans	-80.4	-22.2	176.8	-63.7	-62.3	0	0	0	112.9	L439 N442	L439-Y444 HydrophobicContact CD2-CD2 4.2Å; L439-Y444 WeakPolarHBondContact O-CB 3.28Å; L439-Y444 PolarHBondContact O-N 2.93Å; N442-Y444 HydrophobicContact CB-CD2 3.37Å; N442-Y444 HydrophobicContact CB-CE2 3.2Å; N442-Y444 HydrophobicContact CB-CG 4.4Å; N442-Y444 PolarHBondContact O-N 2.97Å
445	I	32.2	Very low	38.9	Very low	62 Å²	62	109.3 Å²	109.3	32%	0.318	53%	0.528	S	S	.	.	S	Bend	trans	-141.4	138.4	179.8	-56.3	178.9	0	0	0	110.2	M436 L439 H440 L449	M436-I445 HydrophobicContact CE-CD1 4.39Å; M436-I445 HydrophobicContact SD-CD1 4.47Å; L439-I445 HydrophobicContact CB-CD1 3.96Å; L439-I445 HydrophobicContact CB-CG1 4.21Å; L439-I445 HydrophobicContact CD1-CD1 3.76Å; L439-I445 HydrophobicContact CG-CD1 4.44Å; H440-I445 PolarHBondContact ND1-O 3.4Å; I445-L449 HydrophobicContact CG2-CD1 4.05Å
446	D	31.9	Very low	38.3	Very low	123 Å²	123	112.1 Å²	112.1	66%	0.658	55%	0.547	S	S	*	.			trans	-96.1	134	176.1	-155.7	0.1	0	0	0	110.6	N448	D446-N448 PolarHBondContact O-N 3.2Å
447	F	33.5	Very low	37.8	Very low	108 Å²	108	116.2 Å²	116.2	47%	0.474	57%	0.57	S	S	.	*	S	Bend	trans	-78.1	29.3	-167.7	-118.6	-83.8	0	0	0	115	H440 L449	H440-F447 HydrophobicContact CB-CD2 4.02Å; H440-F447 HydrophobicContact CB-CE2 3.93Å; H440-F447 AromaticContact CD2-CD2 3.25Å; H440-F447 WeakPolarHBondContact CD2-CD2 3.22Å; H440-F447 AromaticContact CD2-CE2 3.55Å; H440-F447 AromaticContact CG-CD2 3.58Å; H440-F447 AromaticContact CG-CE2 3.9Å; H440-F447 AromaticContact NE2-CD2 3.74Å; F447-L449 PolarHBondContact O-N 3.01Å
448	N	32.8	Very low	37.3	Very low	142 Å²	142	116.5 Å²	116.5	76%	0.759	57%	0.571	S	S	*	*			trans	-82.8	39.6	171.4	-73	-31.5	0	0	0	112.3	D446 E450	D446-N448 PolarHBondContact O-N 3.2Å; N448-E450 VanDerWaalsContact C-N 3.33Å; N448-E450 PolarHBondContact O-N 3.42Å
449	L	37.7	Very low	36.7	Very low	69 Å²	69	117.7 Å²	117.7	36%	0.361	58%	0.584	S	S	.	*			trans	-92.8	23.8	179.9	-85.5	157.3	0	0	0	113.3	M436 I445 F447 K451 L452	M436-L449 HydrophobicContact CE-CD1 3.66Å; I445-L449 HydrophobicContact CG2-CD1 4.05Å; F447-L449 PolarHBondContact O-N 3.01Å; L449-K451 PolarHBondContact O-N 3.04Å; L449-L452 HydrophobicContact CD2-CB 3.88Å; L449-L452 HydrophobicContact CD2-CD1 3.71Å; L449-L452 HydrophobicContact CD2-CG 4.27Å; L449-L452 PolarHBondContact O-N 3.39Å
450	E	31.8	Very low	36.4	Very low	199 Å²	199	119.4 Å²	119.4	93%	0.93	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-8.5	166.7	-82.3	-170.4	161.2	0	0	113.3	N448	N448-E450 VanDerWaalsContact C-N 3.33Å; N448-E450 PolarHBondContact O-N 3.42Å
451	K	36.7	Very low	36	Very low	202 Å²	202	120.4 Å²	120.4	88%	0.878	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	10.4	177.9	-68.8	-168.5	-178.3	-176.2	0	115.8	L449 D453	L449-K451 PolarHBondContact O-N 3.04Å; K451-D453 PolarHBondContact O-N 2.9Å
452	L	36.6	Very low	35.5	Very low	109 Å²	109	120.1 Å²	120.1	57%	0.571	61%	0.608	S	S	*	*			trans	-82.3	102.9	168.4	-142.1	88.1	0	0	0	108.5	L449 K454 L457	L449-L452 HydrophobicContact CD2-CB 3.88Å; L449-L452 HydrophobicContact CD2-CD1 3.71Å; L449-L452 HydrophobicContact CD2-CG 4.27Å; L449-L452 PolarHBondContact O-N 3.39Å; L452-K454 PolarHBondContact O-N 3.36Å; L452-L457 HydrophobicContact CD2-CD1 4.27Å
453	D	31.8	Very low	35.3	Very low	108 Å²	108	126.2 Å²	126.2	58%	0.578	63%	0.626	S	S	*	*			trans	-62.2	106.4	176.8	-164	3.6	0	0	0	109.1	K451 S455 T456	K451-D453 PolarHBondContact O-N 2.9Å; D453-S455 PolarHBondContact O-N 2.96Å; D453-S455 PolarHBondContact OD1-OG 3.41Å; D453-S455 VanDerWaalsContact OD1-OG 3.12Å; D453-S455 PolarHBondContact OD2-OG 2.96Å; D453-T456 PolarHBondContact O-N 3.41Å; D453-T456 PolarHBondContact O-OG1 3.49Å
454	K	31.5	Very low	35	Very low	174 Å²	174	123.1 Å²	123.1	76%	0.757	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-15.9	-178.6	-71	179.9	179.1	175.2	0	112.1	L452 T456	L452-K454 PolarHBondContact O-N 3.36Å; K454-T456 VanDerWaalsContact C-N 3.28Å; K454-T456 PolarHBondContact O-N 3.32Å
455	S	34.6	Very low	34.9	Very low	54 Å²	54	119.4 Å²	119.4	38%	0.378	61%	0.608	S	S	.	*	H	α-helix	trans	-60.2	-34.9	176.4	68.7	0	0	0	0	112.6	D453 L457 T459	D453-S455 PolarHBondContact O-N 2.96Å; D453-S455 PolarHBondContact OD1-OG 3.41Å; D453-S455 VanDerWaalsContact OD1-OG 3.12Å; D453-S455 PolarHBondContact OD2-OG 2.96Å; S455-L457 PolarHBondContact O-N 2.96Å; S455-T459 WeakPolarHBondContact O-CB 3.26Å; S455-T459 WeakPolarHBondContact O-CG2 3.43Å; S455-T459 PolarHBondContact O-OG1 3.5Å
456	T	34	Very low	35.8	Very low	113 Å²	113	120.5 Å²	120.5	69%	0.693	62%	0.62	S	S	*	*	H	α-helix	trans	-77.3	-21.8	-169.3	-6	0	0	0	0	115.2	D453 K454	D453-T456 PolarHBondContact O-N 3.41Å; D453-T456 PolarHBondContact O-OG1 3.49Å; K454-T456 VanDerWaalsContact C-N 3.28Å; K454-T456 PolarHBondContact O-N 3.32Å
457	L	34.4	Very low	36.5	Very low	143 Å²	143	120.2 Å²	120.2	75%	0.749	62%	0.619	S	S	*	*	H	α-helix	trans	-109.1	-14.1	-172.8	-88	158.8	0	0	0	114.5	L452 S455	L452-L457 HydrophobicContact CD2-CD1 4.27Å; S455-L457 PolarHBondContact O-N 2.96Å
458	L	33	Very low	36.9	Very low	98 Å²	98	120.6 Å²	120.6	51%	0.513	62%	0.622	S	S	.	*	H	α-helix	trans	-129.8	10.5	-167.1	-88.2	152.3	0	0	0	114.5	D460 L461	L458-D460 VanDerWaalsContact C-N 3.27Å; L458-D460 PolarHBondContact O-N 3.02Å; L458-L461 HydrophobicContact CD2-CD1 4.1Å
459	T	37.6	Very low	37.6	Very low	99 Å²	99	118.7 Å²	118.7	61%	0.607	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-5.1	-162.4	6.6	0	0	0	0	117.5	S455	S455-T459 WeakPolarHBondContact O-CB 3.26Å; S455-T459 WeakPolarHBondContact O-CG2 3.43Å; S455-T459 PolarHBondContact O-OG1 3.5Å
460	D	35.5	Very low	38	Very low	86 Å²	86	119.9 Å²	119.9	46%	0.46	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.8	16.8	178.3	-80.6	-43.2	0	0	0	115.7	L458 R463	L458-D460 VanDerWaalsContact C-N 3.27Å; L458-D460 PolarHBondContact O-N 3.02Å; D460-R463 WeakPolarHBondContact OD1-CD 3.43Å
461	L	34.1	Very low	38.8	Very low	102 Å²	102	116.5 Å²	116.5	53%	0.534	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-26.6	169.5	-110.4	145	0	0	0	112.7	L458	L458-L461 HydrophobicContact CD2-CD1 4.1Å
462	D	40.4	Very low	39.1	Very low	166 Å²	166	110.5 Å²	110.5	89%	0.888	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-19.5	178.1	-71.8	-23.2	0	0	0	112.8
463	R	42.1	Very low	39.3	Very low	199 Å²	199	107 Å²	107	75%	0.751	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-40.1	-176	-112.4	-179	178.6	-173.5	0.8	113.6	D460	D460-R463 WeakPolarHBondContact OD1-CD 3.43Å
464	Y	35	Very low	40	Very low	104 Å²	104	107.2 Å²	107.2	41%	0.408	55%	0.554	S	S	.	*	S	Bend	trans	-103.8	107.2	175.5	-63.8	-79.6	0	0	0	106.4	S466	Y464-S466 PolarHBondContact O-N 2.95Å
465	G	35.1	Very low	40.8	Very low	48 Å²	48	106.5 Å²	106.5	50%	0.495	55%	0.554	S	S	.	*			trans	-45.5	143.9	172.4	0	0	0	0	0	109.8	D467 E468 Y469	G465-D467 PolarHBondContact O-N 3.42Å; G465-E468 PolarHBondContact O-N 3.02Å; G465-Y469 PolarHBondContact O-N 2.96Å
466	S	50.9	Low	41.4	Very low	84 Å²	84	109.2 Å²	109.2	59%	0.587	56%	0.564	S	S	*	*	H	α-helix	trans	-42	-32	-169.9	55.3	0	0	0	0	115	Y464 L470	Y464-S466 PolarHBondContact O-N 2.95Å; S466-L470 WeakPolarHBondContact O-CB 3.4Å; S466-L470 PolarHBondContact O-N 3.32Å
467	D	46.8	Very low	42	Very low	117 Å²	117	107.6 Å²	107.6	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-82.9	-33.4	-174.6	-62.7	-4.3	0	0	0	113.3	G465 L470 Q471	G465-D467 PolarHBondContact O-N 3.42Å; D467-L470 PolarHBondContact O-N 2.73Å; D467-Q471 PolarHBondContact O-N 2.97Å
468	E	43.2	Very low	42.4	Very low	117 Å²	117	104 Å²	104	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-73.8	-40.9	178.5	-73.9	-177.7	170.4	0	0	111.5	G465 L470 Q471 L472	G465-E468 PolarHBondContact O-N 3.02Å; E468-L470 VanDerWaalsContact C-N 3.32Å; E468-L470 PolarHBondContact O-N 3.49Å; E468-Q471 PolarHBondContact O-N 2.97Å; E468-L472 WeakPolarHBondContact O-CB 3.44Å; E468-L472 PolarHBondContact O-N 2.73Å
469	Y	46.2	Very low	43.1	Very low	102 Å²	102	102.8 Å²	102.8	40%	0.4	52%	0.523	S	S	.	.	H	α-helix	trans	-61.1	-42.2	172.1	-176	-93.5	0	0	0	110.9	G465 Q471 L472 Q473	G465-Y469 PolarHBondContact O-N 2.96Å; Y469-Q471 PolarHBondContact O-N 3.46Å; Y469-L472 PolarHBondContact O-N 3.38Å; Y469-Q473 WeakPolarHBondContact O-CB 3.47Å; Y469-Q473 PolarHBondContact O-N 3.26Å
470	L	46.8	Very low	43.4	Very low	93 Å²	93	102.6 Å²	102.6	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-38.1	177.4	-152	82.5	0	0	0	112	S466 D467 E468 N474	S466-L470 WeakPolarHBondContact O-CB 3.4Å; S466-L470 PolarHBondContact O-N 3.32Å; D467-L470 PolarHBondContact O-N 2.73Å; E468-L470 VanDerWaalsContact C-N 3.32Å; E468-L470 PolarHBondContact O-N 3.49Å; L470-N474 WeakPolarHBondContact O-CB 3.5Å; L470-N474 PolarHBondContact O-N 3.47Å; L470-N474 PolarHBondContact O-ND2 3.36Å
471	Q	48.4	Very low	43.7	Very low	129 Å²	129	106.2 Å²	106.2	60%	0.603	53%	0.527	S	S	*	.	H	α-helix	trans	-66.7	-46.1	174.6	-81.1	-173	12.4	0	0	112.4	D467 E468 Y469 Q473 N474 Q475	D467-Q471 PolarHBondContact O-N 2.97Å; E468-Q471 PolarHBondContact O-N 2.97Å; Y469-Q471 PolarHBondContact O-N 3.46Å; Q471-Q473 VanDerWaalsContact C-N 3.32Å; Q471-Q473 PolarHBondContact O-N 2.88Å; Q471-N474 PolarHBondContact O-N 2.88Å; Q471-Q475 WeakPolarHBondContact O-CB 3.5Å; Q471-Q475 PolarHBondContact O-N 3.26Å
472	L	42.8	Very low	44.3	Very low	76 Å²	76	104 Å²	104	40%	0.398	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-41.6	173.9	-99.3	147.3	0	0	0	111.5	E468 Y469 N474 Q475 L476	E468-L472 WeakPolarHBondContact O-CB 3.44Å; E468-L472 PolarHBondContact O-N 2.73Å; Y469-L472 PolarHBondContact O-N 3.38Å; L472-N474 VanDerWaalsContact C-N 3.35Å; L472-N474 PolarHBondContact O-N 2.77Å; L472-Q475 PolarHBondContact O-N 2.76Å; L472-L476 HydrophobicContact CD2-CD1 3.66Å; L472-L476 HydrophobicContact CD2-CG 4.48Å; L472-L476 WeakPolarHBondContact O-CB 3.19Å; L472-L476 PolarHBondContact O-N 3.47Å
473	Q	40.9	Very low	44.8	Very low	34 Å²	34	102.3 Å²	102.3	16%	0.159	50%	0.5	C	S	.	.	H	α-helix	trans	-63.9	-39.3	177.8	-165.1	-179.7	21.9	0	0	112.1	Y469 Q471 N477 L478	Y469-Q473 WeakPolarHBondContact O-CB 3.47Å; Y469-Q473 PolarHBondContact O-N 3.26Å; Q471-Q473 VanDerWaalsContact C-N 3.32Å; Q471-Q473 PolarHBondContact O-N 2.88Å; Q473-N477 PolarHBondContact O-N 2.85Å; Q473-L478 HydrophobicContact CG-CB 3.99Å; Q473-L478 PolarHBondContact O-N 3.43Å
474	N	47.4	Very low	45	Very low	113 Å²	113	96.7 Å²	96.7	60%	0.604	48%	0.484	S	S	*	.	H	α-helix	trans	-71.6	-38.7	175.2	-74.1	-32.2	0	0	0	112.6	L470 Q471 L472	L470-N474 WeakPolarHBondContact O-CB 3.5Å; L470-N474 PolarHBondContact O-N 3.47Å; L470-N474 PolarHBondContact O-ND2 3.36Å; Q471-N474 PolarHBondContact O-N 2.88Å; L472-N474 VanDerWaalsContact C-N 3.35Å; L472-N474 PolarHBondContact O-N 2.77Å
475	Q	47.9	Very low	45.6	Very low	160 Å²	160	95 Å²	95	75%	0.748	48%	0.484	S	S	*	.	H	α-helix	trans	-71.7	-41	178.9	-82	-175.1	-14.7	0	0	112.8	Q471 L472	Q471-Q475 WeakPolarHBondContact O-CB 3.5Å; Q471-Q475 PolarHBondContact O-N 3.26Å; L472-Q475 PolarHBondContact O-N 2.76Å
476	L	47.1	Very low	46.5	Very low	111 Å²	111	98.8 Å²	98.8	58%	0.581	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.9	-177.9	-67.9	168.8	0	0	0	113.4	L472 L478	L472-L476 HydrophobicContact CD2-CD1 3.66Å; L472-L476 HydrophobicContact CD2-CG 4.48Å; L472-L476 WeakPolarHBondContact O-CB 3.19Å; L472-L476 PolarHBondContact O-N 3.47Å; L476-L478 HydrophobicContact CB-CD1 3.72Å; L476-L478 HydrophobicContact CB-CG 3.75Å; L476-L478 HydrophobicContact CD1-CD1 3.65Å; L476-L478 HydrophobicContact CD1-CG 4.43Å; L476-L478 HydrophobicContact CG-CD1 4.33Å; L476-L478 PolarHBondContact O-N 2.87Å; L476-L478 VanDerWaalsContact O-N 3.12Å
477	N	46.6	Very low	46.3	Very low	79 Å²	79	102.1 Å²	102.1	42%	0.422	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	33.3	-172.3	-85.2	-34.5	0	0	0	113.3	Q473 H479 L480	Q473-N477 PolarHBondContact O-N 2.85Å; N477-H479 PolarHBondContact O-N 3.31Å; N477-H479 PolarHBondContact O-ND1 3.45Å; N477-H479 PolarHBondContact OD1-CE1 2.6Å; N477-H479 VanDerWaalsContact OD1-CE1 3.31Å; N477-H479 PolarHBondContact OD1-ND1 3.41Å; N477-L480 PolarHBondContact O-N 3.26Å
478	L	42.8	Very low	46.3	Very low	66 Å²	66	104.2 Å²	104.2	35%	0.346	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-8	178.4	-80	158.4	0	0	0	113.4	Q473 L476 L480 Y481 D482	Q473-L478 HydrophobicContact CG-CB 3.99Å; Q473-L478 PolarHBondContact O-N 3.43Å; L476-L478 HydrophobicContact CB-CD1 3.72Å; L476-L478 HydrophobicContact CB-CG 3.75Å; L476-L478 HydrophobicContact CD1-CD1 3.65Å; L476-L478 HydrophobicContact CD1-CG 4.43Å; L476-L478 HydrophobicContact CG-CD1 4.33Å; L476-L478 PolarHBondContact O-N 2.87Å; L476-L478 VanDerWaalsContact O-N 3.12Å; L478-L480 PolarHBondContact O-N 3.45Å; L478-L480 VanDerWaalsContact O-N 3.17Å; L478-Y481 PolarHBondContact O-N 3.24Å; L478-Y481 VanDerWaalsContact O-N 3.1Å; L478-D482 PolarHBondContact O-N 3.12Å; L478-D482 VanDerWaalsContact O-N 3.1Å
479	H	48	Very low	46.6	Very low	73 Å²	73	105.4 Å²	105.4	34%	0.338	49%	0.49	S	S	.	.	H	α-helix	trans	-56.9	-25.2	172.2	74.8	-91	0	0	0	113.2	N477 K483	N477-H479 PolarHBondContact O-N 3.31Å; N477-H479 PolarHBondContact O-ND1 3.45Å; N477-H479 PolarHBondContact OD1-CE1 2.6Å; N477-H479 VanDerWaalsContact OD1-CE1 3.31Å; N477-H479 PolarHBondContact OD1-ND1 3.41Å; H479-K483 WeakPolarHBondContact O-CB 3.41Å; H479-K483 WeakPolarHBondContact O-CD 3.45Å; H479-K483 WeakPolarHBondContact O-CG 3.46Å; H479-K483 PolarHBondContact O-N 3.3Å
480	L	42.4	Very low	46.8	Very low	96 Å²	96	103.2 Å²	103.2	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-72.7	-43.1	174.8	-72.8	164.7	0	0	0	111.5	N477 L478 K483 L484	N477-L480 PolarHBondContact O-N 3.26Å; L478-L480 PolarHBondContact O-N 3.45Å; L478-L480 VanDerWaalsContact O-N 3.17Å; L480-K483 PolarHBondContact O-N 3.06Å; L480-L484 WeakPolarHBondContact O-CB 3.4Å; L480-L484 PolarHBondContact O-N 3Å
481	Y	42.1	Very low	47	Very low	162 Å²	162	100.9 Å²	100.9	64%	0.635	48%	0.481	S	S	*	.	H	α-helix	trans	-66	-46.4	178.6	-173	-98.7	0	0	0	111.6	L478 K483 L484 V485	L478-Y481 PolarHBondContact O-N 3.24Å; L478-Y481 VanDerWaalsContact O-N 3.1Å; Y481-K483 VanDerWaalsContact C-N 3.29Å; Y481-K483 PolarHBondContact O-N 2.83Å; Y481-L484 WeakPolarHBondContact O-CB 3.2Å; Y481-L484 PolarHBondContact O-N 3.32Å; Y481-L484 VanDerWaalsContact O-N 3.07Å; Y481-V485 HydrophobicContact CD1-CG2 4.1Å; Y481-V485 HydrophobicContact CE1-CG2 3.76Å; Y481-V485 WeakPolarHBondContact O-CG2 3.23Å; Y481-V485 PolarHBondContact O-N 3.49Å
482	D	48.3	Very low	46.9	Very low	54 Å²	54	99 Å²	99	29%	0.289	47%	0.472	S	S	.	.	H	α-helix	trans	-61.2	-37.7	176.3	-176.6	40.1	0	0	0	111.9	L478 K486	L478-D482 PolarHBondContact O-N 3.12Å; L478-D482 VanDerWaalsContact O-N 3.1Å; D482-K486 WeakPolarHBondContact O-CB 3.25Å; D482-K486 VanDerWaalsContact O-CG 3.28Å; D482-K486 WeakPolarHBondContact O-CG 3.39Å; D482-K486 PolarHBondContact O-N 2.86Å; D482-K486 VanDerWaalsContact OD1-CE 3.3Å; D482-K486 WeakPolarHBondContact OD1-CE 3.38Å; D482-K486 IonicContact OD1-NZ 2.69Å; D482-K486 PolarHBondContact OD1-NZ 3.48Å; D482-K486 WeakPolarHBondContact OD2-CE 3.38Å; D482-K486 IonicContact OD2-NZ 2.68Å; D482-K486 PolarHBondContact OD2-NZ 3.28Å
483	K	49	Very low	47.5	Very low	131 Å²	131	98 Å²	98	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-65	-39.2	172.7	-80.9	175.9	-176.4	176.8	0	112.7	H479 L480 Y481 R487	H479-K483 WeakPolarHBondContact O-CB 3.41Å; H479-K483 WeakPolarHBondContact O-CD 3.45Å; H479-K483 WeakPolarHBondContact O-CG 3.46Å; H479-K483 PolarHBondContact O-N 3.3Å; L480-K483 PolarHBondContact O-N 3.06Å; Y481-K483 VanDerWaalsContact C-N 3.29Å; Y481-K483 PolarHBondContact O-N 2.83Å; K483-R487 WeakPolarHBondContact O-CB 3.26Å; K483-R487 PolarHBondContact O-N 3.38Å
484	L	47	Very low	48.2	Very low	81 Å²	81	101.3 Å²	101.3	42%	0.424	48%	0.484	S	S	.	.	H	α-helix	trans	-67.1	-44.7	179.7	-155.9	156.2	0	0	0	110.6	L480 Y481 R487 R488	L480-L484 WeakPolarHBondContact O-CB 3.4Å; L480-L484 PolarHBondContact O-N 3Å; Y481-L484 WeakPolarHBondContact O-CB 3.2Å; Y481-L484 PolarHBondContact O-N 3.32Å; Y481-L484 VanDerWaalsContact O-N 3.07Å; L484-R487 PolarHBondContact O-N 3.36Å; L484-R488 PolarHBondContact O-N 2.96Å
485	V	48.2	Very low	48.3	Very low	68 Å²	68	99.9 Å²	99.9	41%	0.412	48%	0.477	S	S	.	.	H	α-helix	trans	-61.1	-46.8	174.9	175.5	0	0	0	0	111.4	Y481 R487 R488 F489	Y481-V485 HydrophobicContact CD1-CG2 4.1Å; Y481-V485 HydrophobicContact CE1-CG2 3.76Å; Y481-V485 WeakPolarHBondContact O-CG2 3.23Å; Y481-V485 PolarHBondContact O-N 3.49Å; V485-R487 VanDerWaalsContact C-N 3.32Å; V485-R487 PolarHBondContact O-N 3.38Å; V485-R488 PolarHBondContact O-N 3.43Å; V485-F489 PolarHBondContact O-N 3.4Å
486	K	52.9	Low	48.6	Very low	128 Å²	128	98.3 Å²	98.3	56%	0.557	47%	0.471	S	S	*	.	H	α-helix	trans	-61	-39.9	176.4	-76.4	170.3	178	164.2	0	112.5	D482 A490	D482-K486 WeakPolarHBondContact O-CB 3.25Å; D482-K486 VanDerWaalsContact O-CG 3.28Å; D482-K486 WeakPolarHBondContact O-CG 3.39Å; D482-K486 PolarHBondContact O-N 2.86Å; D482-K486 VanDerWaalsContact OD1-CE 3.3Å; D482-K486 WeakPolarHBondContact OD1-CE 3.38Å; D482-K486 IonicContact OD1-NZ 2.69Å; D482-K486 PolarHBondContact OD1-NZ 3.48Å; D482-K486 WeakPolarHBondContact OD2-CE 3.38Å; D482-K486 IonicContact OD2-NZ 2.68Å; D482-K486 PolarHBondContact OD2-NZ 3.28Å; K486-A490 PolarHBondContact O-N 3.27Å; K486-A490 VanDerWaalsContact O-N 3.08Å
487	R	47.9	Very low	49.1	Very low	154 Å²	154	96.9 Å²	96.9	58%	0.581	46%	0.464	S	S	*	.	H	α-helix	trans	-64.8	-46	176.4	-174.9	175.6	-178.6	172.5	-3.5	111.3	K483 L484 V485 F489 A490 I491	K483-R487 WeakPolarHBondContact O-CB 3.26Å; K483-R487 PolarHBondContact O-N 3.38Å; L484-R487 PolarHBondContact O-N 3.36Å; V485-R487 VanDerWaalsContact C-N 3.32Å; V485-R487 PolarHBondContact O-N 3.38Å; R487-F489 PolarHBondContact O-N 2.98Å; R487-A490 PolarHBondContact O-N 2.94Å; R487-I491 HydrophobicContact CG-CD1 4.01Å; R487-I491 WeakPolarHBondContact O-CG1 3.35Å; R487-I491 PolarHBondContact O-N 3.19Å
488	R	46	Very low	49.5	Very low	162 Å²	162	97.5 Å²	97.5	61%	0.611	46%	0.46	S	S	*	.	H	α-helix	trans	-58.6	-47.1	176.9	-177.9	175.8	170.6	-174.4	-1.1	111.6	L484 V485 A490 I491 E492	L484-R488 PolarHBondContact O-N 2.96Å; V485-R488 PolarHBondContact O-N 3.43Å; R488-A490 VanDerWaalsContact C-N 3.33Å; R488-A490 PolarHBondContact O-N 2.91Å; R488-I491 PolarHBondContact O-N 3Å; R488-E492 HydrophobicContact CG-CG 4.45Å; R488-E492 IonicContact CZ-OE1 3.91Å; R488-E492 IonicContact NE-OE1 2.77Å; R488-E492 PolarHBondContact NE-OE1 3Å; R488-E492 IonicContact NH2-OE1 3.97Å; R488-E492 PolarHBondContact NH2-OE1 3.24Å; R488-E492 WeakPolarHBondContact O-CG 3.31Å; R488-E492 PolarHBondContact O-N 3.46Å
489	F	50.2	Low	50	Low	142 Å²	142	99.9 Å²	99.9	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-60.7	-40	177.7	-175.3	-98.2	0	0	0	112.7	V485 R487 T493	V485-F489 PolarHBondContact O-N 3.4Å; R487-F489 PolarHBondContact O-N 2.98Å; F489-T493 WeakPolarHBondContact O-CB 3.49Å; F489-T493 PolarHBondContact O-N 3.01Å; F489-T493 PolarHBondContact O-OG1 3.45Å
490	A	50.6	Low	50.6	Low	56 Å²	56	100 Å²	100	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-43	176.4	0	0	0	0	0	112.2	K486 R487 R488 T493 E494	K486-A490 PolarHBondContact O-N 3.27Å; K486-A490 VanDerWaalsContact O-N 3.08Å; R487-A490 PolarHBondContact O-N 2.94Å; R488-A490 VanDerWaalsContact C-N 3.33Å; R488-A490 PolarHBondContact O-N 2.91Å; A490-T493 PolarHBondContact O-N 3.34Å; A490-E494 WeakPolarHBondContact O-CB 3.44Å; A490-E494 PolarHBondContact O-N 3.28Å
491	I	49.7	Very low	51.4	Low	44 Å²	44	100.1 Å²	100.1	23%	0.226	47%	0.47	C	S	.	.	H	α-helix	trans	-67.5	-44.1	178.8	-65.6	171.4	0	0	0	111.1	R487 R488 T493 E494 N495 E570	R487-I491 HydrophobicContact CG-CD1 4.01Å; R487-I491 WeakPolarHBondContact O-CG1 3.35Å; R487-I491 PolarHBondContact O-N 3.19Å; R488-I491 PolarHBondContact O-N 3Å; I491-T493 VanDerWaalsContact C-N 3.33Å; I491-T493 PolarHBondContact O-N 2.92Å; I491-E494 PolarHBondContact O-N 3.31Å; I491-N495 WeakPolarHBondContact O-CB 3.45Å; I491-N495 VanDerWaalsContact O-CG 3.31Å; I491-N495 PolarHBondContact O-N 3Å; I491-N495 PolarHBondContact O-ND2 3.08Å; I491-E570 VanDerWaalsContact CD1-OE1 3.31Å; I491-E570 WeakPolarHBondContact CD1-OE1 3.39Å
492	E	47.8	Very low	52	Low	89 Å²	89	100 Å²	100	42%	0.416	47%	0.468	S	S	.	.	H	α-helix	trans	-60.4	-42.8	176.1	-74.1	176.5	179.9	0	0	111.3	R488 N495 M496	R488-E492 HydrophobicContact CG-CG 4.45Å; R488-E492 IonicContact CZ-OE1 3.91Å; R488-E492 IonicContact NE-OE1 2.77Å; R488-E492 PolarHBondContact NE-OE1 3Å; R488-E492 IonicContact NH2-OE1 3.97Å; R488-E492 PolarHBondContact NH2-OE1 3.24Å; R488-E492 WeakPolarHBondContact O-CG 3.31Å; R488-E492 PolarHBondContact O-N 3.46Å; E492-N495 PolarHBondContact O-N 3.21Å; E492-M496 WeakPolarHBondContact O-CG 3.19Å; E492-M496 PolarHBondContact O-N 3Å
493	T	55.3	Low	52.7	Low	55 Å²	55	104.1 Å²	104.1	34%	0.337	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-43.5	177	-55.1	0	0	0	0	112	F489 A490 I491 N495 M496 N497	F489-T493 WeakPolarHBondContact O-CB 3.49Å; F489-T493 PolarHBondContact O-N 3.01Å; F489-T493 PolarHBondContact O-OG1 3.45Å; A490-T493 PolarHBondContact O-N 3.34Å; I491-T493 VanDerWaalsContact C-N 3.33Å; I491-T493 PolarHBondContact O-N 2.92Å; T493-N495 VanDerWaalsContact C-N 3.34Å; T493-N495 PolarHBondContact O-N 3.29Å; T493-M496 PolarHBondContact O-N 3.18Å; T493-N497 VanDerWaalsContact O-CG 3.31Å; T493-N497 PolarHBondContact O-N 3.03Å; T493-N497 PolarHBondContact O-ND2 3.01Å
494	E	54.4	Low	53.4	Low	104 Å²	104	104.6 Å²	104.6	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-61.6	-42.8	176.4	-172.1	-179	167.5	0	0	111.5	A490 I491 M496 N497 R498	A490-E494 WeakPolarHBondContact O-CB 3.44Å; A490-E494 PolarHBondContact O-N 3.28Å; I491-E494 PolarHBondContact O-N 3.31Å; E494-M496 PolarHBondContact O-N 2.83Å; E494-N497 PolarHBondContact O-N 2.87Å; E494-R498 VanDerWaalsContact O-CG 3.31Å; E494-R498 WeakPolarHBondContact O-CG 3.43Å; E494-R498 PolarHBondContact O-N 3.04Å
495	N	50.6	Low	54.2	Low	83 Å²	83	104.5 Å²	104.5	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-41.2	178	-74.7	-26	0	0	0	112.4	I491 E492 T493 R498 L499	I491-N495 WeakPolarHBondContact O-CB 3.45Å; I491-N495 VanDerWaalsContact O-CG 3.31Å; I491-N495 PolarHBondContact O-N 3Å; I491-N495 PolarHBondContact O-ND2 3.08Å; E492-N495 PolarHBondContact O-N 3.21Å; T493-N495 VanDerWaalsContact C-N 3.34Å; T493-N495 PolarHBondContact O-N 3.29Å; N495-R498 PolarHBondContact O-N 3.38Å; N495-L499 PolarHBondContact O-N 3.39Å
496	M	54.5	Low	54.7	Low	126 Å²	126	109 Å²	109	62%	0.621	49%	0.492	S	S	*	.	H	α-helix	trans	-62.1	-44.3	174.2	-74.3	-61.4	-67.3	0	0	112	E492 T493 E494 R498 L499 E500	E492-M496 WeakPolarHBondContact O-CG 3.19Å; E492-M496 PolarHBondContact O-N 3Å; T493-M496 PolarHBondContact O-N 3.18Å; E494-M496 PolarHBondContact O-N 2.83Å; M496-R498 VanDerWaalsContact C-N 3.34Å; M496-R498 PolarHBondContact O-N 2.93Å; M496-L499 PolarHBondContact O-N 3.21Å; M496-E500 PolarHBondContact O-N 3.1Å
497	N	56.2	Low	55	Low	82 Å²	82	107.9 Å²	107.9	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-40.7	176.6	-71.6	-23.2	0	0	0	112.1	T493 E494 E500 F501	T493-N497 VanDerWaalsContact O-CG 3.31Å; T493-N497 PolarHBondContact O-N 3.03Å; T493-N497 PolarHBondContact O-ND2 3.01Å; E494-N497 PolarHBondContact O-N 2.87Å; N497-E500 PolarHBondContact O-N 3.49Å; N497-F501 WeakPolarHBondContact O-CB 3.45Å; N497-F501 PolarHBondContact O-N 3.06Å
498	R	55.5	Low	55.9	Low	92 Å²	92	107.6 Å²	107.6	35%	0.347	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-44.9	175.3	-71.2	173.5	104.3	-175.7	2.3	111	T402 E494 N495 M496 F501 W502	T402-R498 PolarHBondContact OG1-NH2 3.47Å; E494-R498 VanDerWaalsContact O-CG 3.31Å; E494-R498 WeakPolarHBondContact O-CG 3.43Å; E494-R498 PolarHBondContact O-N 3.04Å; N495-R498 PolarHBondContact O-N 3.38Å; M496-R498 VanDerWaalsContact C-N 3.34Å; M496-R498 PolarHBondContact O-N 2.93Å; R498-F501 PolarHBondContact O-N 3.09Å; R498-W502 PolarHBondContact O-N 3.43Å
499	L	54.5	Low	56.5	Low	116 Å²	116	108.3 Å²	108.3	61%	0.607	50%	0.497	S	S	*	.	H	α-helix	trans	-61.3	-44.7	178.1	-171.9	72.8	0	0	0	111.8	N495 M496 F501 W502 K503	N495-L499 PolarHBondContact O-N 3.39Å; M496-L499 PolarHBondContact O-N 3.21Å; L499-F501 VanDerWaalsContact C-N 3.33Å; L499-F501 PolarHBondContact O-N 3.33Å; L499-W502 PolarHBondContact O-N 3.28Å; L499-K503 PolarHBondContact O-N 3.24Å
500	E	59.5	Low	56.8	Low	75 Å²	75	105 Å²	105	35%	0.35	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-40.3	178.7	-151.7	-148	149.7	0	0	111.7	M496 N497 K503 R504	M496-E500 PolarHBondContact O-N 3.1Å; N497-E500 PolarHBondContact O-N 3.49Å; E500-K503 WeakPolarHBondContact O-CB 3.19Å; E500-K503 PolarHBondContact O-N 2.89Å; E500-R504 WeakPolarHBondContact O-CG 3.41Å; E500-R504 PolarHBondContact O-N 3.26Å; E500-R504 IonicContact OE1-CZ 3.94Å; E500-R504 VanDerWaalsContact OE1-CZ 3.28Å; E500-R504 IonicContact OE1-NE 3.28Å; E500-R504 PolarHBondContact OE1-NE 3.31Å; E500-R504 VanDerWaalsContact OE1-NE 3.08Å; E500-R504 IonicContact OE1-NH2 3.75Å; E500-R504 PolarHBondContact OE1-NH2 3.37Å; E500-R504 IonicContact OE2-NH2 3.45Å
501	F	59.5	Low	57.1	Low	99 Å²	99	104.7 Å²	104.7	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-47.3	174.2	179.2	-99.9	0	0	0	112.2	N497 R498 L499 K503 R504 L505	N497-F501 WeakPolarHBondContact O-CB 3.45Å; N497-F501 PolarHBondContact O-N 3.06Å; R498-F501 PolarHBondContact O-N 3.09Å; L499-F501 VanDerWaalsContact C-N 3.33Å; L499-F501 PolarHBondContact O-N 3.33Å; F501-K503 VanDerWaalsContact C-N 3.29Å; F501-K503 PolarHBondContact O-N 3.4Å; F501-R504 PolarHBondContact O-N 3.45Å; F501-L505 HydrophobicContact CD1-CD1 4.24Å; F501-L505 HydrophobicContact CE1-CD1 3.43Å; F501-L505 VanDerWaalsContact CE1-CD1 3.43Å; F501-L505 HydrophobicContact CE2-CD1 4.47Å; F501-L505 HydrophobicContact CZ-CD1 3.57Å; F501-L505 PolarHBondContact O-N 3.04Å
502	W	54.8	Low	57.6	Low	158 Å²	158	106.6 Å²	106.6	60%	0.598	49%	0.494	S	S	*	.	H	α-helix	trans	-58.2	-42	175.6	-79.7	112.3	0	0	0	111.9	R498 L499 L505 Y506	R498-W502 PolarHBondContact O-N 3.43Å; L499-W502 PolarHBondContact O-N 3.28Å; W502-L505 PolarHBondContact O-N 3.5Å; W502-Y506 WeakPolarHBondContact O-CB 3.15Å; W502-Y506 PolarHBondContact O-N 3.44Å
503	K	62.9	Low	58.1	Low	141 Å²	141	107 Å²	107	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-59.8	-46.7	175.7	-172.3	-179.8	179	-178.4	0	111.8	L499 E500 F501 L505 Y506 L507	L499-K503 PolarHBondContact O-N 3.24Å; E500-K503 WeakPolarHBondContact O-CB 3.19Å; E500-K503 PolarHBondContact O-N 2.89Å; F501-K503 VanDerWaalsContact C-N 3.29Å; F501-K503 PolarHBondContact O-N 3.4Å; K503-L505 PolarHBondContact O-N 3.35Å; K503-Y506 PolarHBondContact O-N 3.48Å; K503-L507 HydrophobicContact CG-CD1 4.31Å; K503-L507 WeakPolarHBondContact O-CG 3.3Å; K503-L507 PolarHBondContact O-N 3.42Å
504	R	63.6	Low	58.1	Low	141 Å²	141	109.8 Å²	109.8	53%	0.532	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-41.6	177.2	-70.3	-179.4	-172.5	-163.7	1.8	112	E500 F501 L507 K508	E500-R504 WeakPolarHBondContact O-CG 3.41Å; E500-R504 PolarHBondContact O-N 3.26Å; E500-R504 IonicContact OE1-CZ 3.94Å; E500-R504 VanDerWaalsContact OE1-CZ 3.28Å; E500-R504 IonicContact OE1-NE 3.28Å; E500-R504 PolarHBondContact OE1-NE 3.31Å; E500-R504 VanDerWaalsContact OE1-NE 3.08Å; E500-R504 IonicContact OE1-NH2 3.75Å; E500-R504 PolarHBondContact OE1-NH2 3.37Å; E500-R504 IonicContact OE2-NH2 3.45Å; F501-R504 PolarHBondContact O-N 3.45Å; R504-L507 PolarHBondContact O-N 3.01Å; R504-K508 WeakPolarHBondContact O-CB 3.36Å; R504-K508 PolarHBondContact O-N 3.41Å
505	L	63.1	Low	58.1	Low	79 Å²	79	111.4 Å²	111.4	41%	0.414	53%	0.525	S	S	.	.	H	α-helix	trans	-65.9	-41	180	-139.1	152.6	0	0	0	111.4	F501 W502 K503 K508 R509	F501-L505 HydrophobicContact CD1-CD1 4.24Å; F501-L505 HydrophobicContact CE1-CD1 3.43Å; F501-L505 VanDerWaalsContact CE1-CD1 3.43Å; F501-L505 HydrophobicContact CE2-CD1 4.47Å; F501-L505 HydrophobicContact CZ-CD1 3.57Å; F501-L505 PolarHBondContact O-N 3.04Å; W502-L505 PolarHBondContact O-N 3.5Å; K503-L505 PolarHBondContact O-N 3.35Å; L505-K508 PolarHBondContact O-N 2.98Å; L505-R509 WeakPolarHBondContact O-CB 3.47Å; L505-R509 PolarHBondContact O-N 3.42Å
506	Y	59.1	Low	58.5	Low	164 Å²	164	108.6 Å²	108.6	64%	0.643	51%	0.512	S	S	*	.	H	α-helix	trans	-63.8	-46.3	175.2	-161.2	-100.6	0	0	0	111.9	W502 K503 K508 R509 I510	W502-Y506 WeakPolarHBondContact O-CB 3.15Å; W502-Y506 PolarHBondContact O-N 3.44Å; K503-Y506 PolarHBondContact O-N 3.48Å; Y506-K508 PolarHBondContact O-N 3.39Å; Y506-R509 PolarHBondContact O-N 3Å; Y506-I510 HydrophobicContact CD1-CD1 3.59Å; Y506-I510 HydrophobicContact CD1-CG1 4.37Å; Y506-I510 HydrophobicContact CE1-CD1 3.46Å; Y506-I510 VanDerWaalsContact CE1-CD1 3.46Å; Y506-I510 HydrophobicContact CE1-CG1 4.27Å; Y506-I510 WeakPolarHBondContact O-CG1 3.27Å; Y506-I510 PolarHBondContact O-N 2.96Å
507	L	60.4	Low	58.8	Low	103 Å²	103	107.7 Å²	107.7	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-59.6	-42.6	175.1	-74.2	167.8	0	0	0	112.3	K503 R504 R509 I510 S511	K503-L507 HydrophobicContact CG-CD1 4.31Å; K503-L507 WeakPolarHBondContact O-CG 3.3Å; K503-L507 PolarHBondContact O-N 3.42Å; R504-L507 PolarHBondContact O-N 3.01Å; L507-R509 VanDerWaalsContact C-N 3.35Å; L507-R509 PolarHBondContact O-N 2.85Å; L507-I510 PolarHBondContact O-N 3.19Å; L507-S511 PolarHBondContact O-N 2.95Å
508	K	65	Low	58.9	Low	149 Å²	149	110.8 Å²	110.8	65%	0.648	53%	0.527	S	S	*	.	H	α-helix	trans	-66.5	-35.1	177	-169.6	175.3	-178	177.7	0	112.5	R504 L505 Y506 S511 T512	R504-K508 WeakPolarHBondContact O-CB 3.36Å; R504-K508 PolarHBondContact O-N 3.41Å; L505-K508 PolarHBondContact O-N 2.98Å; Y506-K508 PolarHBondContact O-N 3.39Å; K508-S511 PolarHBondContact O-OG 2.94Å; K508-T512 WeakPolarHBondContact O-CB 3.44Å; K508-T512 WeakPolarHBondContact O-CG2 3.37Å; K508-T512 PolarHBondContact O-N 2.94Å; K508-T512 PolarHBondContact O-OG1 3.03Å
509	R	58.6	Low	59.1	Low	176 Å²	176	110 Å²	110	66%	0.664	53%	0.529	S	S	*	.	H	α-helix	trans	-69.9	-40.4	176.2	-160.8	171.9	-176.3	178.1	-0.9	111.4	L505 Y506 L507 T512 V513	L505-R509 WeakPolarHBondContact O-CB 3.47Å; L505-R509 PolarHBondContact O-N 3.42Å; Y506-R509 PolarHBondContact O-N 3Å; L507-R509 VanDerWaalsContact C-N 3.35Å; L507-R509 PolarHBondContact O-N 2.85Å; R509-T512 WeakPolarHBondContact CA-OG1 3.37Å; R509-T512 PolarHBondContact O-OG1 3.48Å; R509-T512 VanDerWaalsContact O-OG1 3.04Å; R509-V513 VanDerWaalsContact O-CG2 3.26Å; R509-V513 WeakPolarHBondContact O-CG2 3.24Å; R509-V513 PolarHBondContact O-N 3.34Å; R509-V513 VanDerWaalsContact O-N 3.09Å
510	I	57.6	Low	59.6	Low	73 Å²	73	112.5 Å²	112.5	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-48.1	173.5	-70.5	169.7	0	0	0	110.8	Y506 L507 T512 V513 L514	Y506-I510 HydrophobicContact CD1-CD1 3.59Å; Y506-I510 HydrophobicContact CD1-CG1 4.37Å; Y506-I510 HydrophobicContact CE1-CD1 3.46Å; Y506-I510 VanDerWaalsContact CE1-CD1 3.46Å; Y506-I510 HydrophobicContact CE1-CG1 4.27Å; Y506-I510 WeakPolarHBondContact O-CG1 3.27Å; Y506-I510 PolarHBondContact O-N 2.96Å; L507-I510 PolarHBondContact O-N 3.19Å; I510-T512 PolarHBondContact O-N 3.44Å; I510-V513 PolarHBondContact O-N 3.33Å; I510-L514 HydrophobicContact CG2-CD1 3.55Å; I510-L514 HydrophobicContact CG2-CG 4.31Å; I510-L514 WeakPolarHBondContact O-CB 3.45Å; I510-L514 WeakPolarHBondContact O-CG 3.33Å; I510-L514 PolarHBondContact O-N 3.4Å
511	S	57.3	Low	60.1	Low	50 Å²	50	111.9 Å²	111.9	35%	0.35	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-41.6	-178.3	70.7	0	0	0	0	112.4	L507 K508 I515	L507-S511 PolarHBondContact O-N 2.95Å; K508-S511 PolarHBondContact O-OG 2.94Å; S511-I515 WeakPolarHBondContact O-CB 3.29Å; S511-I515 WeakPolarHBondContact O-CD1 3.38Å; S511-I515 WeakPolarHBondContact O-CG1 3.44Å; S511-I515 PolarHBondContact O-N 2.7Å
512	T	59.4	Low	60.6	Low	83 Å²	83	111 Å²	111	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-66.3	-37.1	177.5	42.5	0	0	0	0	113.1	K508 R509 I510 S516	K508-T512 WeakPolarHBondContact O-CB 3.44Å; K508-T512 WeakPolarHBondContact O-CG2 3.37Å; K508-T512 PolarHBondContact O-N 2.94Å; K508-T512 PolarHBondContact O-OG1 3.03Å; R509-T512 WeakPolarHBondContact CA-OG1 3.37Å; R509-T512 PolarHBondContact O-OG1 3.48Å; R509-T512 VanDerWaalsContact O-OG1 3.04Å; I510-T512 PolarHBondContact O-N 3.44Å; T512-S516 WeakPolarHBondContact O-CB 3.37Å; T512-S516 PolarHBondContact O-N 3.3Å
513	V	57.9	Low	61.4	Low	97 Å²	97	108.5 Å²	108.5	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-71.9	-45.1	177.1	174.2	0	0	0	0	111.5	R509 I510	R509-V513 VanDerWaalsContact O-CG2 3.26Å; R509-V513 WeakPolarHBondContact O-CG2 3.24Å; R509-V513 PolarHBondContact O-N 3.34Å; R509-V513 VanDerWaalsContact O-N 3.09Å; I510-V513 PolarHBondContact O-N 3.33Å
514	L	54.9	Low	62	Low	115 Å²	115	107.6 Å²	107.6	60%	0.602	54%	0.535	S	S	*	.	H	α-helix	trans	-73	-30.5	-177.9	-70	174.2	0	0	0	113.6	I510 L519	I510-L514 HydrophobicContact CG2-CD1 3.55Å; I510-L514 HydrophobicContact CG2-CG 4.31Å; I510-L514 WeakPolarHBondContact O-CB 3.45Å; I510-L514 WeakPolarHBondContact O-CG 3.33Å; I510-L514 PolarHBondContact O-N 3.4Å; L514-L519 WeakPolarHBondContact O-CD2 3.47Å
515	I	55.9	Low	62.7	Low	137 Å²	137	105 Å²	105	70%	0.703	53%	0.532	S	S	*	.	H	α-helix	trans	-95.1	-4.3	-177.6	-55.5	169.1	0	0	0	111.7	S511	S511-I515 WeakPolarHBondContact O-CB 3.29Å; S511-I515 WeakPolarHBondContact O-CD1 3.38Å; S511-I515 WeakPolarHBondContact O-CG1 3.44Å; S511-I515 PolarHBondContact O-N 2.7Å
516	S	58.2	Low	63.3	Low	25 Å²	25	103.3 Å²	103.3	18%	0.175	53%	0.525	C	S	.	.			trans	-57	131.8	-177	176.7	0	0	0	0	112.3	T512 Q518 L519	T512-S516 WeakPolarHBondContact O-CB 3.37Å; T512-S516 PolarHBondContact O-N 3.3Å; S516-Q518 PolarHBondContact O-N 3.08Å; S516-Q518 VanDerWaalsContact OG-CB 3.29Å; S516-Q518 WeakPolarHBondContact OG-CB 3.4Å; S516-Q518 WeakPolarHBondContact OG-CG 3.47Å; S516-Q518 PolarHBondContact OG-N 3.38Å; S516-Q518 VanDerWaalsContact OG-N 3.14Å; S516-L519 WeakPolarHBondContact O-CB 3.44Å; S516-L519 PolarHBondContact O-N 3.32Å
517	P	60.2	Low	64.1	Low	106 Å²	106	100 Å²	100	69%	0.688	53%	0.525	S	S	*	.	H	α-helix	trans	-54.7	-24.9	169.9	-22.5	31.4	0	0	0	113.1	L519 K520 S521	P517-L519 VanDerWaalsContact C-N 3.28Å; P517-L519 PolarHBondContact O-N 3.16Å; P517-K520 PolarHBondContact O-N 3.38Å; P517-S521 PolarHBondContact O-N 3.26Å
518	Q	59.5	Low	65.1	Low	147 Å²	147	101.3 Å²	101.3	69%	0.687	53%	0.529	S	S	*	.	H	α-helix	trans	-64.2	-33.6	176.2	-59.5	176.2	-14.2	0	0	111.5	S516 K520 S521 V522	S516-Q518 PolarHBondContact O-N 3.08Å; S516-Q518 VanDerWaalsContact OG-CB 3.29Å; S516-Q518 WeakPolarHBondContact OG-CB 3.4Å; S516-Q518 WeakPolarHBondContact OG-CG 3.47Å; S516-Q518 PolarHBondContact OG-N 3.38Å; S516-Q518 VanDerWaalsContact OG-N 3.14Å; Q518-K520 PolarHBondContact O-N 3.04Å; Q518-S521 WeakPolarHBondContact O-CB 3.34Å; Q518-S521 PolarHBondContact O-N 2.84Å; Q518-V522 VanDerWaalsContact O-CG2 3.29Å; Q518-V522 WeakPolarHBondContact O-CG2 3.44Å; Q518-V522 PolarHBondContact O-N 3.26Å
519	L	59.5	Low	66	Low	76 Å²	76	97.6 Å²	97.6	40%	0.398	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-43	176.6	-170.9	70.5	0	0	0	110.8	L514 S516 P517 S521 V522 I523	L514-L519 WeakPolarHBondContact O-CD2 3.47Å; S516-L519 WeakPolarHBondContact O-CB 3.44Å; S516-L519 PolarHBondContact O-N 3.32Å; P517-L519 VanDerWaalsContact C-N 3.28Å; P517-L519 PolarHBondContact O-N 3.16Å; L519-S521 VanDerWaalsContact C-N 3.32Å; L519-S521 PolarHBondContact O-N 3.34Å; L519-V522 PolarHBondContact O-N 2.94Å; L519-I523 HydrophobicContact CD2-CD1 4.45Å; L519-I523 HydrophobicContact CG-CD1 3.96Å; L519-I523 HydrophobicContact CG-CG1 4.49Å; L519-I523 WeakPolarHBondContact O-CB 3.47Å; L519-I523 VanDerWaalsContact O-CG1 3.23Å; L519-I523 WeakPolarHBondContact O-CG1 3.37Å; L519-I523 PolarHBondContact O-N 3.48Å
520	K	65.1	Low	67.3	Low	168 Å²	168	93 Å²	93	73%	0.73	50%	0.504	S	S	*	.	H	α-helix	trans	-60.5	-41.6	174.7	-70.8	-174	178.6	-178.9	0	112.2	P517 Q518 K524	P517-K520 PolarHBondContact O-N 3.38Å; Q518-K520 PolarHBondContact O-N 3.04Å; K520-K524 WeakPolarHBondContact O-CB 3.31Å; K520-K524 PolarHBondContact O-N 3.16Å
521	S	70.2	Confident	68.4	Low	62 Å²	62	95.9 Å²	95.9	43%	0.434	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-44.2	176.1	-178.1	0	0	0	0	111.8	P517 Q518 L519 K524 N525	P517-S521 PolarHBondContact O-N 3.26Å; Q518-S521 WeakPolarHBondContact O-CB 3.34Å; Q518-S521 PolarHBondContact O-N 2.84Å; L519-S521 VanDerWaalsContact C-N 3.32Å; L519-S521 PolarHBondContact O-N 3.34Å; S521-K524 PolarHBondContact O-N 3.26Å; S521-N525 WeakPolarHBondContact O-CB 3.42Å; S521-N525 PolarHBondContact O-N 2.87Å; S521-N525 PolarHBondContact O-ND2 3.16Å; S521-N525 PolarHBondContact O-OD1 3.38Å
522	V	68.3	Low	69.6	Low	82 Å²	82	98.9 Å²	98.9	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-63.9	-45.9	176.6	173.2	0	0	0	0	111	Q518 L519 K524 N525 V526	Q518-V522 VanDerWaalsContact O-CG2 3.29Å; Q518-V522 WeakPolarHBondContact O-CG2 3.44Å; Q518-V522 PolarHBondContact O-N 3.26Å; L519-V522 PolarHBondContact O-N 2.94Å; V522-K524 VanDerWaalsContact C-N 3.29Å; V522-K524 PolarHBondContact O-N 3.39Å; V522-N525 PolarHBondContact O-N 3.46Å; V522-V526 HydrophobicContact CG1-CG2 4.22Å; V522-V526 WeakPolarHBondContact O-CB 3.25Å; V522-V526 VanDerWaalsContact O-CG2 3.22Å; V522-V526 WeakPolarHBondContact O-CG2 3.44Å; V522-V526 PolarHBondContact O-N 3.3Å
523	I	71.8	Confident	70.7	Confident	105 Å²	105	99 Å²	99	54%	0.538	53%	0.525	S	S	.	.	H	α-helix	trans	-57.5	-44.5	176.3	-69.4	165.3	0	0	0	110.6	L519 V526 S527	L519-I523 HydrophobicContact CD2-CD1 4.45Å; L519-I523 HydrophobicContact CG-CD1 3.96Å; L519-I523 HydrophobicContact CG-CG1 4.49Å; L519-I523 WeakPolarHBondContact O-CB 3.47Å; L519-I523 VanDerWaalsContact O-CG1 3.23Å; L519-I523 WeakPolarHBondContact O-CG1 3.37Å; L519-I523 PolarHBondContact O-N 3.48Å; I523-V526 PolarHBondContact O-N 3.06Å; I523-S527 PolarHBondContact O-N 2.94Å
524	K	76.2	Confident	71.7	Confident	122 Å²	122	97.7 Å²	97.7	53%	0.53	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-49.1	177	-173.7	-179.8	173.3	-176.1	0	111.8	K520 S521 V522 V526 S527 E528	K520-K524 WeakPolarHBondContact O-CB 3.31Å; K520-K524 PolarHBondContact O-N 3.16Å; S521-K524 PolarHBondContact O-N 3.26Å; V522-K524 VanDerWaalsContact C-N 3.29Å; V522-K524 PolarHBondContact O-N 3.39Å; K524-V526 VanDerWaalsContact C-N 3.29Å; K524-V526 PolarHBondContact O-N 2.88Å; K524-S527 PolarHBondContact O-N 3.29Å; K524-S527 VanDerWaalsContact O-N 3.1Å; K524-S527 PolarHBondContact O-OG 2.84Å; K524-E528 WeakPolarHBondContact CE-OE1 3.44Å; K524-E528 IonicContact NZ-OE1 2.7Å; K524-E528 PolarHBondContact O-N 2.91Å
525	N	78.3	Confident	73	Confident	87 Å²	87	97.2 Å²	97.2	47%	0.465	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-39.7	178.6	-68.9	-13.1	0	0	0	111.7	S521 V522 S527 E528 M529	S521-N525 WeakPolarHBondContact O-CB 3.42Å; S521-N525 PolarHBondContact O-N 2.87Å; S521-N525 PolarHBondContact O-ND2 3.16Å; S521-N525 PolarHBondContact O-OD1 3.38Å; V522-N525 PolarHBondContact O-N 3.46Å; N525-S527 VanDerWaalsContact C-N 3.34Å; N525-E528 PolarHBondContact O-N 3.47Å; N525-M529 WeakPolarHBondContact O-CG 3.36Å; N525-M529 PolarHBondContact O-N 3.25Å
526	V	75.1	Confident	74.3	Confident	43 Å²	43	98 Å²	98	26%	0.261	51%	0.507	S	S	.	.	H	α-helix	trans	-64.7	-37.9	175.9	169.1	0	0	0	0	111.4	V522 I523 K524 E528 M529 H534	V522-V526 HydrophobicContact CG1-CG2 4.22Å; V522-V526 WeakPolarHBondContact O-CB 3.25Å; V522-V526 VanDerWaalsContact O-CG2 3.22Å; V522-V526 WeakPolarHBondContact O-CG2 3.44Å; V522-V526 PolarHBondContact O-N 3.3Å; I523-V526 PolarHBondContact O-N 3.06Å; K524-V526 VanDerWaalsContact C-N 3.29Å; K524-V526 PolarHBondContact O-N 2.88Å; V526-E528 VanDerWaalsContact C-N 3.27Å; V526-E528 PolarHBondContact O-N 3.06Å; V526-M529 PolarHBondContact O-N 3.45Å; V526-H534 WeakPolarHBondContact CG1-NE2 3.42Å
527	S	76.3	Confident	75.3	Confident	93 Å²	93	98.8 Å²	98.8	65%	0.65	51%	0.513	S	S	*	.	H	α-helix	trans	-68.6	-22.9	176.5	71.5	0	0	0	0	114.3	I523 K524 N525	I523-S527 PolarHBondContact O-N 2.94Å; K524-S527 PolarHBondContact O-N 3.29Å; K524-S527 VanDerWaalsContact O-N 3.1Å; K524-S527 PolarHBondContact O-OG 2.84Å; N525-S527 VanDerWaalsContact C-N 3.34Å
528	E	82.8	Confident	76.2	Confident	132 Å²	132	97.3 Å²	97.3	62%	0.617	50%	0.498	S	S	*	.	H	α-helix	trans	-92	-8.3	179.2	-68.3	176.4	-173.8	0	0	113	K524 N525 V526	K524-E528 WeakPolarHBondContact CE-OE1 3.44Å; K524-E528 IonicContact NZ-OE1 2.7Å; K524-E528 PolarHBondContact O-N 2.91Å; N525-E528 PolarHBondContact O-N 3.47Å; V526-E528 VanDerWaalsContact C-N 3.27Å; V526-E528 PolarHBondContact O-N 3.06Å
529	M	83.6	Confident	77.2	Confident	70 Å²	70	92.9 Å²	92.9	35%	0.345	49%	0.487	S	S	.	.	S	Bend	trans	-73.3	143.9	-178.5	-81.4	175.9	150.6	0	0	112.8	N525 V526 E533 H534 C537	N525-M529 WeakPolarHBondContact O-CG 3.36Å; N525-M529 PolarHBondContact O-N 3.25Å; V526-M529 PolarHBondContact O-N 3.45Å; M529-E533 HydrophobicContact CB-CB 3.92Å; M529-E533 HydrophobicContact CE-CB 4.31Å; M529-E533 HydrophobicContact CG-CB 3.92Å; M529-E533 HydrophobicContact SD-CB 4.28Å; M529-H534 HydrophobicContact CB-CB 4.47Å; M529-C537 HydrophobicContact CE-CB 4.22Å; M529-C537 HydrophobicContact SD-CB 3.97Å
530	N	85	Confident	78.2	Confident	81 Å²	81	90.9 Å²	90.9	43%	0.433	49%	0.485	S	S	.	.			trans	-71.1	163.6	166.6	65.3	50.5	0	0	0	111.3	I532 E533 H534	N530-I532 PolarHBondContact O-N 3.08Å; N530-I532 VanDerWaalsContact O-N 3.13Å; N530-I532 PolarHBondContact OD1-N 2.77Å; N530-E533 VanDerWaalsContact CG-CD 3.47Å; N530-E533 PolarHBondContact N-OE2 3.2Å; N530-E533 PolarHBondContact ND2-OE1 3.05Å; N530-E533 PolarHBondContact ND2-OE2 3.23Å; N530-E533 PolarHBondContact O-N 2.99Å; N530-E533 VanDerWaalsContact O-N 3.12Å; N530-E533 WeakPolarHBondContact OD1-CB 3.35Å; N530-E533 VanDerWaalsContact OD1-CG 3.32Å; N530-E533 WeakPolarHBondContact OD1-CG 3.49Å; N530-E533 PolarHBondContact OD1-N 2.96Å; N530-H534 WeakPolarHBondContact O-CB 3.31Å; N530-H534 PolarHBondContact O-N 2.93Å
531	L	81.8	Confident	78.8	Confident	132 Å²	132	86.5 Å²	86.5	69%	0.691	47%	0.472	S	S	*	.	H	α-helix	trans	-54.3	-37.7	-176.4	-177.2	66.7	0	0	0	113.3	H534 L535	L531-H534 PolarHBondContact O-N 3.39Å; L531-L535 HydrophobicContact CG-CD1 4.41Å; L531-L535 WeakPolarHBondContact O-CG 3.31Å; L531-L535 PolarHBondContact O-N 2.92Å
532	I	82.5	Confident	79.1	Confident	113 Å²	113	87.8 Å²	87.8	58%	0.579	48%	0.477	S	S	*	.	H	α-helix	trans	-71	-43	-179	-63.3	174.2	0	0	0	110.8	N530 H534 L535 K536	N530-I532 PolarHBondContact O-N 3.08Å; N530-I532 VanDerWaalsContact O-N 3.13Å; N530-I532 PolarHBondContact OD1-N 2.77Å; I532-H534 VanDerWaalsContact C-N 3.33Å; I532-L535 PolarHBondContact O-N 2.89Å; I532-K536 WeakPolarHBondContact O-CG 3.47Å; I532-K536 PolarHBondContact O-N 3.35Å
533	E	82.4	Confident	79.6	Confident	87 Å²	87	90.6 Å²	90.6	41%	0.407	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-40.3	174.1	-76.2	163.6	-169.6	0	0	111.4	M529 N530 K536 C537	M529-E533 HydrophobicContact CB-CB 3.92Å; M529-E533 HydrophobicContact CE-CB 4.31Å; M529-E533 HydrophobicContact CG-CB 3.92Å; M529-E533 HydrophobicContact SD-CB 4.28Å; N530-E533 VanDerWaalsContact CG-CD 3.47Å; N530-E533 PolarHBondContact N-OE2 3.2Å; N530-E533 PolarHBondContact ND2-OE1 3.05Å; N530-E533 PolarHBondContact ND2-OE2 3.23Å; N530-E533 PolarHBondContact O-N 2.99Å; N530-E533 VanDerWaalsContact O-N 3.12Å; N530-E533 WeakPolarHBondContact OD1-CB 3.35Å; N530-E533 VanDerWaalsContact OD1-CG 3.32Å; N530-E533 WeakPolarHBondContact OD1-CG 3.49Å; N530-E533 PolarHBondContact OD1-N 2.96Å; E533-K536 PolarHBondContact O-N 3.4Å; E533-C537 WeakPolarHBondContact O-CB 3.48Å; E533-C537 PolarHBondContact O-N 3.44Å
534	H	78.5	Confident	79.9	Confident	69 Å²	69	91.2 Å²	91.2	32%	0.319	49%	0.489	S	S	.	.	H	α-helix	trans	-62.6	-46.5	176.7	-166.5	-137	0	0	0	111.4	V526 M529 N530 L531 I532 K536 C537 I538	V526-H534 WeakPolarHBondContact CG1-NE2 3.42Å; M529-H534 HydrophobicContact CB-CB 4.47Å; N530-H534 WeakPolarHBondContact O-CB 3.31Å; N530-H534 PolarHBondContact O-N 2.93Å; L531-H534 PolarHBondContact O-N 3.39Å; I532-H534 VanDerWaalsContact C-N 3.33Å; H534-K536 PolarHBondContact O-N 3.21Å; H534-C537 WeakPolarHBondContact O-CB 3.45Å; H534-C537 PolarHBondContact O-N 3.4Å; H534-I538 WeakPolarHBondContact O-CG1 3.38Å; H534-I538 PolarHBondContact O-N 2.91Å
535	L	81.5	Confident	80	Confident	105 Å²	105	93.8 Å²	93.8	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-39.5	175.3	-73.1	170.7	0	0	0	112.7	L531 I532 I538 A539	L531-L535 HydrophobicContact CG-CD1 4.41Å; L531-L535 WeakPolarHBondContact O-CG 3.31Å; L531-L535 PolarHBondContact O-N 2.92Å; I532-L535 PolarHBondContact O-N 2.89Å; L535-I538 PolarHBondContact O-N 3.47Å; L535-A539 WeakPolarHBondContact O-CB 3.47Å; L535-A539 PolarHBondContact O-N 2.95Å
536	K	83	Confident	80	Confident	152 Å²	152	94.4 Å²	94.4	66%	0.661	50%	0.496	S	S	*	.	H	α-helix	trans	-65.7	-39.9	174	-75	178.4	-179.1	178.1	0	112.1	I532 E533 H534 A539 G540	I532-K536 WeakPolarHBondContact O-CG 3.47Å; I532-K536 PolarHBondContact O-N 3.35Å; E533-K536 PolarHBondContact O-N 3.4Å; H534-K536 PolarHBondContact O-N 3.21Å; K536-A539 PolarHBondContact O-N 2.86Å; K536-G540 PolarHBondContact O-N 2.99Å
537	C	80.6	Confident	80.3	Confident	42 Å²	42	95.6 Å²	95.6	28%	0.284	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-48.4	175.7	-172.2	0	0	0	0	110.7	M529 E533 H534 A539 G540 T541	M529-C537 HydrophobicContact CE-CB 4.22Å; M529-C537 HydrophobicContact SD-CB 3.97Å; E533-C537 WeakPolarHBondContact O-CB 3.48Å; E533-C537 PolarHBondContact O-N 3.44Å; H534-C537 WeakPolarHBondContact O-CB 3.45Å; H534-C537 PolarHBondContact O-N 3.4Å; C537-A539 PolarHBondContact O-N 2.99Å; C537-G540 PolarHBondContact O-N 3.33Å; C537-T541 PolarHBondContact O-N 2.94Å; C537-T541 PolarHBondContact O-OG1 3.44Å
538	I	79.3	Confident	80.2	Confident	75 Å²	75	94.5 Å²	94.5	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-46.3	176.4	-67.5	167.2	0	0	0	111.2	H534 L535 G540 T541 V542	H534-I538 WeakPolarHBondContact O-CG1 3.38Å; H534-I538 PolarHBondContact O-N 2.91Å; L535-I538 PolarHBondContact O-N 3.47Å; I538-G540 VanDerWaalsContact C-N 3.31Å; I538-G540 PolarHBondContact O-N 3.34Å; I538-T541 VanDerWaalsContact CA-OG1 3.3Å; I538-T541 WeakPolarHBondContact CA-OG1 3.41Å; I538-T541 PolarHBondContact O-N 2.98Å; I538-T541 PolarHBondContact O-OG1 2.88Å; I538-V542 HydrophobicContact CG2-CG2 4.3Å; I538-V542 WeakPolarHBondContact O-CB 3.47Å; I538-V542 VanDerWaalsContact O-CG2 3.23Å; I538-V542 WeakPolarHBondContact O-CG2 3.32Å; I538-V542 PolarHBondContact O-N 3.11Å
539	A	78.6	Confident	79.9	Confident	55 Å²	55	90.2 Å²	90.2	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-41.1	177.2	0	0	0	0	0	111.9	L535 K536 C537 Q543	L535-A539 WeakPolarHBondContact O-CB 3.47Å; L535-A539 PolarHBondContact O-N 2.95Å; K536-A539 PolarHBondContact O-N 2.86Å; C537-A539 PolarHBondContact O-N 2.99Å; A539-Q543 WeakPolarHBondContact O-CG 3.43Å; A539-Q543 PolarHBondContact O-N 3.02Å
540	G	81.3	Confident	79.7	Confident	34 Å²	34	92 Å²	92	35%	0.351	49%	0.486	S	S	.	.	H	α-helix	trans	-65.9	-42.3	176	0	0	0	0	0	113.2	K536 C537 I538 Q543 L544	K536-G540 PolarHBondContact O-N 2.99Å; C537-G540 PolarHBondContact O-N 3.33Å; I538-G540 VanDerWaalsContact C-N 3.31Å; I538-G540 PolarHBondContact O-N 3.34Å; G540-Q543 PolarHBondContact O-N 2.97Å; G540-L544 WeakPolarHBondContact O-CB 3.49Å; G540-L544 PolarHBondContact O-N 2.94Å
541	T	77	Confident	79.4	Confident	76 Å²	76	94.6 Å²	94.6	47%	0.466	49%	0.493	S	S	.	.	H	α-helix	trans	-68.7	-37.3	176.2	44.6	0	0	0	0	112.1	C537 I538 L544 Y545	C537-T541 PolarHBondContact O-N 2.94Å; C537-T541 PolarHBondContact O-OG1 3.44Å; I538-T541 VanDerWaalsContact CA-OG1 3.3Å; I538-T541 WeakPolarHBondContact CA-OG1 3.41Å; I538-T541 PolarHBondContact O-N 2.98Å; I538-T541 PolarHBondContact O-OG1 2.88Å; T541-L544 PolarHBondContact O-N 3.41Å; T541-Y545 VanDerWaalsContact O-CB 3.26Å; T541-Y545 WeakPolarHBondContact O-CB 3.23Å; T541-Y545 PolarHBondContact O-N 3.27Å
542	V	76.4	Confident	78.9	Confident	89 Å²	89	90.4 Å²	90.4	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-43.4	172.9	170.5	0	0	0	0	111.1	I538 Y545 H546	I538-V542 HydrophobicContact CG2-CG2 4.3Å; I538-V542 WeakPolarHBondContact O-CB 3.47Å; I538-V542 VanDerWaalsContact O-CG2 3.23Å; I538-V542 WeakPolarHBondContact O-CG2 3.32Å; I538-V542 PolarHBondContact O-N 3.11Å; V542-Y545 PolarHBondContact O-N 3.39Å; V542-H546 WeakPolarHBondContact O-CB 3.23Å; V542-H546 PolarHBondContact O-N 3.22Å
543	Q	80.3	Confident	78.6	Confident	140 Å²	140	89.8 Å²	89.8	65%	0.654	47%	0.473	S	S	*	.	H	α-helix	trans	-63.9	-42	174.5	-78.1	-177	-6.1	0	0	112.4	A539 G540 H546 T547	A539-Q543 WeakPolarHBondContact O-CG 3.43Å; A539-Q543 PolarHBondContact O-N 3.02Å; G540-Q543 PolarHBondContact O-N 2.97Å; Q543-H546 PolarHBondContact O-N 3Å; Q543-T547 WeakPolarHBondContact O-CB 3.44Å; Q543-T547 PolarHBondContact O-N 3.07Å; Q543-T547 PolarHBondContact O-OG1 3.49Å
544	L	77.8	Confident	78.4	Confident	118 Å²	118	91.6 Å²	91.6	62%	0.618	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-44.1	177.1	-158.6	105.7	0	0	0	110.8	G540 T541 H546 T547 C548	G540-L544 WeakPolarHBondContact O-CB 3.49Å; G540-L544 PolarHBondContact O-N 2.94Å; T541-L544 PolarHBondContact O-N 3.41Å; L544-H546 PolarHBondContact O-N 3.39Å; L544-T547 WeakPolarHBondContact O-CB 3.29Å; L544-T547 PolarHBondContact O-N 2.96Å; L544-C548 WeakPolarHBondContact O-CB 3.43Å; L544-C548 PolarHBondContact O-N 2.89Å; L544-C548 PolarHBondContact O-SG 3.37Å; L544-C548 VanDerWaalsContact O-SG 3.34Å
545	Y	76.9	Confident	78.1	Confident	177 Å²	177	94.2 Å²	94.2	69%	0.694	49%	0.493	S	S	*	.	H	α-helix	trans	-59.8	-46.1	175.1	179.4	-94.7	0	0	0	111.3	T541 V542 T547 C548 S549	T541-Y545 VanDerWaalsContact O-CB 3.26Å; T541-Y545 WeakPolarHBondContact O-CB 3.23Å; T541-Y545 PolarHBondContact O-N 3.27Å; V542-Y545 PolarHBondContact O-N 3.39Å; Y545-T547 VanDerWaalsContact C-N 3.29Å; Y545-T547 PolarHBondContact O-N 3.28Å; Y545-C548 PolarHBondContact O-N 2.91Å; Y545-S549 VanDerWaalsContact O-CB 3.25Å; Y545-S549 WeakPolarHBondContact O-CB 3.35Å; Y545-S549 PolarHBondContact O-N 3.35Å
546	H	78.6	Confident	77.8	Confident	100 Å²	100	94.1 Å²	94.1	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-38.1	176.3	-172.3	66.4	0	0	0	112.1	V542 Q543 L544 K550	V542-H546 WeakPolarHBondContact O-CB 3.23Å; V542-H546 PolarHBondContact O-N 3.22Å; Q543-H546 PolarHBondContact O-N 3Å; L544-H546 PolarHBondContact O-N 3.39Å; H546-K550 WeakPolarHBondContact NE2-CE 3.47Å; H546-K550 PolarHBondContact NE2-NZ 2.93Å; H546-K550 WeakPolarHBondContact O-CG 3.49Å; H546-K550 PolarHBondContact O-N 3.2Å
547	T	81.5	Confident	77.6	Confident	67 Å²	67	94.1 Å²	94.1	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-67.2	-47.2	176.2	-56.7	0	0	0	0	111.3	Q543 L544 Y545 S549 K550 F551	Q543-T547 WeakPolarHBondContact O-CB 3.44Å; Q543-T547 PolarHBondContact O-N 3.07Å; Q543-T547 PolarHBondContact O-OG1 3.49Å; L544-T547 WeakPolarHBondContact O-CB 3.29Å; L544-T547 PolarHBondContact O-N 2.96Å; Y545-T547 VanDerWaalsContact C-N 3.29Å; Y545-T547 PolarHBondContact O-N 3.28Å; T547-S549 VanDerWaalsContact C-N 3.35Å; T547-S549 PolarHBondContact O-N 3.18Å; T547-K550 PolarHBondContact O-N 2.96Å; T547-F551 HydrophobicContact CG2-CD2 3.69Å; T547-F551 HydrophobicContact CG2-CE2 3.43Å; T547-F551 VanDerWaalsContact CG2-CE2 3.43Å; T547-F551 WeakPolarHBondContact O-CD2 3.36Å; T547-F551 PolarHBondContact O-N 2.83Å
548	C	75.7	Confident	77.4	Confident	70 Å²	70	97.6 Å²	97.6	47%	0.473	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-40.9	174.9	-71	0	0	0	0	112.1	L544 Y545 F551 A552	L544-C548 WeakPolarHBondContact O-CB 3.43Å; L544-C548 PolarHBondContact O-N 2.89Å; L544-C548 PolarHBondContact O-SG 3.37Å; L544-C548 VanDerWaalsContact O-SG 3.34Å; Y545-C548 PolarHBondContact O-N 2.91Å; C548-F551 PolarHBondContact O-N 3.35Å; C548-A552 VanDerWaalsContact O-CB 3.29Å; C548-A552 WeakPolarHBondContact O-CB 3.38Å; C548-A552 PolarHBondContact O-N 3.48Å
549	S	75	Confident	77	Confident	42 Å²	42	97.5 Å²	97.5	29%	0.294	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-44.6	175.7	177.6	0	0	0	0	111.3	Y545 T547 A552 Q553	Y545-S549 VanDerWaalsContact O-CB 3.25Å; Y545-S549 WeakPolarHBondContact O-CB 3.35Å; Y545-S549 PolarHBondContact O-N 3.35Å; T547-S549 VanDerWaalsContact C-N 3.35Å; T547-S549 PolarHBondContact O-N 3.18Å; S549-A552 PolarHBondContact O-N 3.48Å; S549-Q553 WeakPolarHBondContact O-CB 3.36Å; S549-Q553 WeakPolarHBondContact O-CG 3.28Å; S549-Q553 PolarHBondContact O-N 3.29Å
550	K	79.9	Confident	76.8	Confident	109 Å²	109	98.1 Å²	98.1	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-45.2	173.8	-81.4	179.9	168.7	165.8	0	112.9	H546 T547 Q553 Q554	H546-K550 WeakPolarHBondContact NE2-CE 3.47Å; H546-K550 PolarHBondContact NE2-NZ 2.93Å; H546-K550 WeakPolarHBondContact O-CG 3.49Å; H546-K550 PolarHBondContact O-N 3.2Å; T547-K550 PolarHBondContact O-N 2.96Å; K550-Q553 PolarHBondContact O-N 3.21Å; K550-Q554 WeakPolarHBondContact O-CG 3.38Å; K550-Q554 PolarHBondContact O-N 3.5Å
551	F	78.2	Confident	76.5	Confident	134 Å²	134	101.2 Å²	101.2	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-43.5	176.9	-81.3	-62.8	0	0	0	111.9	T547 C548 Q554 E555	T547-F551 HydrophobicContact CG2-CD2 3.69Å; T547-F551 HydrophobicContact CG2-CE2 3.43Å; T547-F551 VanDerWaalsContact CG2-CE2 3.43Å; T547-F551 WeakPolarHBondContact O-CD2 3.36Å; T547-F551 PolarHBondContact O-N 2.83Å; C548-F551 PolarHBondContact O-N 3.35Å; F551-Q554 PolarHBondContact O-N 2.91Å; F551-E555 WeakPolarHBondContact O-CB 3.31Å; F551-E555 PolarHBondContact O-N 3.24Å
552	A	72.5	Confident	76.4	Confident	45 Å²	45	100.4 Å²	100.4	37%	0.372	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.1	0	0	0	0	0	111.8	C548 S549 E555 I556	C548-A552 VanDerWaalsContact O-CB 3.29Å; C548-A552 WeakPolarHBondContact O-CB 3.38Å; C548-A552 PolarHBondContact O-N 3.48Å; S549-A552 PolarHBondContact O-N 3.48Å; A552-E555 PolarHBondContact O-N 3.44Å; A552-I556 WeakPolarHBondContact O-CB 3.2Å; A552-I556 WeakPolarHBondContact O-CD1 3.47Å; A552-I556 WeakPolarHBondContact O-CG1 3.25Å; A552-I556 PolarHBondContact O-N 2.89Å
553	Q	75.1	Confident	76.1	Confident	100 Å²	100	100.7 Å²	100.7	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-45.6	173.8	-78.8	178.6	-15.9	0	0	111.5	S549 K550 E555 I556 Y557	S549-Q553 WeakPolarHBondContact O-CB 3.36Å; S549-Q553 WeakPolarHBondContact O-CG 3.28Å; S549-Q553 PolarHBondContact O-N 3.29Å; K550-Q553 PolarHBondContact O-N 3.21Å; Q553-E555 PolarHBondContact O-N 3.09Å; Q553-I556 PolarHBondContact O-N 3.4Å; Q553-Y557 HydrophobicContact CB-CD2 4.48Å; Q553-Y557 HydrophobicContact CB-CE2 4.28Å; Q553-Y557 WeakPolarHBondContact O-CD2 3.07Å; Q553-Y557 PolarHBondContact O-N 3.04Å
554	Q	78.8	Confident	76	Confident	125 Å²	125	98 Å²	98	58%	0.584	49%	0.486	S	S	*	.	H	α-helix	trans	-61.3	-42.2	176.9	-74.7	176.4	-10.2	0	0	112.5	K550 F551 Y557 Q558	K550-Q554 WeakPolarHBondContact O-CG 3.38Å; K550-Q554 PolarHBondContact O-N 3.5Å; F551-Q554 PolarHBondContact O-N 2.91Å; Q554-Y557 PolarHBondContact O-N 3.28Å; Q554-Q558 WeakPolarHBondContact O-CB 3.14Å; Q554-Q558 PolarHBondContact O-N 2.87Å
555	E	73.1	Confident	76.1	Confident	124 Å²	124	96 Å²	96	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.8	-168.2	176	-170.3	0	0	111.4	F551 A552 Q553 Q558 I559	F551-E555 WeakPolarHBondContact O-CB 3.31Å; F551-E555 PolarHBondContact O-N 3.24Å; A552-E555 PolarHBondContact O-N 3.44Å; Q553-E555 PolarHBondContact O-N 3.09Å; E555-Q558 PolarHBondContact O-N 2.65Å; E555-I559 HydrophobicContact CG-CD1 4.15Å; E555-I559 VanDerWaalsContact O-CG1 3.26Å; E555-I559 WeakPolarHBondContact O-CG1 3.47Å; E555-I559 PolarHBondContact O-N 3Å
556	I	74.5	Confident	75.6	Confident	102 Å²	102	89.2 Å²	89.2	52%	0.523	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-48.4	174.3	-70	165.1	0	0	0	110.7	A552 Q553 Q558 I559 V560	A552-I556 WeakPolarHBondContact O-CB 3.2Å; A552-I556 WeakPolarHBondContact O-CD1 3.47Å; A552-I556 WeakPolarHBondContact O-CG1 3.25Å; A552-I556 PolarHBondContact O-N 2.89Å; Q553-I556 PolarHBondContact O-N 3.4Å; I556-Q558 VanDerWaalsContact C-N 3.31Å; I556-Q558 PolarHBondContact O-N 3.4Å; I556-I559 PolarHBondContact O-N 3.1Å; I556-V560 HydrophobicContact CG2-CG2 4.37Å; I556-V560 VanDerWaalsContact O-CG2 3.28Å; I556-V560 WeakPolarHBondContact O-CG2 3.49Å; I556-V560 PolarHBondContact O-N 3.5Å
557	Y	78.1	Confident	75.6	Confident	153 Å²	153	93 Å²	93	60%	0.6	47%	0.472	S	S	*	.	H	α-helix	trans	-59.8	-42.3	177.6	-75.1	-60.2	0	0	0	111.7	Q553 Q554 I559 V560 D561	Q553-Y557 HydrophobicContact CB-CD2 4.48Å; Q553-Y557 HydrophobicContact CB-CE2 4.28Å; Q553-Y557 WeakPolarHBondContact O-CD2 3.07Å; Q553-Y557 PolarHBondContact O-N 3.04Å; Q554-Y557 PolarHBondContact O-N 3.28Å; Y557-I559 PolarHBondContact O-N 3.26Å; Y557-V560 PolarHBondContact O-N 3.23Å; Y557-D561 PolarHBondContact O-N 2.7Å
558	Q	77	Confident	75.4	Confident	115 Å²	115	93.7 Å²	93.7	54%	0.537	47%	0.474	S	S	.	.	H	α-helix	trans	-63.7	-42.2	177	-172.5	176.9	-2.9	0	0	112.5	Q554 E555 I556 V560 D561 E562	Q554-Q558 WeakPolarHBondContact O-CB 3.14Å; Q554-Q558 PolarHBondContact O-N 2.87Å; E555-Q558 PolarHBondContact O-N 2.65Å; I556-Q558 VanDerWaalsContact C-N 3.31Å; I556-Q558 PolarHBondContact O-N 3.4Å; Q558-V560 VanDerWaalsContact C-N 3.33Å; Q558-D561 PolarHBondContact O-N 3.46Å; Q558-E562 PolarHBondContact NE2-OE1 3.04Å; Q558-E562 VanDerWaalsContact NE2-OE1 3.16Å; Q558-E562 WeakPolarHBondContact O-CB 3.05Å; Q558-E562 WeakPolarHBondContact O-CG 3.3Å; Q558-E562 PolarHBondContact O-N 2.93Å
559	I	71.6	Confident	75.7	Confident	73 Å²	73	95.5 Å²	95.5	37%	0.374	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-40.4	176.1	-69.1	165.6	0	0	0	110.8	E555 I556 Y557 N563	E555-I559 HydrophobicContact CG-CD1 4.15Å; E555-I559 VanDerWaalsContact O-CG1 3.26Å; E555-I559 WeakPolarHBondContact O-CG1 3.47Å; E555-I559 PolarHBondContact O-N 3Å; I556-I559 PolarHBondContact O-N 3.1Å; Y557-I559 PolarHBondContact O-N 3.26Å; I559-N563 VanDerWaalsContact O-CB 3.31Å; I559-N563 WeakPolarHBondContact O-CB 3.47Å; I559-N563 VanDerWaalsContact O-CG 3.31Å; I559-N563 PolarHBondContact O-N 3.17Å; I559-N563 PolarHBondContact O-ND2 2.95Å
560	V	72.9	Confident	75.7	Confident	67 Å²	67	97.9 Å²	97.9	41%	0.406	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-47.5	176.6	170.6	0	0	0	0	110.5	I556 Y557 Q558 E562 N563 I564	I556-V560 HydrophobicContact CG2-CG2 4.37Å; I556-V560 VanDerWaalsContact O-CG2 3.28Å; I556-V560 WeakPolarHBondContact O-CG2 3.49Å; I556-V560 PolarHBondContact O-N 3.5Å; Y557-V560 PolarHBondContact O-N 3.23Å; Q558-V560 VanDerWaalsContact C-N 3.33Å; V560-E562 PolarHBondContact O-N 3.36Å; V560-N563 PolarHBondContact O-N 3.1Å; V560-I564 HydrophobicContact CG1-CD1 3.68Å; V560-I564 HydrophobicContact CG1-CG1 4.37Å; V560-I564 WeakPolarHBondContact O-CB 3.42Å; V560-I564 VanDerWaalsContact O-CG1 3.26Å; V560-I564 WeakPolarHBondContact O-CG1 3.47Å; V560-I564 PolarHBondContact O-N 3.44Å
561	D	76.1	Confident	75.6	Confident	99 Å²	99	96.1 Å²	96.1	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-41.6	178.2	-74.2	-15.2	0	0	0	112.4	Y557 Q558 S565	Y557-D561 PolarHBondContact O-N 2.7Å; Q558-D561 PolarHBondContact O-N 3.46Å; D561-S565 WeakPolarHBondContact O-CB 3.27Å; D561-S565 PolarHBondContact O-N 2.97Å; D561-S565 PolarHBondContact O-OG 3.3Å
562	E	74.2	Confident	75.9	Confident	60 Å²	60	94 Å²	94	28%	0.28	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-41.8	175.8	-75.3	179.9	-164.1	0	0	111.8	Q558 V560 S565 A566	Q558-E562 PolarHBondContact NE2-OE1 3.04Å; Q558-E562 VanDerWaalsContact NE2-OE1 3.16Å; Q558-E562 WeakPolarHBondContact O-CB 3.05Å; Q558-E562 WeakPolarHBondContact O-CG 3.3Å; Q558-E562 PolarHBondContact O-N 2.93Å; V560-E562 PolarHBondContact O-N 3.36Å; E562-S565 PolarHBondContact O-N 3.41Å; E562-A566 WeakPolarHBondContact O-CB 3.39Å; E562-A566 PolarHBondContact O-N 3.4Å
563	N	71.1	Confident	76.2	Confident	94 Å²	94	96.1 Å²	96.1	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-66.7	-41.9	176.6	-80.5	-23.6	0	0	0	112.3	I559 V560 S565 A566 R567	I559-N563 VanDerWaalsContact O-CB 3.31Å; I559-N563 WeakPolarHBondContact O-CB 3.47Å; I559-N563 VanDerWaalsContact O-CG 3.31Å; I559-N563 PolarHBondContact O-N 3.17Å; I559-N563 PolarHBondContact O-ND2 2.95Å; V560-N563 PolarHBondContact O-N 3.1Å; N563-S565 VanDerWaalsContact C-N 3.31Å; N563-A566 PolarHBondContact O-N 2.88Å; N563-R567 WeakPolarHBondContact O-CB 3.3Å; N563-R567 PolarHBondContact O-N 2.55Å
564	I	78	Confident	76.3	Confident	85 Å²	85	95.8 Å²	95.8	44%	0.436	48%	0.478	S	S	.	.	H	α-helix	trans	-61.1	-44.4	174.3	-69.9	167.8	0	0	0	109.6	V560 A566 R567 N568	V560-I564 HydrophobicContact CG1-CD1 3.68Å; V560-I564 HydrophobicContact CG1-CG1 4.37Å; V560-I564 WeakPolarHBondContact O-CB 3.42Å; V560-I564 VanDerWaalsContact O-CG1 3.26Å; V560-I564 WeakPolarHBondContact O-CG1 3.47Å; V560-I564 PolarHBondContact O-N 3.44Å; I564-A566 PolarHBondContact O-N 3.47Å; I564-R567 PolarHBondContact O-N 3Å; I564-N568 WeakPolarHBondContact O-CB 3.25Å; I564-N568 PolarHBondContact O-N 3.31Å; I564-N568 PolarHBondContact O-ND2 3.32Å
565	S	79	Confident	76.4	Confident	75 Å²	75	94.3 Å²	94.3	52%	0.524	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-42.7	178.4	-59.9	0	0	0	0	112.5	D561 E562 N563 L569	D561-S565 WeakPolarHBondContact O-CB 3.27Å; D561-S565 PolarHBondContact O-N 2.97Å; D561-S565 PolarHBondContact O-OG 3.3Å; E562-S565 PolarHBondContact O-N 3.41Å; N563-S565 VanDerWaalsContact C-N 3.31Å; S565-L569 PolarHBondContact O-N 3.01Å
566	A	67.7	Low	76.9	Confident	35 Å²	35	92.7 Å²	92.7	29%	0.289	47%	0.468	S	S	.	.	H	α-helix	trans	-65.8	-43.2	176.9	0	0	0	0	0	111.9	E562 N563 I564 L569 E570	E562-A566 WeakPolarHBondContact O-CB 3.39Å; E562-A566 PolarHBondContact O-N 3.4Å; N563-A566 PolarHBondContact O-N 2.88Å; I564-A566 PolarHBondContact O-N 3.47Å; A566-L569 WeakPolarHBondContact O-CB 3.45Å; A566-L569 PolarHBondContact O-N 3.44Å; A566-E570 PolarHBondContact O-N 3.46Å
567	R	77	Confident	77.1	Confident	178 Å²	178	92.1 Å²	92.1	67%	0.672	47%	0.466	S	S	*	.	H	α-helix	trans	-63.8	-42.9	176.7	-176.8	173.1	-177.9	156.5	1.6	112	N563 I564 L569 E570 L571	N563-R567 WeakPolarHBondContact O-CB 3.3Å; N563-R567 PolarHBondContact O-N 2.55Å; I564-R567 PolarHBondContact O-N 3Å; R567-L569 VanDerWaalsContact C-N 3.3Å; R567-L569 PolarHBondContact O-N 3.25Å; R567-E570 PolarHBondContact O-N 3.02Å; R567-L571 HydrophobicContact CG-CD1 3.95Å; R567-L571 WeakPolarHBondContact O-CB 3.34Å; R567-L571 WeakPolarHBondContact O-CG 3.32Å; R567-L571 PolarHBondContact O-N 3.38Å
568	N	78.4	Confident	77.1	Confident	82 Å²	82	89.3 Å²	89.3	44%	0.439	46%	0.461	S	S	.	.	H	α-helix	trans	-63.1	-37.9	175.8	-73	-14.6	0	0	0	111.6	I564 N572	I564-N568 WeakPolarHBondContact O-CB 3.25Å; I564-N568 PolarHBondContact O-N 3.31Å; I564-N568 PolarHBondContact O-ND2 3.32Å; N568-N572 WeakPolarHBondContact O-CB 3.36Å; N568-N572 PolarHBondContact O-N 3.25Å; N568-N572 PolarHBondContact O-ND2 3.06Å
569	L	82.4	Confident	77.6	Confident	109 Å²	109	88.5 Å²	88.5	57%	0.571	46%	0.457	S	S	*	.	H	α-helix	trans	-64.1	-43.5	174.6	-178.4	67.7	0	0	0	112	S565 A566 R567 N572 L573	S565-L569 PolarHBondContact O-N 3.01Å; A566-L569 WeakPolarHBondContact O-CB 3.45Å; A566-L569 PolarHBondContact O-N 3.44Å; R567-L569 VanDerWaalsContact C-N 3.3Å; R567-L569 PolarHBondContact O-N 3.25Å; L569-N572 PolarHBondContact O-N 3.45Å; L569-L573 WeakPolarHBondContact O-CG 3.26Å; L569-L573 PolarHBondContact O-N 3.38Å; L569-L573 VanDerWaalsContact O-N 3.08Å
570	E	73.8	Confident	78.1	Confident	91 Å²	91	91.2 Å²	91.2	43%	0.425	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-45.3	177.7	-173	172.1	-163.8	0	0	111.9	I491 A566 R567 N572 L573 E574	I491-E570 VanDerWaalsContact CD1-OE1 3.31Å; I491-E570 WeakPolarHBondContact CD1-OE1 3.39Å; A566-E570 PolarHBondContact O-N 3.46Å; R567-E570 PolarHBondContact O-N 3.02Å; E570-N572 VanDerWaalsContact C-N 3.33Å; E570-N572 PolarHBondContact O-N 2.91Å; E570-L573 PolarHBondContact O-N 3.22Å; E570-E574 PolarHBondContact O-N 2.97Å
571	L	78.6	Confident	78.6	Confident	72 Å²	72	91.8 Å²	91.8	38%	0.377	47%	0.469	S	S	.	.	H	α-helix	trans	-57.7	-43.9	173.5	-81.8	159.3	0	0	0	111.9	R567 L573 E574 I575	R567-L571 HydrophobicContact CG-CD1 3.95Å; R567-L571 WeakPolarHBondContact O-CB 3.34Å; R567-L571 WeakPolarHBondContact O-CG 3.32Å; R567-L571 PolarHBondContact O-N 3.38Å; L571-L573 VanDerWaalsContact C-N 3.33Å; L571-L573 PolarHBondContact O-N 3.32Å; L571-E574 PolarHBondContact O-N 2.64Å; L571-I575 VanDerWaalsContact O-CG1 3.25Å; L571-I575 WeakPolarHBondContact O-CG1 2.96Å; L571-I575 PolarHBondContact O-N 3.29Å
572	N	83.7	Confident	79.1	Confident	90 Å²	90	90.3 Å²	90.3	48%	0.481	46%	0.461	S	S	.	.	H	α-helix	trans	-63.3	-39.3	177.6	-72.4	-22.2	0	0	0	112.1	N568 L569 E570 I575 D576	N568-N572 WeakPolarHBondContact O-CB 3.36Å; N568-N572 PolarHBondContact O-N 3.25Å; N568-N572 PolarHBondContact O-ND2 3.06Å; L569-N572 PolarHBondContact O-N 3.45Å; E570-N572 VanDerWaalsContact C-N 3.33Å; E570-N572 PolarHBondContact O-N 2.91Å; N572-I575 PolarHBondContact O-N 3.05Å; N572-D576 VanDerWaalsContact O-CG 3.29Å; N572-D576 PolarHBondContact O-N 3.45Å
573	L	80.5	Confident	79.8	Confident	90 Å²	90	91.3 Å²	91.3	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-38.3	175.4	-69.5	170.9	0	0	0	112.1	L569 E570 L571 D576 D577	L569-L573 WeakPolarHBondContact O-CG 3.26Å; L569-L573 PolarHBondContact O-N 3.38Å; L569-L573 VanDerWaalsContact O-N 3.08Å; E570-L573 PolarHBondContact O-N 3.22Å; L571-L573 VanDerWaalsContact C-N 3.33Å; L571-L573 PolarHBondContact O-N 3.32Å; L573-D576 PolarHBondContact O-N 3.44Å; L573-D577 PolarHBondContact O-N 3.08Å
574	E	75.9	Confident	80.7	Confident	92 Å²	92	92.5 Å²	92.5	43%	0.43	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-40.9	174.9	-174	174.1	-166.5	0	0	111.6	E570 L571 D577 L578	E570-E574 PolarHBondContact O-N 2.97Å; L571-E574 PolarHBondContact O-N 2.64Å; E574-D577 PolarHBondContact O-N 2.99Å; E574-L578 HydrophobicContact CG-CD1 4.28Å; E574-L578 WeakPolarHBondContact O-CB 3.33Å; E574-L578 VanDerWaalsContact O-CG 3.31Å; E574-L578 WeakPolarHBondContact O-CG 3.17Å; E574-L578 PolarHBondContact O-N 3.06Å
575	I	81.9	Confident	81.1	Confident	94 Å²	94	92.6 Å²	92.6	48%	0.482	47%	0.468	S	S	.	.	H	α-helix	trans	-61.3	-45.3	173.6	-69.1	164.6	0	0	0	110.7	L571 N572 D577 L578 Q579	L571-I575 VanDerWaalsContact O-CG1 3.25Å; L571-I575 WeakPolarHBondContact O-CG1 2.96Å; L571-I575 PolarHBondContact O-N 3.29Å; N572-I575 PolarHBondContact O-N 3.05Å; I575-D577 PolarHBondContact O-N 3.34Å; I575-L578 PolarHBondContact O-N 3.01Å; I575-Q579 WeakPolarHBondContact O-CB 2.72Å; I575-Q579 PolarHBondContact O-N 3.36Å
576	D	82.1	Confident	81.7	Confident	91 Å²	91	94.1 Å²	94.1	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-62	-41.9	177.8	-73.9	-18.7	0	0	0	112.1	N572 L573 Q579 Q580	N572-D576 VanDerWaalsContact O-CG 3.29Å; N572-D576 PolarHBondContact O-N 3.45Å; L573-D576 PolarHBondContact O-N 3.44Å; D576-Q579 PolarHBondContact O-N 3.44Å; D576-Q580 WeakPolarHBondContact O-CG 3.38Å; D576-Q580 PolarHBondContact O-N 3.26Å
577	D	79	Confident	82.9	Confident	90 Å²	90	98.7 Å²	98.7	48%	0.481	48%	0.48	S	S	.	.	H	α-helix	trans	-66.5	-41.3	177.5	-78.5	-14.3	0	0	0	111.3	L573 E574 I575 Q580 L581	L573-D577 PolarHBondContact O-N 3.08Å; E574-D577 PolarHBondContact O-N 2.99Å; I575-D577 PolarHBondContact O-N 3.34Å; D577-Q580 PolarHBondContact O-N 2.9Å; D577-L581 PolarHBondContact O-N 2.76Å
578	L	78.6	Confident	83.6	Confident	93 Å²	93	93.1 Å²	93.1	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-38.4	175	-74	173.3	0	0	0	112	E574 I575 L581 N582	E574-L578 HydrophobicContact CG-CD1 4.28Å; E574-L578 WeakPolarHBondContact O-CB 3.33Å; E574-L578 VanDerWaalsContact O-CG 3.31Å; E574-L578 WeakPolarHBondContact O-CG 3.17Å; E574-L578 PolarHBondContact O-N 3.06Å; I575-L578 PolarHBondContact O-N 3.01Å; L578-L581 PolarHBondContact O-N 2.88Å; L578-N582 WeakPolarHBondContact O-CB 3.37Å; L578-N582 PolarHBondContact O-N 3.44Å
579	Q	87.1	Confident	84.1	Confident	99 Å²	99	93.7 Å²	93.7	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-45.1	175.9	-170.5	65.3	36.8	0	0	111	I575 D576 L581 N582 D583	I575-Q579 WeakPolarHBondContact O-CB 2.72Å; I575-Q579 PolarHBondContact O-N 3.36Å; D576-Q579 PolarHBondContact O-N 3.44Å; Q579-L581 VanDerWaalsContact C-N 3.3Å; Q579-L581 PolarHBondContact O-N 3.12Å; Q579-N582 PolarHBondContact O-N 3.19Å; Q579-N582 VanDerWaalsContact O-N 3.16Å; Q579-D583 PolarHBondContact NE2-OD1 3.12Å; Q579-D583 VanDerWaalsContact NE2-OD1 3.16Å; Q579-D583 PolarHBondContact O-N 3.12Å
580	Q	83.5	Confident	84.6	Confident	129 Å²	129	91.8 Å²	91.8	60%	0.603	46%	0.46	S	S	*	.	H	α-helix	trans	-60.4	-39.4	174.8	-75.8	177.2	38.9	0	0	112.6	D576 D577 Y584	D576-Q580 WeakPolarHBondContact O-CG 3.38Å; D576-Q580 PolarHBondContact O-N 3.26Å; D577-Q580 PolarHBondContact O-N 2.9Å; Q580-Y584 WeakPolarHBondContact O-CB 3.33Å; Q580-Y584 PolarHBondContact O-N 3.22Å
581	L	82.7	Confident	85.5	Confident	80 Å²	80	91.3 Å²	91.3	42%	0.419	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-42	175.2	-179.5	61.7	0	0	0	111.3	D577 L578 Q579 Y584 L585	D577-L581 PolarHBondContact O-N 2.76Å; L578-L581 PolarHBondContact O-N 2.88Å; Q579-L581 VanDerWaalsContact C-N 3.3Å; Q579-L581 PolarHBondContact O-N 3.12Å; L581-Y584 PolarHBondContact O-N 3.29Å; L581-L585 HydrophobicContact CG-CD1 4.31Å; L581-L585 WeakPolarHBondContact O-CG 3.35Å; L581-L585 PolarHBondContact O-N 2.9Å
582	N	86.2	Confident	86.3	Confident	68 Å²	68	93.3 Å²	93.3	36%	0.364	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-46.7	176.8	-169.6	65	0	0	0	111.5	L578 Q579 Y584 L585 E586	L578-N582 WeakPolarHBondContact O-CB 3.37Å; L578-N582 PolarHBondContact O-N 3.44Å; Q579-N582 PolarHBondContact O-N 3.19Å; Q579-N582 VanDerWaalsContact O-N 3.16Å; N582-Y584 VanDerWaalsContact C-N 3.29Å; N582-Y584 PolarHBondContact O-N 2.98Å; N582-L585 PolarHBondContact O-N 3.28Å; N582-L585 VanDerWaalsContact O-N 3.11Å; N582-E586 PolarHBondContact ND2-OE1 3.12Å; N582-E586 PolarHBondContact O-N 2.81Å
583	D	89.7	Confident	86.7	Confident	81 Å²	81	93.6 Å²	93.6	43%	0.433	46%	0.462	S	S	.	.	H	α-helix	trans	-59.6	-39.5	176.9	-64.1	-9.8	0	0	0	111.6	Q579 F587	Q579-D583 PolarHBondContact NE2-OD1 3.12Å; Q579-D583 VanDerWaalsContact NE2-OD1 3.16Å; Q579-D583 PolarHBondContact O-N 3.12Å; D583-F587 WeakPolarHBondContact O-CB 3.48Å; D583-F587 PolarHBondContact O-N 3.25Å
584	Y	89.3	Confident	87.3	Confident	119 Å²	119	92.2 Å²	92.2	47%	0.467	46%	0.46	S	S	.	.	H	α-helix	trans	-64.5	-42.6	174.7	176.1	-98.8	0	0	0	112.3	Q580 L581 N582 F587 M588	Q580-Y584 WeakPolarHBondContact O-CB 3.33Å; Q580-Y584 PolarHBondContact O-N 3.22Å; L581-Y584 PolarHBondContact O-N 3.29Å; N582-Y584 VanDerWaalsContact C-N 3.29Å; N582-Y584 PolarHBondContact O-N 2.98Å; Y584-F587 PolarHBondContact O-N 3Å; Y584-M588 HydrophobicContact CD1-CG 4.39Å; Y584-M588 HydrophobicContact CE1-CG 3.92Å; Y584-M588 HydrophobicContact CE2-CG 4.27Å; Y584-M588 WeakPolarHBondContact O-CG 3.45Å; Y584-M588 PolarHBondContact O-N 3.49Å
585	L	87.2	Confident	88.1	Confident	87 Å²	87	91.9 Å²	91.9	46%	0.455	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-42.9	177.1	-71.2	171.8	0	0	0	111.4	L581 N582 F587 M588 I589	L581-L585 HydrophobicContact CG-CD1 4.31Å; L581-L585 WeakPolarHBondContact O-CG 3.35Å; L581-L585 PolarHBondContact O-N 2.9Å; N582-L585 PolarHBondContact O-N 3.28Å; N582-L585 VanDerWaalsContact O-N 3.11Å; L585-F587 VanDerWaalsContact C-N 3.33Å; L585-F587 PolarHBondContact O-N 3.01Å; L585-M588 PolarHBondContact O-N 3.47Å; L585-I589 VanDerWaalsContact O-CG1 3.27Å; L585-I589 WeakPolarHBondContact O-CG1 3.49Å; L585-I589 PolarHBondContact O-N 3.34Å
586	E	90.7	Very high	88.7	Confident	107 Å²	107	92.1 Å²	92.1	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-40.2	174.8	-76	-172.6	-172.4	0	0	112.4	N582 I589 S590	N582-E586 PolarHBondContact ND2-OE1 3.12Å; N582-E586 PolarHBondContact O-N 2.81Å; E586-I589 PolarHBondContact O-N 2.7Å; E586-S590 WeakPolarHBondContact O-CB 3.21Å; E586-S590 PolarHBondContact O-N 3.4Å; E586-S590 PolarHBondContact O-OG 3.31Å
587	F	93	Very high	89.2	Confident	130 Å²	130	95.4 Å²	95.4	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-60.7	-47.5	173.5	174.6	-97.2	0	0	0	111.8	D583 Y584 L585 I589 S590 Q591	D583-F587 WeakPolarHBondContact O-CB 3.48Å; D583-F587 PolarHBondContact O-N 3.25Å; Y584-F587 PolarHBondContact O-N 3Å; L585-F587 VanDerWaalsContact C-N 3.33Å; L585-F587 PolarHBondContact O-N 3.01Å; F587-I589 PolarHBondContact O-N 3.44Å; F587-S590 PolarHBondContact O-N 3.09Å; F587-Q591 PolarHBondContact O-N 2.96Å
588	M	92.1	Very high	89.9	Confident	61 Å²	61	97.3 Å²	97.3	30%	0.3	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-41.5	178.3	-73.2	-62.8	-61.4	0	0	112.2	Y584 L585 Q591 K592	Y584-M588 HydrophobicContact CD1-CG 4.39Å; Y584-M588 HydrophobicContact CE1-CG 3.92Å; Y584-M588 HydrophobicContact CE2-CG 4.27Å; Y584-M588 WeakPolarHBondContact O-CG 3.45Å; Y584-M588 PolarHBondContact O-N 3.49Å; L585-M588 PolarHBondContact O-N 3.47Å; M588-Q591 PolarHBondContact O-N 3.33Å; M588-K592 WeakPolarHBondContact O-CG 3.46Å; M588-K592 PolarHBondContact O-N 3.08Å
589	I	89.3	Confident	90.6	Very high	94 Å²	94	99.2 Å²	99.2	48%	0.482	47%	0.474	S	S	.	.	H	α-helix	trans	-61.2	-46.6	175	-70.5	166.4	0	0	0	110.1	L585 E586 F587 Q591 K592 Q593	L585-I589 VanDerWaalsContact O-CG1 3.27Å; L585-I589 WeakPolarHBondContact O-CG1 3.49Å; L585-I589 PolarHBondContact O-N 3.34Å; E586-I589 PolarHBondContact O-N 2.7Å; F587-I589 PolarHBondContact O-N 3.44Å; I589-Q591 PolarHBondContact O-N 3.02Å; I589-K592 PolarHBondContact O-N 3.32Å; I589-Q593 HydrophobicContact CG2-CG 4.32Å; I589-Q593 WeakPolarHBondContact O-CB 3.46Å; I589-Q593 VanDerWaalsContact O-CG 3.3Å; I589-Q593 WeakPolarHBondContact O-CG 3.4Å; I589-Q593 PolarHBondContact O-N 3.25Å
590	S	92.7	Very high	90.9	Very high	69 Å²	69	101.5 Å²	101.5	48%	0.483	48%	0.478	S	S	.	.	H	α-helix	trans	-60.8	-43.2	178.5	-63.3	0	0	0	0	112.2	E586 F587 Q593 S594	E586-S590 WeakPolarHBondContact O-CB 3.21Å; E586-S590 PolarHBondContact O-N 3.4Å; E586-S590 PolarHBondContact O-OG 3.31Å; F587-S590 PolarHBondContact O-N 3.09Å; S590-Q593 PolarHBondContact O-N 2.97Å; S590-S594 PolarHBondContact O-N 3.46Å
591	Q	92.4	Very high	91.3	Very high	81 Å²	81	101 Å²	101	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-49.5	174.9	-171.7	-174.4	28.9	0	0	110.9	F587 M588 I589 Q593 S594 E595	F587-Q591 PolarHBondContact O-N 2.96Å; M588-Q591 PolarHBondContact O-N 3.33Å; I589-Q591 PolarHBondContact O-N 3.02Å; Q591-Q593 PolarHBondContact O-N 3.47Å; Q591-S594 WeakPolarHBondContact O-CB 3.49Å; Q591-S594 PolarHBondContact O-N 3.47Å; Q591-S594 VanDerWaalsContact O-N 3.12Å; Q591-S594 PolarHBondContact O-OG 2.93Å; Q591-E595 PolarHBondContact O-N 3.39Å
592	K	93.8	Very high	91.7	Very high	114 Å²	114	100.4 Å²	100.4	50%	0.496	47%	0.471	S	S	.	.	H	α-helix	trans	-64.5	-37.9	-179.9	-72.2	-72.5	161.3	-157.4	0	113	M588 I589 S594 E595 L596	M588-K592 WeakPolarHBondContact O-CG 3.46Å; M588-K592 PolarHBondContact O-N 3.08Å; I589-K592 PolarHBondContact O-N 3.32Å; K592-S594 VanDerWaalsContact C-N 3.31Å; K592-S594 PolarHBondContact O-N 2.81Å; K592-E595 IonicContact NZ-OE1 2.66Å; K592-E595 IonicContact NZ-OE2 3.19Å; K592-E595 PolarHBondContact NZ-OE2 3Å; K592-E595 PolarHBondContact O-N 3.28Å; K592-L596 WeakPolarHBondContact O-CB 3.49Å; K592-L596 PolarHBondContact O-N 3.47Å
593	Q	93.8	Very high	92	Very high	97 Å²	97	103.3 Å²	103.3	45%	0.453	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-37.4	173.1	-73.3	178.4	2.4	0	0	112	I589 S590 Q591 L596 R597	I589-Q593 HydrophobicContact CG2-CG 4.32Å; I589-Q593 WeakPolarHBondContact O-CB 3.46Å; I589-Q593 VanDerWaalsContact O-CG 3.3Å; I589-Q593 WeakPolarHBondContact O-CG 3.4Å; I589-Q593 PolarHBondContact O-N 3.25Å; S590-Q593 PolarHBondContact O-N 2.97Å; Q591-Q593 PolarHBondContact O-N 3.47Å; Q593-L596 PolarHBondContact O-N 3.33Å; Q593-R597 WeakPolarHBondContact O-CG 3.48Å; Q593-R597 PolarHBondContact O-N 3.06Å
594	S	93.1	Very high	92.1	Very high	61 Å²	61	105.3 Å²	105.3	43%	0.427	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-41	175.9	80.6	0	0	0	0	112.6	S590 Q591 K592 L596 R597 K598	S590-S594 PolarHBondContact O-N 3.46Å; Q591-S594 WeakPolarHBondContact O-CB 3.49Å; Q591-S594 PolarHBondContact O-N 3.47Å; Q591-S594 VanDerWaalsContact O-N 3.12Å; Q591-S594 PolarHBondContact O-OG 2.93Å; K592-S594 VanDerWaalsContact C-N 3.31Å; K592-S594 PolarHBondContact O-N 2.81Å; S594-L596 VanDerWaalsContact C-N 3.35Å; S594-R597 PolarHBondContact O-N 3.37Å; S594-K598 PolarHBondContact O-N 3.5Å; S594-K598 VanDerWaalsContact O-N 3.08Å
595	E	92.6	Very high	92.2	Very high	85 Å²	85	105.9 Å²	105.9	40%	0.397	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-43.5	174.7	-71.4	178.8	174.5	0	0	111.2	Q591 K592 K598 K599	Q591-E595 PolarHBondContact O-N 3.39Å; K592-E595 IonicContact NZ-OE1 2.66Å; K592-E595 IonicContact NZ-OE2 3.19Å; K592-E595 PolarHBondContact NZ-OE2 3Å; K592-E595 PolarHBondContact O-N 3.28Å; E595-K598 PolarHBondContact O-N 3.47Å; E595-K599 WeakPolarHBondContact O-CG 3.36Å; E595-K599 PolarHBondContact O-N 2.85Å
596	L	94	Very high	92.4	Very high	99 Å²	99	107.2 Å²	107.2	52%	0.518	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-39.8	178.3	-167.6	146.1	0	0	0	112.1	K592 Q593 S594 K599 R600	K592-L596 WeakPolarHBondContact O-CB 3.49Å; K592-L596 PolarHBondContact O-N 3.47Å; Q593-L596 PolarHBondContact O-N 3.33Å; S594-L596 VanDerWaalsContact C-N 3.35Å; L596-K599 PolarHBondContact O-N 2.93Å; L596-R600 PolarHBondContact O-N 3.18Å
597	R	93.4	Very high	92.5	Very high	160 Å²	160	106.8 Å²	106.8	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-43.6	173.1	-75.1	177.6	-170.5	150.2	5.4	111.9	Q593 S594 R600 Q601	Q593-R597 WeakPolarHBondContact O-CG 3.48Å; Q593-R597 PolarHBondContact O-N 3.06Å; S594-R597 PolarHBondContact O-N 3.37Å; R597-R600 PolarHBondContact O-N 3.04Å; R597-Q601 PolarHBondContact O-N 3.26Å; R597-Q601 VanDerWaalsContact O-N 3.09Å
598	K	92.8	Very high	92.4	Very high	130 Å²	130	107.4 Å²	107.4	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-43.3	176.8	-173.9	-179.6	176	-177.6	0	111.5	S594 E595 R600 Q601 E602	S594-K598 PolarHBondContact O-N 3.5Å; S594-K598 VanDerWaalsContact O-N 3.08Å; E595-K598 PolarHBondContact O-N 3.47Å; K598-R600 VanDerWaalsContact C-N 3.34Å; K598-R600 PolarHBondContact O-N 3.4Å; K598-Q601 PolarHBondContact O-N 3.11Å; K598-E602 WeakPolarHBondContact O-CG 3.42Å; K598-E602 PolarHBondContact O-N 3.49Å
599	K	92.9	Very high	92.4	Very high	133 Å²	133	109.8 Å²	109.8	58%	0.578	52%	0.522	S	S	*	.	H	α-helix	trans	-62.7	-38.7	176.1	-75.7	-75.1	165.6	-156.4	0	112.9	E595 L596 E602 Q603	E595-K599 WeakPolarHBondContact O-CG 3.36Å; E595-K599 PolarHBondContact O-N 2.85Å; L596-K599 PolarHBondContact O-N 2.93Å; K599-E602 IonicContact NZ-OE2 3.44Å; K599-E602 PolarHBondContact NZ-OE2 3.05Å; K599-E602 PolarHBondContact O-N 3.21Å; K599-Q603 PolarHBondContact O-N 3.06Å
600	R	93.7	Very high	92.6	Very high	146 Å²	146	110.1 Å²	110.1	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-63.6	-40.9	174.5	-169.4	179.9	-71.5	165.8	-4.1	112	L596 R597 K598 Q603 E604	L596-R600 PolarHBondContact O-N 3.18Å; R597-R600 PolarHBondContact O-N 3.04Å; K598-R600 VanDerWaalsContact C-N 3.34Å; K598-R600 PolarHBondContact O-N 3.4Å; R600-Q603 WeakPolarHBondContact O-CB 3.28Å; R600-Q603 PolarHBondContact O-N 3.08Å; R600-E604 PolarHBondContact O-N 3.47Å
601	Q	92.4	Very high	92.6	Very high	119 Å²	119	113 Å²	113	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-64	-40.7	174.2	-70.6	176.7	-15.1	0	0	112.5	R597 K598 Q603 E604 Q605	R597-Q601 PolarHBondContact O-N 3.26Å; R597-Q601 VanDerWaalsContact O-N 3.09Å; K598-Q601 PolarHBondContact O-N 3.11Å; Q601-Q603 VanDerWaalsContact C-N 3.29Å; Q601-Q603 PolarHBondContact O-N 3.06Å; Q601-E604 PolarHBondContact O-N 3.47Å; Q601-Q605 WeakPolarHBondContact O-CG 3.32Å; Q601-Q605 PolarHBondContact O-N 3.48Å; Q601-Q605 VanDerWaalsContact O-N 3.08Å
602	E	90.3	Very high	92.7	Very high	67 Å²	67	116.7 Å²	116.7	31%	0.313	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-39.3	173.9	-71.4	172.1	-171.7	0	0	111.4	K598 K599 Q605 L606	K598-E602 WeakPolarHBondContact O-CG 3.42Å; K598-E602 PolarHBondContact O-N 3.49Å; K599-E602 IonicContact NZ-OE2 3.44Å; K599-E602 PolarHBondContact NZ-OE2 3.05Å; K599-E602 PolarHBondContact O-N 3.21Å; E602-Q605 PolarHBondContact O-N 3.47Å; E602-L606 WeakPolarHBondContact O-CG 3.41Å; E602-L606 PolarHBondContact O-N 2.73Å; E602-L606 VanDerWaalsContact O-N 3.11Å
603	Q	92	Very high	92.6	Very high	129 Å²	129	113.5 Å²	113.5	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-66.6	-42.4	176.1	-174.7	-179.8	4.5	0	0	112.5	K599 R600 Q601 Q605 L606 L607	K599-Q603 PolarHBondContact O-N 3.06Å; R600-Q603 WeakPolarHBondContact O-CB 3.28Å; R600-Q603 PolarHBondContact O-N 3.08Å; Q601-Q603 VanDerWaalsContact C-N 3.29Å; Q601-Q603 PolarHBondContact O-N 3.06Å; Q603-Q605 VanDerWaalsContact C-N 3.34Å; Q603-Q605 PolarHBondContact O-N 2.9Å; Q603-L606 PolarHBondContact O-N 2.96Å; Q603-L607 PolarHBondContact O-N 3.02Å
604	E	91.9	Very high	92.6	Very high	124 Å²	124	114.5 Å²	114.5	58%	0.579	54%	0.538	S	S	*	.	H	α-helix	trans	-61.5	-41.5	176.1	-74.7	170.9	-171.8	0	0	111.7	R600 Q601 L606 L607 E608	R600-E604 PolarHBondContact O-N 3.47Å; Q601-E604 PolarHBondContact O-N 3.47Å; E604-L606 PolarHBondContact O-N 3.17Å; E604-L607 PolarHBondContact O-N 3.43Å; E604-E608 PolarHBondContact O-N 2.77Å
605	Q	91.3	Very high	92.7	Very high	131 Å²	131	116.1 Å²	116.1	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-63.4	-38.5	175.1	-71.5	176.3	2	0	0	112.8	Q601 E602 Q603 L607 E608 L609	Q601-Q605 WeakPolarHBondContact O-CG 3.32Å; Q601-Q605 PolarHBondContact O-N 3.48Å; Q601-Q605 VanDerWaalsContact O-N 3.08Å; E602-Q605 PolarHBondContact O-N 3.47Å; Q603-Q605 VanDerWaalsContact C-N 3.34Å; Q603-Q605 PolarHBondContact O-N 2.9Å; Q605-L607 VanDerWaalsContact C-N 3.3Å; Q605-E608 PolarHBondContact O-N 2.77Å; Q605-L609 PolarHBondContact O-N 3.07Å
606	L	91.6	Very high	92.7	Very high	115 Å²	115	114.1 Å²	114.1	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-37.2	175.1	-79.6	166	0	0	0	111.8	E602 Q603 E604 L609 E610	E602-L606 WeakPolarHBondContact O-CG 3.41Å; E602-L606 PolarHBondContact O-N 2.73Å; E602-L606 VanDerWaalsContact O-N 3.11Å; Q603-L606 PolarHBondContact O-N 2.96Å; E604-L606 PolarHBondContact O-N 3.17Å; L606-L609 PolarHBondContact O-N 3.41Å; L606-E610 PolarHBondContact O-N 2.7Å
607	L	93.1	Very high	92.6	Very high	97 Å²	97	114.2 Å²	114.2	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-70.3	-37.1	179.7	-150.9	144.6	0	0	0	111.6	Q603 E604 Q605 E610 M611	Q603-L607 PolarHBondContact O-N 3.02Å; E604-L607 PolarHBondContact O-N 3.43Å; Q605-L607 VanDerWaalsContact C-N 3.3Å; L607-E610 WeakPolarHBondContact O-CB 3.47Å; L607-E610 PolarHBondContact O-N 2.89Å; L607-M611 PolarHBondContact O-N 2.74Å; L607-M611 VanDerWaalsContact O-N 3.08Å
608	E	91.2	Very high	92.6	Very high	144 Å²	144	112.3 Å²	112.3	67%	0.673	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-41.9	171.1	-170.8	176	-168.9	0	0	111.8	E604 Q605 E610 M611 Y612	E604-E608 PolarHBondContact O-N 2.77Å; Q605-E608 PolarHBondContact O-N 2.77Å; E608-E610 VanDerWaalsContact C-N 3.33Å; E608-E610 PolarHBondContact O-N 3.12Å; E608-M611 PolarHBondContact O-N 3.19Å; E608-Y612 PolarHBondContact O-N 2.99Å; E608-Y612 VanDerWaalsContact O-N 3.07Å
609	L	92.6	Very high	92.7	Very high	111 Å²	111	111.2 Å²	111.2	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-64.2	-37.5	175.3	-168.9	73.9	0	0	0	112	Q605 L606 Y612 A613	Q605-L609 PolarHBondContact O-N 3.07Å; L606-L609 PolarHBondContact O-N 3.41Å; L609-Y612 PolarHBondContact O-N 3.3Å; L609-A613 WeakPolarHBondContact O-CB 3.26Å; L609-A613 PolarHBondContact O-N 3.03Å
610	E	93.5	Very high	92.7	Very high	100 Å²	100	109.8 Å²	109.8	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-42.7	175.2	-167.2	-164.5	147.4	0	0	111.6	L606 L607 E608 Y612 A613 K614	L606-E610 PolarHBondContact O-N 2.7Å; L607-E610 WeakPolarHBondContact O-CB 3.47Å; L607-E610 PolarHBondContact O-N 2.89Å; E608-E610 VanDerWaalsContact C-N 3.33Å; E608-E610 PolarHBondContact O-N 3.12Å; E610-Y612 VanDerWaalsContact C-N 3.34Å; E610-Y612 PolarHBondContact O-N 3.46Å; E610-A613 PolarHBondContact O-N 2.76Å; E610-K614 PolarHBondContact O-N 3.32Å; E610-K614 WeakPolarHBondContact OE1-CE 3.48Å; E610-K614 IonicContact OE1-NZ 2.7Å; E610-K614 PolarHBondContact OE1-NZ 3.22Å
611	M	92.9	Very high	92.8	Very high	131 Å²	131	107.6 Å²	107.6	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-59.9	-44.5	174.1	-75.1	-174.2	54.6	0	0	111.8	L607 E608 A613 K614 E615	L607-M611 PolarHBondContact O-N 2.74Å; L607-M611 VanDerWaalsContact O-N 3.08Å; E608-M611 PolarHBondContact O-N 3.19Å; M611-A613 PolarHBondContact O-N 3.38Å; M611-K614 PolarHBondContact O-N 3.3Å; M611-E615 PolarHBondContact O-N 3.31Å
612	Y	94.1	Very high	92.9	Very high	157 Å²	157	109.8 Å²	109.8	62%	0.616	53%	0.531	S	S	*	.	H	α-helix	trans	-63	-40.8	176.2	-178.7	-97.9	0	0	0	112.3	E608 L609 E610 K614 E615 A616	E608-Y612 PolarHBondContact O-N 2.99Å; E608-Y612 VanDerWaalsContact O-N 3.07Å; L609-Y612 PolarHBondContact O-N 3.3Å; E610-Y612 VanDerWaalsContact C-N 3.34Å; E610-Y612 PolarHBondContact O-N 3.46Å; Y612-K614 PolarHBondContact O-N 2.89Å; Y612-E615 PolarHBondContact O-N 2.71Å; Y612-A616 PolarHBondContact O-N 3.39Å
613	A	92.3	Very high	93.1	Very high	47 Å²	47	111.1 Å²	111.1	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-63.1	-40.5	176.2	0	0	0	0	0	112	L609 E610 M611 A616 L617	L609-A613 WeakPolarHBondContact O-CB 3.26Å; L609-A613 PolarHBondContact O-N 3.03Å; E610-A613 PolarHBondContact O-N 2.76Å; M611-A613 PolarHBondContact O-N 3.38Å; A613-A616 PolarHBondContact O-N 3.48Å; A613-L617 WeakPolarHBondContact O-CG 3.18Å; A613-L617 PolarHBondContact O-N 3.27Å
614	K	93.5	Very high	93.2	Very high	119 Å²	119	111.2 Å²	111.2	52%	0.517	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-42	173.9	-78	171.3	169.2	162.3	0	112.1	E610 M611 Y612 L617 Q618	E610-K614 PolarHBondContact O-N 3.32Å; E610-K614 WeakPolarHBondContact OE1-CE 3.48Å; E610-K614 IonicContact OE1-NZ 2.7Å; E610-K614 PolarHBondContact OE1-NZ 3.22Å; M611-K614 PolarHBondContact O-N 3.3Å; Y612-K614 PolarHBondContact O-N 2.89Å; K614-L617 PolarHBondContact O-N 3.26Å; K614-Q618 PolarHBondContact O-N 2.94Å; K614-Q618 VanDerWaalsContact O-N 3.14Å
615	E	94	Very high	93.3	Very high	94 Å²	94	111 Å²	111	44%	0.439	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-40.3	175.5	-165.1	-167.1	148.6	0	0	111.9	M611 Y612 Q618 K619	M611-E615 PolarHBondContact O-N 3.31Å; Y612-E615 PolarHBondContact O-N 2.71Å; E615-Q618 PolarHBondContact O-N 3.22Å; E615-K619 PolarHBondContact O-N 3.41Å; E615-K619 VanDerWaalsContact O-N 3.14Å; E615-K619 VanDerWaalsContact OE1-CE 3.26Å; E615-K619 WeakPolarHBondContact OE1-CE 3.33Å; E615-K619 IonicContact OE1-NZ 3.08Å; E615-K619 PolarHBondContact OE1-NZ 3.45Å
616	A	92.5	Very high	93.4	Very high	43 Å²	43	110.7 Å²	110.7	36%	0.355	54%	0.536	S	S	.	.	H	α-helix	trans	-64.3	-40	176.6	0	0	0	0	0	112.4	Y612 A613 K619 L620	Y612-A616 PolarHBondContact O-N 3.39Å; A613-A616 PolarHBondContact O-N 3.48Å; A616-K619 PolarHBondContact O-N 2.83Å; A616-L620 PolarHBondContact O-N 3.34Å
617	L	93.4	Very high	93.5	Very high	102 Å²	102	108.7 Å²	108.7	53%	0.534	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-45.4	174.7	-76.8	167.6	0	0	0	111.7	A613 K614 K619 L620 D621	A613-L617 WeakPolarHBondContact O-CG 3.18Å; A613-L617 PolarHBondContact O-N 3.27Å; K614-L617 PolarHBondContact O-N 3.26Å; L617-K619 VanDerWaalsContact C-N 3.26Å; L617-K619 PolarHBondContact O-N 3.31Å; L617-L620 WeakPolarHBondContact O-CB 3.26Å; L617-L620 PolarHBondContact O-N 3.47Å; L617-D621 PolarHBondContact O-N 2.99Å
618	Q	93.2	Very high	93.5	Very high	120 Å²	120	108.5 Å²	108.5	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-60.3	-35.4	175.9	-72	-179.1	-1.3	0	0	112.9	K614 E615 R622	K614-Q618 PolarHBondContact O-N 2.94Å; K614-Q618 VanDerWaalsContact O-N 3.14Å; E615-Q618 PolarHBondContact O-N 3.22Å; Q618-R622 WeakPolarHBondContact O-CG 3.15Å; Q618-R622 PolarHBondContact O-N 3.33Å
619	K	94.5	Very high	93.6	Very high	106 Å²	106	105.9 Å²	105.9	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-68.1	-38	174.3	-71.8	173.9	-174.5	163.8	0	111.7	E615 A616 L617 R622 I623	E615-K619 PolarHBondContact O-N 3.41Å; E615-K619 VanDerWaalsContact O-N 3.14Å; E615-K619 VanDerWaalsContact OE1-CE 3.26Å; E615-K619 WeakPolarHBondContact OE1-CE 3.33Å; E615-K619 IonicContact OE1-NZ 3.08Å; E615-K619 PolarHBondContact OE1-NZ 3.45Å; A616-K619 PolarHBondContact O-N 2.83Å; L617-K619 VanDerWaalsContact C-N 3.26Å; L617-K619 PolarHBondContact O-N 3.31Å; K619-R622 PolarHBondContact O-N 3.07Å; K619-I623 WeakPolarHBondContact O-CG1 3.42Å; K619-I623 PolarHBondContact O-N 3.34Å; K619-I623 VanDerWaalsContact O-N 3.12Å
620	L	93.8	Very high	93.6	Very high	104 Å²	104	104.3 Å²	104.3	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-41.2	176.8	-170.5	67.9	0	0	0	111.7	A616 L617 R622 I623 K624	A616-L620 PolarHBondContact O-N 3.34Å; L617-L620 WeakPolarHBondContact O-CB 3.26Å; L617-L620 PolarHBondContact O-N 3.47Å; L620-R622 VanDerWaalsContact C-N 3.31Å; L620-R622 PolarHBondContact O-N 3.46Å; L620-I623 PolarHBondContact O-N 3.3Å; L620-I623 VanDerWaalsContact O-N 3.17Å; L620-K624 PolarHBondContact O-N 3.11Å
621	D	94.3	Very high	93.6	Very high	100 Å²	100	102.4 Å²	102.4	54%	0.535	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-38.8	176.2	-69.9	-29.8	0	0	0	111.9	L617 K624 Q625	L617-D621 PolarHBondContact O-N 2.99Å; D621-K624 PolarHBondContact O-N 3.3Å; D621-Q625 PolarHBondContact O-N 3.48Å
622	R	94.3	Very high	93.5	Very high	165 Å²	165	101.9 Å²	101.9	62%	0.623	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-44.3	172.8	-70.8	179.7	-170.7	179.4	4	112.3	Q618 K619 L620 K624 Q625 E626	Q618-R622 WeakPolarHBondContact O-CG 3.15Å; Q618-R622 PolarHBondContact O-N 3.33Å; K619-R622 PolarHBondContact O-N 3.07Å; L620-R622 VanDerWaalsContact C-N 3.31Å; L620-R622 PolarHBondContact O-N 3.46Å; R622-K624 VanDerWaalsContact C-N 3.32Å; R622-K624 PolarHBondContact O-N 3.35Å; R622-Q625 PolarHBondContact O-N 2.93Å; R622-E626 PolarHBondContact O-N 2.9Å
623	I	94.3	Very high	93.3	Very high	94 Å²	94	102 Å²	102	48%	0.482	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-41.3	177.2	-67.3	167.3	0	0	0	110.4	K619 L620 Q625 E626 V627	K619-I623 WeakPolarHBondContact O-CG1 3.42Å; K619-I623 PolarHBondContact O-N 3.34Å; K619-I623 VanDerWaalsContact O-N 3.12Å; L620-I623 PolarHBondContact O-N 3.3Å; L620-I623 VanDerWaalsContact O-N 3.17Å; I623-Q625 VanDerWaalsContact C-N 3.34Å; I623-Q625 PolarHBondContact O-N 3.08Å; I623-E626 PolarHBondContact O-N 2.82Å; I623-V627 HydrophobicContact CG2-CG2 4.44Å; I623-V627 WeakPolarHBondContact O-CG2 3.31Å; I623-V627 PolarHBondContact O-N 3.25Å
624	K	94.5	Very high	93.3	Very high	131 Å²	131	106.2 Å²	106.2	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-58.5	-47	176	-176.4	-178.9	175.4	-175.8	0	111.2	L620 D621 R622 E626 V627 D628	L620-K624 PolarHBondContact O-N 3.11Å; D621-K624 PolarHBondContact O-N 3.3Å; R622-K624 VanDerWaalsContact C-N 3.32Å; R622-K624 PolarHBondContact O-N 3.35Å; K624-E626 VanDerWaalsContact C-N 3.34Å; K624-E626 PolarHBondContact O-N 3.44Å; K624-V627 WeakPolarHBondContact O-CB 3.43Å; K624-V627 PolarHBondContact O-N 2.89Å; K624-V627 VanDerWaalsContact O-N 3.15Å; K624-D628 PolarHBondContact O-N 2.99Å
625	Q	93.8	Very high	93.3	Very high	119 Å²	119	104.1 Å²	104.1	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-59.2	-43.1	176.2	-173.5	-179.3	-1.2	0	0	112.3	D621 R622 I623 V627 D628 E629	D621-Q625 PolarHBondContact O-N 3.48Å; R622-Q625 PolarHBondContact O-N 2.93Å; I623-Q625 VanDerWaalsContact C-N 3.34Å; I623-Q625 PolarHBondContact O-N 3.08Å; Q625-V627 VanDerWaalsContact C-N 3.34Å; Q625-V627 PolarHBondContact O-N 3.24Å; Q625-D628 PolarHBondContact O-N 3.01Å; Q625-E629 WeakPolarHBondContact O-CG 3.14Å; Q625-E629 PolarHBondContact O-N 3.06Å
626	E	94	Very high	93.2	Very high	126 Å²	126	103.7 Å²	103.7	59%	0.589	51%	0.51	S	S	*	.	H	α-helix	trans	-62.4	-40.1	175.5	-72	178	-173.5	0	0	112.1	R622 I623 K624 E629 T630	R622-E626 PolarHBondContact O-N 2.9Å; I623-E626 PolarHBondContact O-N 2.82Å; K624-E626 VanDerWaalsContact C-N 3.34Å; K624-E626 PolarHBondContact O-N 3.44Å; E626-E629 PolarHBondContact O-N 3.47Å; E626-T630 WeakPolarHBondContact O-CG2 3.42Å; E626-T630 PolarHBondContact O-N 2.81Å; E626-T630 PolarHBondContact O-OG1 2.98Å
627	V	93.4	Very high	93.1	Very high	73 Å²	73	106.3 Å²	106.3	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-45.5	175.6	171.1	0	0	0	0	110.9	I623 K624 Q625 E629 T630 T631	I623-V627 HydrophobicContact CG2-CG2 4.44Å; I623-V627 WeakPolarHBondContact O-CG2 3.31Å; I623-V627 PolarHBondContact O-N 3.25Å; K624-V627 WeakPolarHBondContact O-CB 3.43Å; K624-V627 PolarHBondContact O-N 2.89Å; K624-V627 VanDerWaalsContact O-N 3.15Å; Q625-V627 VanDerWaalsContact C-N 3.34Å; Q625-V627 PolarHBondContact O-N 3.24Å; V627-E629 VanDerWaalsContact C-N 3.33Å; V627-E629 PolarHBondContact O-N 3.31Å; V627-T630 WeakPolarHBondContact CA-OG1 3.47Å; V627-T630 PolarHBondContact O-N 3.49Å; V627-T630 PolarHBondContact O-OG1 3.14Å; V627-T631 WeakPolarHBondContact O-CB 3.49Å; V627-T631 PolarHBondContact O-N 3.39Å; V627-T631 PolarHBondContact O-OG1 3.4Å
628	D	93.4	Very high	93	Very high	93 Å²	93	110.7 Å²	110.7	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-61	-43.2	178.2	-66.9	-23.6	0	0	0	111	K624 Q625 T630 T631 Q632	K624-D628 PolarHBondContact O-N 2.99Å; Q625-D628 PolarHBondContact O-N 3.01Å; D628-T630 PolarHBondContact O-N 2.99Å; D628-T631 PolarHBondContact O-N 2.81Å; D628-Q632 WeakPolarHBondContact O-CB 3.23Å; D628-Q632 PolarHBondContact O-N 3.03Å
629	E	92.8	Very high	92.9	Very high	89 Å²	89	110.3 Å²	110.3	42%	0.416	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-43.4	174	-74.2	-175.4	-162.3	0	0	112.7	Q625 E626 V627 T631 Q632 R633	Q625-E629 WeakPolarHBondContact O-CG 3.14Å; Q625-E629 PolarHBondContact O-N 3.06Å; E626-E629 PolarHBondContact O-N 3.47Å; V627-E629 VanDerWaalsContact C-N 3.33Å; V627-E629 PolarHBondContact O-N 3.31Å; E629-T631 VanDerWaalsContact C-N 3.33Å; E629-Q632 PolarHBondContact O-N 3.17Å; E629-R633 WeakPolarHBondContact O-CG 3.39Å; E629-R633 PolarHBondContact O-N 3.45Å; E629-R633 IonicContact OE2-NH2 3.49Å
630	T	93	Very high	92.8	Very high	78 Å²	78	108.1 Å²	108.1	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-36.8	177.8	64	0	0	0	0	112.2	E626 V627 D628 R633 Q634	E626-T630 WeakPolarHBondContact O-CG2 3.42Å; E626-T630 PolarHBondContact O-N 2.81Å; E626-T630 PolarHBondContact O-OG1 2.98Å; V627-T630 WeakPolarHBondContact CA-OG1 3.47Å; V627-T630 PolarHBondContact O-N 3.49Å; V627-T630 PolarHBondContact O-OG1 3.14Å; D628-T630 PolarHBondContact O-N 2.99Å; T630-R633 PolarHBondContact O-N 3.27Å; T630-Q634 WeakPolarHBondContact O-CB 3.43Å; T630-Q634 PolarHBondContact O-N 2.97Å
631	T	93.2	Very high	92.7	Very high	60 Å²	60	107.4 Å²	107.4	37%	0.368	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-44.2	176.2	-53.7	0	0	0	0	110.1	V627 D628 E629 R633 Q634 I635	V627-T631 WeakPolarHBondContact O-CB 3.49Å; V627-T631 PolarHBondContact O-N 3.39Å; V627-T631 PolarHBondContact O-OG1 3.4Å; D628-T631 PolarHBondContact O-N 2.81Å; E629-T631 VanDerWaalsContact C-N 3.33Å; T631-R633 PolarHBondContact O-N 3.31Å; T631-Q634 WeakPolarHBondContact O-CB 3.35Å; T631-Q634 PolarHBondContact O-N 3.2Å; T631-Q634 VanDerWaalsContact O-N 3.11Å; T631-I635 HydrophobicContact CG2-CD1 4.48Å; T631-I635 WeakPolarHBondContact O-CG1 3.48Å; T631-I635 PolarHBondContact O-N 2.9Å
632	Q	91.5	Very high	92.5	Very high	120 Å²	120	107.3 Å²	107.3	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-61.3	-42.9	175	-166.1	67.9	-3.4	0	0	112	D628 E629 Q634 I635 V636	D628-Q632 WeakPolarHBondContact O-CB 3.23Å; D628-Q632 PolarHBondContact O-N 3.03Å; E629-Q632 PolarHBondContact O-N 3.17Å; Q632-Q634 VanDerWaalsContact C-N 3.3Å; Q632-Q634 PolarHBondContact O-N 3.12Å; Q632-I635 PolarHBondContact O-N 3.24Å; Q632-V636 WeakPolarHBondContact O-CG2 3.33Å; Q632-V636 PolarHBondContact O-N 2.72Å; Q632-V636 VanDerWaalsContact O-N 3.14Å
633	R	90.7	Very high	92.5	Very high	158 Å²	158	106.8 Å²	106.8	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-60.7	-39.6	173.5	-69.6	175.2	-163.5	180	9.9	111.7	E629 T630 T631 V636 I637	E629-R633 WeakPolarHBondContact O-CG 3.39Å; E629-R633 PolarHBondContact O-N 3.45Å; E629-R633 IonicContact OE2-NH2 3.49Å; T630-R633 PolarHBondContact O-N 3.27Å; T631-R633 PolarHBondContact O-N 3.31Å; R633-V636 PolarHBondContact O-N 2.91Å; R633-I637 VanDerWaalsContact O-CG1 3.3Å; R633-I637 WeakPolarHBondContact O-CG1 3.09Å; R633-I637 PolarHBondContact O-N 3.26Å
634	Q	91.7	Very high	92.3	Very high	136 Å²	136	107.1 Å²	107.1	64%	0.636	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-39.4	178.3	-168	177.1	9.6	0	0	112.3	T630 T631 Q632 I637 R638	T630-Q634 WeakPolarHBondContact O-CB 3.43Å; T630-Q634 PolarHBondContact O-N 2.97Å; T631-Q634 WeakPolarHBondContact O-CB 3.35Å; T631-Q634 PolarHBondContact O-N 3.2Å; T631-Q634 VanDerWaalsContact O-N 3.11Å; Q632-Q634 VanDerWaalsContact C-N 3.3Å; Q632-Q634 PolarHBondContact O-N 3.12Å; Q634-I637 PolarHBondContact O-N 2.68Å; Q634-R638 WeakPolarHBondContact O-CB 3.39Å; Q634-R638 PolarHBondContact O-N 3.49Å
635	I	92.4	Very high	92.2	Very high	76 Å²	76	106.2 Å²	106.2	39%	0.39	52%	0.516	S	S	.	.	H	α-helix	trans	-60.1	-47.1	174.2	-67.4	166.5	0	0	0	110.4	T631 Q632 I637 R638 Q639	T631-I635 HydrophobicContact CG2-CD1 4.48Å; T631-I635 WeakPolarHBondContact O-CG1 3.48Å; T631-I635 PolarHBondContact O-N 2.9Å; Q632-I635 PolarHBondContact O-N 3.24Å; I635-I637 PolarHBondContact O-N 2.69Å; I635-R638 WeakPolarHBondContact O-CB 3.35Å; I635-R638 PolarHBondContact O-N 2.96Å; I635-R638 VanDerWaalsContact O-N 3.17Å; I635-Q639 WeakPolarHBondContact O-CG 3.2Å; I635-Q639 PolarHBondContact O-N 3.05Å
636	V	91.5	Very high	92.1	Very high	84 Å²	84	106.5 Å²	106.5	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-43.1	177.4	174.7	0	0	0	0	111.7	Q632 R633 R638 Q639 S640	Q632-V636 WeakPolarHBondContact O-CG2 3.33Å; Q632-V636 PolarHBondContact O-N 2.72Å; Q632-V636 VanDerWaalsContact O-N 3.14Å; R633-V636 PolarHBondContact O-N 2.91Å; V636-R638 VanDerWaalsContact C-N 3.33Å; V636-R638 PolarHBondContact O-N 3.33Å; V636-Q639 PolarHBondContact O-N 3.49Å; V636-S640 WeakPolarHBondContact O-CB 3.36Å; V636-S640 PolarHBondContact O-N 3.49Å
637	I	91	Very high	92.1	Very high	99 Å²	99	109.1 Å²	109.1	51%	0.508	52%	0.52	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.5	-68.9	165.8	0	0	0	110.8	R633 Q634 I635 S640 N641	R633-I637 VanDerWaalsContact O-CG1 3.3Å; R633-I637 WeakPolarHBondContact O-CG1 3.09Å; R633-I637 PolarHBondContact O-N 3.26Å; Q634-I637 PolarHBondContact O-N 2.68Å; I635-I637 PolarHBondContact O-N 2.69Å; I637-S640 PolarHBondContact O-N 2.96Å; I637-N641 WeakPolarHBondContact O-CB 3.17Å; I637-N641 PolarHBondContact O-N 3.02Å
638	R	91.9	Very high	92	Very high	194 Å²	194	111 Å²	111	73%	0.732	52%	0.522	S	S	*	.	H	α-helix	trans	-62.4	-46.3	178.6	-172.3	178.7	-179.9	178.8	-0.7	111.5	Q634 I635 V636 S640 N641 E642	Q634-R638 WeakPolarHBondContact O-CB 3.39Å; Q634-R638 PolarHBondContact O-N 3.49Å; I635-R638 WeakPolarHBondContact O-CB 3.35Å; I635-R638 PolarHBondContact O-N 2.96Å; I635-R638 VanDerWaalsContact O-N 3.17Å; V636-R638 VanDerWaalsContact C-N 3.33Å; V636-R638 PolarHBondContact O-N 3.33Å; R638-S640 VanDerWaalsContact C-N 3.34Å; R638-S640 PolarHBondContact O-N 3.28Å; R638-N641 PolarHBondContact O-N 3.41Å; R638-E642 PolarHBondContact O-N 3.28Å
639	Q	91.2	Very high	91.8	Very high	111 Å²	111	111.3 Å²	111.3	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-41.4	175.4	-70.5	177.6	-9.9	0	0	111.9	I635 V636 E642 K643	I635-Q639 WeakPolarHBondContact O-CG 3.2Å; I635-Q639 PolarHBondContact O-N 3.05Å; V636-Q639 PolarHBondContact O-N 3.49Å; Q639-E642 PolarHBondContact O-N 3.31Å; Q639-K643 WeakPolarHBondContact O-CG 3.31Å; Q639-K643 PolarHBondContact O-N 3.07Å; Q639-K643 VanDerWaalsContact O-N 3.12Å
640	S	92.3	Very high	91.7	Very high	60 Å²	60	113.5 Å²	113.5	42%	0.42	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-44.8	174.8	-177.4	0	0	0	0	112.2	V636 I637 R638 E642 K643 L644	V636-S640 WeakPolarHBondContact O-CB 3.36Å; V636-S640 PolarHBondContact O-N 3.49Å; I637-S640 PolarHBondContact O-N 2.96Å; R638-S640 VanDerWaalsContact C-N 3.34Å; R638-S640 PolarHBondContact O-N 3.28Å; S640-E642 VanDerWaalsContact C-N 3.33Å; S640-E642 PolarHBondContact O-N 2.89Å; S640-K643 WeakPolarHBondContact O-CB 3.45Å; S640-K643 PolarHBondContact O-N 2.85Å; S640-L644 WeakPolarHBondContact O-CG 3.26Å; S640-L644 PolarHBondContact O-N 3.41Å
641	N	91.5	Very high	91.5	Very high	89 Å²	89	114.4 Å²	114.4	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-36.2	177.1	-77.2	-17.4	0	0	0	112.4	I637 R638 L644 F645	I637-N641 WeakPolarHBondContact O-CB 3.17Å; I637-N641 PolarHBondContact O-N 3.02Å; R638-N641 PolarHBondContact O-N 3.41Å; N641-L644 PolarHBondContact O-N 3.2Å; N641-F645 VanDerWaalsContact O-CB 3.29Å; N641-F645 WeakPolarHBondContact O-CB 3.5Å; N641-F645 PolarHBondContact O-N 3.21Å
642	E	90.9	Very high	91.3	Very high	98 Å²	98	116.1 Å²	116.1	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-64.6	-42.5	174.6	-163.7	-169.3	144.7	0	0	111.3	R638 Q639 S640 F645 K646	R638-E642 PolarHBondContact O-N 3.28Å; Q639-E642 PolarHBondContact O-N 3.31Å; S640-E642 VanDerWaalsContact C-N 3.33Å; S640-E642 PolarHBondContact O-N 2.89Å; E642-F645 PolarHBondContact O-N 3.36Å; E642-K646 WeakPolarHBondContact O-CG 3.31Å; E642-K646 PolarHBondContact O-N 2.8Å; E642-K646 WeakPolarHBondContact OE1-CE 3.46Å; E642-K646 IonicContact OE1-NZ 2.84Å; E642-K646 PolarHBondContact OE1-NZ 3.41Å
643	K	92.3	Very high	91.2	Very high	155 Å²	155	116.8 Å²	116.8	67%	0.674	53%	0.533	S	S	*	.	H	α-helix	trans	-61.4	-43.4	172.7	-70.4	177.7	-178.3	-179.9	0	111.7	Q639 S640 F645 K646 R647	Q639-K643 WeakPolarHBondContact O-CG 3.31Å; Q639-K643 PolarHBondContact O-N 3.07Å; Q639-K643 VanDerWaalsContact O-N 3.12Å; S640-K643 WeakPolarHBondContact O-CB 3.45Å; S640-K643 PolarHBondContact O-N 2.85Å; K643-F645 VanDerWaalsContact C-N 3.32Å; K643-F645 PolarHBondContact O-N 3.22Å; K643-K646 PolarHBondContact O-N 2.93Å; K643-R647 WeakPolarHBondContact O-CB 3.4Å; K643-R647 PolarHBondContact O-N 2.92Å
644	L	91.5	Very high	90.9	Very high	101 Å²	101	114.1 Å²	114.1	53%	0.529	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-39.5	174.8	-75.7	171.6	0	0	0	111.8	S640 N641 R647 K648	S640-L644 WeakPolarHBondContact O-CG 3.26Å; S640-L644 PolarHBondContact O-N 3.41Å; N641-L644 PolarHBondContact O-N 3.2Å; L644-R647 PolarHBondContact O-N 3.13Å; L644-K648 WeakPolarHBondContact O-CB 3.24Å; L644-K648 PolarHBondContact O-N 3.34Å
645	F	92.7	Very high	90.4	Very high	111 Å²	111	113.1 Å²	113.1	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-67.1	-46	178	-176.2	-101.3	0	0	0	111.8	N641 E642 K643 R647 K648 Q649	N641-F645 VanDerWaalsContact O-CB 3.29Å; N641-F645 WeakPolarHBondContact O-CB 3.5Å; N641-F645 PolarHBondContact O-N 3.21Å; E642-F645 PolarHBondContact O-N 3.36Å; K643-F645 VanDerWaalsContact C-N 3.32Å; K643-F645 PolarHBondContact O-N 3.22Å; F645-R647 VanDerWaalsContact C-N 3.28Å; F645-R647 PolarHBondContact O-N 3.34Å; F645-K648 WeakPolarHBondContact O-CB 3.28Å; F645-K648 PolarHBondContact O-N 3.37Å; F645-K648 VanDerWaalsContact O-N 3.16Å; F645-Q649 HydrophobicContact CD1-CG 4.29Å; F645-Q649 VanDerWaalsContact CE1-CD 3.44Å; F645-Q649 HydrophobicContact CE1-CG 3.95Å; F645-Q649 HydrophobicContact CZ-CG 4.09Å; F645-Q649 PolarHBondContact O-N 3.01Å
646	K	92	Very high	89.6	Confident	125 Å²	125	115.5 Å²	115.5	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-57.4	-42.7	172.8	-72.6	176.9	-175.4	168.7	0	111.1	E642 K643 Q649 Y650	E642-K646 WeakPolarHBondContact O-CG 3.31Å; E642-K646 PolarHBondContact O-N 2.8Å; E642-K646 WeakPolarHBondContact OE1-CE 3.46Å; E642-K646 IonicContact OE1-NZ 2.84Å; E642-K646 PolarHBondContact OE1-NZ 3.41Å; K643-K646 PolarHBondContact O-N 2.93Å; K646-Q649 PolarHBondContact O-N 3.47Å; K646-Y650 WeakPolarHBondContact O-CB 3.4Å; K646-Y650 PolarHBondContact O-N 3.13Å
647	R	92.2	Very high	89	Confident	181 Å²	181	116.6 Å²	116.6	68%	0.683	53%	0.531	S	S	*	.	H	α-helix	trans	-67	-39.2	176.1	-168.5	162.8	-177.9	137.3	-2.9	112.6	K643 L644 F645 Y650 L651	K643-R647 WeakPolarHBondContact O-CB 3.4Å; K643-R647 PolarHBondContact O-N 2.92Å; L644-R647 PolarHBondContact O-N 3.13Å; F645-R647 VanDerWaalsContact C-N 3.28Å; F645-R647 PolarHBondContact O-N 3.34Å; R647-Y650 PolarHBondContact O-N 3.12Å; R647-L651 HydrophobicContact CG-CD1 4.47Å; R647-L651 VanDerWaalsContact O-CG 3.29Å; R647-L651 WeakPolarHBondContact O-CG 3.26Å; R647-L651 PolarHBondContact O-N 3.49Å
648	K	91.7	Very high	88.1	Confident	112 Å²	112	117.3 Å²	117.3	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-49.5	173.7	178.4	-177.4	166.6	-177.1	0	110.7	L644 F645 Y650 L651 E652	L644-K648 WeakPolarHBondContact O-CB 3.24Å; L644-K648 PolarHBondContact O-N 3.34Å; F645-K648 WeakPolarHBondContact O-CB 3.28Å; F645-K648 PolarHBondContact O-N 3.37Å; F645-K648 VanDerWaalsContact O-N 3.16Å; K648-Y650 VanDerWaalsContact C-N 3.31Å; K648-Y650 PolarHBondContact O-N 3.49Å; K648-L651 CarbonylContact O-C 3.57Å; K648-L651 WeakPolarHBondContact O-CB 3.35Å; K648-L651 PolarHBondContact O-N 3.17Å; K648-L651 VanDerWaalsContact O-N 3.11Å; K648-E652 WeakPolarHBondContact CE-OE1 3.38Å; K648-E652 HydrophobicContact CG-CG 4.34Å; K648-E652 IonicContact NZ-OE1 2.76Å; K648-E652 WeakPolarHBondContact O-CB 3.26Å; K648-E652 WeakPolarHBondContact O-CG 2.99Å; K648-E652 PolarHBondContact O-N 3.06Å
649	Q	90.3	Very high	86.6	Confident	100 Å²	100	111 Å²	111	47%	0.467	52%	0.521	S	S	.	.	H	α-helix	trans	-59.7	-41.6	176.9	-75.6	-169.2	-19.9	0	0	112.1	F645 K646 L651 E652 K653	F645-Q649 HydrophobicContact CD1-CG 4.29Å; F645-Q649 VanDerWaalsContact CE1-CD 3.44Å; F645-Q649 HydrophobicContact CE1-CG 3.95Å; F645-Q649 HydrophobicContact CZ-CG 4.09Å; F645-Q649 PolarHBondContact O-N 3.01Å; K646-Q649 PolarHBondContact O-N 3.47Å; Q649-L651 VanDerWaalsContact C-N 3.34Å; Q649-L651 PolarHBondContact O-N 2.84Å; Q649-E652 PolarHBondContact O-N 3.43Å; Q649-K653 WeakPolarHBondContact O-CB 3.43Å; Q649-K653 PolarHBondContact O-N 3.42Å
650	Y	91	Very high	84.7	Confident	135 Å²	135	112.2 Å²	112.2	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-59.4	-45.3	173.6	174.4	-94.7	0	0	0	111.6	K646 R647 K648 K653 K654	K646-Y650 WeakPolarHBondContact O-CB 3.4Å; K646-Y650 PolarHBondContact O-N 3.13Å; R647-Y650 PolarHBondContact O-N 3.12Å; K648-Y650 VanDerWaalsContact C-N 3.31Å; K648-Y650 PolarHBondContact O-N 3.49Å; Y650-K653 PolarHBondContact O-N 2.87Å; Y650-K654 HydrophobicContact CE1-CD 4.02Å; Y650-K654 WeakPolarHBondContact O-CB 3.46Å; Y650-K654 PolarHBondContact O-N 2.98Å; Y650-K654 PolarHBondContact OH-NZ 2.6Å; Y650-K654 VanDerWaalsContact OH-NZ 3.11Å
651	L	88.8	Confident	82.9	Confident	98 Å²	98	119.9 Å²	119.9	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-66.9	-39	176.8	-71.6	170.9	0	0	0	112.5	R647 K648 Q649 K654 L655	R647-L651 HydrophobicContact CG-CD1 4.47Å; R647-L651 VanDerWaalsContact O-CG 3.29Å; R647-L651 WeakPolarHBondContact O-CG 3.26Å; R647-L651 PolarHBondContact O-N 3.49Å; K648-L651 CarbonylContact O-C 3.57Å; K648-L651 WeakPolarHBondContact O-CB 3.35Å; K648-L651 PolarHBondContact O-N 3.17Å; K648-L651 VanDerWaalsContact O-N 3.11Å; Q649-L651 VanDerWaalsContact C-N 3.34Å; Q649-L651 PolarHBondContact O-N 2.84Å; L651-K654 PolarHBondContact O-N 3.4Å; L651-L655 VanDerWaalsContact O-CB 3.24Å; L651-L655 WeakPolarHBondContact O-CB 3.43Å; L651-L655 PolarHBondContact O-N 2.92Å
652	E	88.4	Confident	80.4	Confident	95 Å²	95	124 Å²	124	44%	0.444	56%	0.56	S	S	.	*	H	α-helix	trans	-65.4	-42.1	175.2	-77.1	178.1	163.7	0	0	111.2	K648 Q649 K654 L655 K656	K648-E652 WeakPolarHBondContact CE-OE1 3.38Å; K648-E652 HydrophobicContact CG-CG 4.34Å; K648-E652 IonicContact NZ-OE1 2.76Å; K648-E652 WeakPolarHBondContact O-CB 3.26Å; K648-E652 WeakPolarHBondContact O-CG 2.99Å; K648-E652 PolarHBondContact O-N 3.06Å; Q649-E652 PolarHBondContact O-N 3.43Å; E652-K654 VanDerWaalsContact C-N 3.34Å; E652-L655 CarbonylContact O-C 3.3Å; E652-L655 PolarHBondContact O-N 2.85Å; E652-K656 VanDerWaalsContact O-CB 3.23Å; E652-K656 WeakPolarHBondContact O-CB 3.48Å; E652-K656 PolarHBondContact O-N 2.83Å
653	K	88.1	Confident	77.6	Confident	135 Å²	135	130.4 Å²	130.4	59%	0.587	58%	0.58	S	S	*	*	H	α-helix	trans	-60.3	-45.9	173	-175	179.9	176.5	-177.8	0	110.7	Q649 Y650 L655 K656 E657	Q649-K653 WeakPolarHBondContact O-CB 3.43Å; Q649-K653 PolarHBondContact O-N 3.42Å; Y650-K653 PolarHBondContact O-N 2.87Å; K653-L655 VanDerWaalsContact C-N 3.35Å; K653-L655 PolarHBondContact O-N 2.87Å; K653-K656 WeakPolarHBondContact O-CB 3.19Å; K653-K656 PolarHBondContact O-N 2.76Å; K653-E657 WeakPolarHBondContact CE-OE1 3.44Å; K653-E657 WeakPolarHBondContact O-CG 3.49Å; K653-E657 PolarHBondContact O-N 2.84Å
654	K	84.9	Confident	74.5	Confident	101 Å²	101	131.4 Å²	131.4	44%	0.439	59%	0.587	S	S	.	*	H	α-helix	trans	-65.2	-37.6	177.2	-149.4	172	-168.8	168.2	0	112.1	Y650 L651 E652 K656 L658	Y650-K654 HydrophobicContact CE1-CD 4.02Å; Y650-K654 WeakPolarHBondContact O-CB 3.46Å; Y650-K654 PolarHBondContact O-N 2.98Å; Y650-K654 PolarHBondContact OH-NZ 2.6Å; Y650-K654 VanDerWaalsContact OH-NZ 3.11Å; L651-K654 PolarHBondContact O-N 3.4Å; E652-K654 VanDerWaalsContact C-N 3.34Å; K654-K656 VanDerWaalsContact C-N 3.35Å; K654-L658 VanDerWaalsContact O-CG 3.27Å; K654-L658 WeakPolarHBondContact O-CG 3.47Å; K654-L658 PolarHBondContact O-N 2.93Å
655	L	80.8	Confident	71.5	Confident	116 Å²	116	134.7 Å²	134.7	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-67.3	-38.1	173.5	-174.5	69	0	0	0	110.8	L651 E652 K653 L658 S659	L651-L655 VanDerWaalsContact O-CB 3.24Å; L651-L655 WeakPolarHBondContact O-CB 3.43Å; L651-L655 PolarHBondContact O-N 2.92Å; E652-L655 CarbonylContact O-C 3.3Å; E652-L655 PolarHBondContact O-N 2.85Å; K653-L655 VanDerWaalsContact C-N 3.35Å; K653-L655 PolarHBondContact O-N 2.87Å; L655-L658 CarbonylContact O-C 3.59Å; L655-L658 WeakPolarHBondContact O-CB 3.28Å; L655-L658 PolarHBondContact O-N 3.26Å; L655-S659 WeakPolarHBondContact O-CB 3.2Å; L655-S659 PolarHBondContact O-N 3.17Å; L655-S659 PolarHBondContact O-OG 2.83Å
656	K	77	Confident	68.3	Low	126 Å²	126	137.4 Å²	137.4	55%	0.548	61%	0.614	S	S	.	*	H	α-helix	trans	-66.8	-44.4	177.2	-165.6	-179.6	-177.4	-169.3	0	111.4	E652 K653 K654 L658 S659 E660	E652-K656 VanDerWaalsContact O-CB 3.23Å; E652-K656 WeakPolarHBondContact O-CB 3.48Å; E652-K656 PolarHBondContact O-N 2.83Å; K653-K656 WeakPolarHBondContact O-CB 3.19Å; K653-K656 PolarHBondContact O-N 2.76Å; K654-K656 VanDerWaalsContact C-N 3.35Å; K656-L658 PolarHBondContact O-N 2.88Å; K656-S659 WeakPolarHBondContact CA-OG 3.38Å; K656-S659 CarbonylContact O-C 3.59Å; K656-S659 PolarHBondContact O-N 3.34Å; K656-S659 VanDerWaalsContact O-N 3.11Å; K656-S659 PolarHBondContact O-OG 2.66Å; K656-E660 VanDerWaalsContact CE-OE1 3.23Å; K656-E660 WeakPolarHBondContact CE-OE1 3.45Å; K656-E660 HydrophobicContact CG-CG 4.45Å; K656-E660 WeakPolarHBondContact O-CB 3.43Å; K656-E660 WeakPolarHBondContact O-CG 3.43Å; K656-E660 PolarHBondContact O-N 3.44Å
657	E	78.5	Confident	65.1	Low	107 Å²	107	138 Å²	138	50%	0.5	62%	0.622	S	S	.	*	H	α-helix	trans	-58.4	-37	170.9	-73.3	169.3	-169.8	0	0	111.7	K653	K653-E657 WeakPolarHBondContact CE-OE1 3.44Å; K653-E657 WeakPolarHBondContact O-CG 3.49Å; K653-E657 PolarHBondContact O-N 2.84Å
658	L	71.4	Confident	61.8	Low	114 Å²	114	138.6 Å²	138.6	60%	0.597	63%	0.626	S	S	*	*	H	α-helix	trans	-74.3	-34.2	173.9	-71.6	170.6	0	0	0	113	K654 L655 K656	K654-L658 VanDerWaalsContact O-CG 3.27Å; K654-L658 WeakPolarHBondContact O-CG 3.47Å; K654-L658 PolarHBondContact O-N 2.93Å; L655-L658 CarbonylContact O-C 3.59Å; L655-L658 WeakPolarHBondContact O-CB 3.28Å; L655-L658 PolarHBondContact O-N 3.26Å; K656-L658 PolarHBondContact O-N 2.88Å
659	S	61.5	Low	58.7	Low	61 Å²	61	143.5 Å²	143.5	43%	0.427	64%	0.643	S	S	.	*	H	α-helix	trans	-79.6	-28.7	179.5	72.1	0	0	0	0	112.8	L655 K656 R661 K662	L655-S659 WeakPolarHBondContact O-CB 3.2Å; L655-S659 PolarHBondContact O-N 3.17Å; L655-S659 PolarHBondContact O-OG 2.83Å; K656-S659 WeakPolarHBondContact CA-OG 3.38Å; K656-S659 CarbonylContact O-C 3.59Å; K656-S659 PolarHBondContact O-N 3.34Å; K656-S659 VanDerWaalsContact O-N 3.11Å; K656-S659 PolarHBondContact O-OG 2.66Å; S659-R661 PolarHBondContact O-N 2.92Å; S659-K662 CarbonylContact O-C 3.59Å; S659-K662 VanDerWaalsContact O-C 3.3Å; S659-K662 WeakPolarHBondContact O-CA 3.49Å; S659-K662 PolarHBondContact O-N 3.11Å
660	E	51.3	Low	55.6	Low	137 Å²	137	143.5 Å²	143.5	64%	0.64	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-13	174.5	-79.7	170	178.7	0	0	112	K656 K662	K656-E660 VanDerWaalsContact CE-OE1 3.23Å; K656-E660 WeakPolarHBondContact CE-OE1 3.45Å; K656-E660 HydrophobicContact CG-CG 4.45Å; K656-E660 WeakPolarHBondContact O-CB 3.43Å; K656-E660 WeakPolarHBondContact O-CG 3.43Å; K656-E660 PolarHBondContact O-N 3.44Å; E660-K662 VanDerWaalsContact C-N 3.29Å
661	R	53.7	Low	52.5	Low	220 Å²	220	140.4 Å²	140.4	83%	0.83	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-6.1	162.8	-75.3	-176	179	176.4	0.8	114.6	S659	S659-R661 PolarHBondContact O-N 2.92Å
662	K	39.3	Very low	49.5	Very low	177 Å²	177	142.1 Å²	142.1	77%	0.77	68%	0.677	S	S	*	*	S	Bend	trans	-138.7	94.2	-178.7	-99.7	-175.7	173.8	179.2	0	111.3	S659 E660	S659-K662 CarbonylContact O-C 3.59Å; S659-K662 VanDerWaalsContact O-C 3.3Å; S659-K662 WeakPolarHBondContact O-CA 3.49Å; S659-K662 PolarHBondContact O-N 3.11Å; E660-K662 VanDerWaalsContact C-N 3.29Å
663	R	33.1	Very low	46.5	Very low	232 Å²	232	145.1 Å²	145.1	88%	0.875	70%	0.696	S	S	*	*			trans	52.8	118.7	151	-72.2	-173.3	-174.5	155.9	0.6	117.6
664	Q	27.1	Very low	43.5	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	71%	0.708	S	S	*	*				41.2	94.3	85	-81.4	-179.3	-19.4	0	0	113.3
665	E	27.1	Very low	40.8	Very low	170 Å²	170	148.9 Å²	148.9	79%	0.794	73%	0.726	S	S	*	*				159.2	136.3	125.9	-91.1	170.4	173	0	0	111.3
666	E	26	Very low	38.1	Very low	168 Å²	168	155.1 Å²	155.1	79%	0.785	74%	0.742	S	S	*	*			trans	67.2	150.1	150.1	-68.1	-177.3	167.7	0	0	119.3
667	L	24.8	Very low	36	Very low	137 Å²	137	153.7 Å²	153.7	72%	0.717	75%	0.748	S	S	*	*			cis	-172.8	153.6	-26.1	-140.6	128.2	0	0	0	103.1
668	Y	23	Very low	33.7	Very low	193 Å²	193	152.5 Å²	152.5	76%	0.757	75%	0.748	S	S	*	*			trans	10	136	159.2	-78.6	-113.6	0	0	0	120.3
669	Y	27.6	Very low	31.7	Very low	216 Å²	216	148.6 Å²	148.6	85%	0.847	74%	0.735	S	S	*	*				-173.5	144.2	101.3	-112	-85.5	0	0	0	113.1
670	S	25.1	Very low	30.8	Very low	99 Å²	99	146.8 Å²	146.8	69%	0.692	72%	0.722	S	S	*	*			trans	-72.3	163.1	171.1	51	0	0	0	0	113.1
671	G	24.8	Very low	30.1	Very low	70 Å²	70	146 Å²	146	72%	0.722	73%	0.727	S	S	*	*			trans	-173.5	74.8	172.6	0	0	0	0	0	113.3	L673	G671-L673 PolarHBondContact O-N 2.83Å
672	T	25.5	Very low	29.3	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	72%	0.721	S	S	*	*			trans	-61.4	116.8	171.1	-37.2	0	0	0	0	110.3
673	L	27	Very low	29.2	Very low	159 Å²	159	139 Å²	139	83%	0.832	71%	0.709	S	S	*	*			trans	-94.7	105.7	171.4	-88.7	160.3	0	0	0	109.7	G671 N675	G671-L673 PolarHBondContact O-N 2.83Å; L673-N675 PolarHBondContact O-N 2.79Å
674	L	23.9	Very low	29.4	Very low	163 Å²	163	130.6 Å²	130.6	85%	0.853	68%	0.679	S	S	*	*			trans	-63.7	112.8	165.4	-87.4	133	0	0	0	109.9
675	N	28.8	Very low	29.4	Very low	152 Å²	152	127.9 Å²	127.9	81%	0.813	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-77.3	119.4	167.9	-77.3	-25.8	0	0	0	109.6	L673	L673-N675 PolarHBondContact O-N 2.79Å
676	R	24.7	Very low	29.4	Very low	246 Å²	246	125.5 Å²	125.5	93%	0.928	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-70.2	125.4	168.3	-85.1	179.5	171.1	170.6	-2.7	109.4
677	S	32.5	Very low	29.6	Very low	97 Å²	97	123 Å²	123	68%	0.678	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-87.4	131.3	172	33.6	0	0	0	0	111
678	V	29.9	Very low	29.7	Very low	82 Å²	82	122.6 Å²	122.6	50%	0.497	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-86.5	138.6	178.6	172.6	0	0	0	0	109.6	E682	V678-E682 HydrophobicContact CG1-CB 3.69Å; V678-E682 HydrophobicContact CG1-CG 4.3Å; V678-E682 WeakPolarHBondContact CG1-OE2 3.05Å
679	G	29.9	Very low	29.9	Very low	32 Å²	32	117.2 Å²	117.2	33%	0.33	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-81.6	159.7	-175	0	0	0	0	0	114.5	T681 E682	G679-T681 VanDerWaalsContact C-N 3.31Å; G679-T681 PolarHBondContact O-N 2.83Å; G679-E682 PolarHBondContact O-N 3.35Å
680	C	41.3	Very low	29.9	Very low	23 Å²	23	115.3 Å²	115.3	16%	0.155	65%	0.653	C	S	.	*	H	α-helix	trans	-67.3	-18	-174.1	-80.7	0	0	0	0	115.9	E682 L683 F684	C680-E682 PolarHBondContact O-N 3.14Å; C680-L683 PolarHBondContact O-N 3.28Å; C680-L683 VanDerWaalsContact O-N 3.11Å; C680-F684 HydrophobicContact CB-CD2 3.92Å; C680-F684 HydrophobicContact CB-CE2 4.5Å; C680-F684 PolarHBondContact O-N 3.26Å
681	T	37.8	Very low	29.9	Very low	121 Å²	121	115.6 Å²	115.6	74%	0.742	65%	0.65	S	S	*	*	H	α-helix	trans	-67.9	-16.4	170.4	41.8	0	0	0	0	112.7	G679	G679-T681 VanDerWaalsContact C-N 3.31Å; G679-T681 PolarHBondContact O-N 2.83Å
682	E	37	Very low	30	Very low	152 Å²	152	118.2 Å²	118.2	71%	0.71	65%	0.654	S	S	*	*	H	α-helix	trans	-95.4	-15.5	170.8	-64.4	180	-163	0	0	112.7	V678 G679 C680	V678-E682 HydrophobicContact CG1-CB 3.69Å; V678-E682 HydrophobicContact CG1-CG 4.3Å; V678-E682 WeakPolarHBondContact CG1-OE2 3.05Å; G679-E682 PolarHBondContact O-N 3.35Å; C680-E682 PolarHBondContact O-N 3.14Å
683	L	36.4	Very low	30.1	Very low	97 Å²	97	118.4 Å²	118.4	51%	0.508	65%	0.649	S	S	.	*	H	α-helix	trans	-101.1	-29.6	-178.7	-66.3	166.8	0	0	0	113.8	C680	C680-L683 PolarHBondContact O-N 3.28Å; C680-L683 VanDerWaalsContact O-N 3.11Å
684	F	36.8	Very low	30	Very low	56 Å²	56	118 Å²	118	25%	0.246	65%	0.647	C	S	.	*			trans	-138.4	89.1	-173	-54.1	-76.3	0	0	0	109.9	C680 I686 L710	C680-F684 HydrophobicContact CB-CD2 3.92Å; C680-F684 HydrophobicContact CB-CE2 4.5Å; C680-F684 PolarHBondContact O-N 3.26Å; F684-I686 VanDerWaalsContact C-N 3.35Å; F684-I686 PolarHBondContact O-N 3.39Å; F684-L710 HydrophobicContact CD1-CD1 3.88Å; F684-L710 HydrophobicContact CE1-CB 4.05Å; F684-L710 HydrophobicContact CE1-CD1 3.87Å; F684-L710 HydrophobicContact CE1-CD2 4.29Å; F684-L710 HydrophobicContact CE1-CG 4.29Å
685	P	27.1	Very low	30.6	Very low	119 Å²	119	117.1 Å²	117.1	77%	0.773	64%	0.644	S	S	*	*			trans	-66	96.4	174.1	25.1	-30.6	0	0	0	109.4
686	I	28.1	Very low	30.8	Very low	120 Å²	120	116.9 Å²	116.9	62%	0.615	64%	0.643	S	S	*	*			trans	-68.2	126.5	162.9	-58.4	172.1	0	0	0	105.9	F684 I688	F684-I686 VanDerWaalsContact C-N 3.35Å; F684-I686 PolarHBondContact O-N 3.39Å; I686-I688 VanDerWaalsContact C-N 3.29Å; I686-I688 PolarHBondContact O-N 3.14Å
687	P	29	Very low	31.1	Very low	114 Å²	114	111.7 Å²	111.7	74%	0.74	63%	0.633	S	S	*	*			trans	-68.4	92.1	174.1	26.5	-30.3	0	0	0	108.8	S689	P687-S689 VanDerWaalsContact C-N 3.34Å; P687-S689 PolarHBondContact O-N 3.4Å
688	I	26.8	Very low	30.9	Very low	129 Å²	129	117.1 Å²	117.1	66%	0.662	65%	0.645	S	S	*	*			trans	-73.1	94.8	167	-52.3	174.2	0	0	0	105.7	I686 E690	I686-I688 VanDerWaalsContact C-N 3.29Å; I686-I688 PolarHBondContact O-N 3.14Å; I688-E690 VanDerWaalsContact C-N 3.29Å; I688-E690 HydrophobicContact CG2-CG 3.8Å; I688-E690 PolarHBondContact O-N 2.98Å
689	S	27.1	Very low	31	Very low	80 Å²	80	120.7 Å²	120.7	56%	0.559	66%	0.66	S	S	*	*			trans	-68.5	92.8	164.7	59	0	0	0	0	107.9	P687 T691	P687-S689 VanDerWaalsContact C-N 3.34Å; P687-S689 PolarHBondContact O-N 3.4Å; S689-T691 PolarHBondContact O-N 2.71Å; S689-T691 VanDerWaalsContact O-N 3.17Å
690	E	28	Very low	30.8	Very low	177 Å²	177	127.5 Å²	127.5	83%	0.827	68%	0.681	S	S	*	*			trans	-71.3	7.4	170.1	-72.3	-169.6	158.4	0	0	113.1	I688	I688-E690 VanDerWaalsContact C-N 3.29Å; I688-E690 HydrophobicContact CG2-CG 3.8Å; I688-E690 PolarHBondContact O-N 2.98Å
691	T	26.3	Very low	30.3	Very low	105 Å²	105	131.5 Å²	131.5	64%	0.644	71%	0.706	S	S	*	*	S	Bend	trans	-94.9	124.1	171.2	52	0	0	0	0	110.3	S689 I693	S689-T691 PolarHBondContact O-N 2.71Å; S689-T691 VanDerWaalsContact O-N 3.17Å; T691-I693 PolarHBondContact O-N 3.01Å
692	P	25.6	Very low	30	Very low	124 Å²	124	132.1 Å²	132.1	81%	0.805	71%	0.71	S	S	*	*			trans	-54.8	125.5	177.8	22.7	-31.7	0	0	0	109.4	N694	P692-N694 PolarHBondContact O-N 3.02Å
693	I	28.4	Very low	29.9	Very low	138 Å²	138	128 Å²	128	71%	0.708	70%	0.698	S	S	*	*			trans	-58.5	104.4	-176.5	-63.6	166.4	0	0	0	108.4	T691	T691-I693 PolarHBondContact O-N 3.01Å
694	N	25.3	Very low	29.5	Very low	150 Å²	150	125.8 Å²	125.8	80%	0.802	69%	0.689	S	S	*	*			trans	-76.3	118.6	163.4	-139.8	-0.3	0	0	0	106.2	P692 D696	P692-N694 PolarHBondContact O-N 3.02Å; N694-D696 PolarHBondContact O-N 2.98Å
695	N	35.3	Very low	29.2	Very low	146 Å²	146	125.2 Å²	125.2	78%	0.781	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	17.6	-157.5	-107	-9.7	0	0	0	117.3
696	D	34	Very low	29.5	Very low	147 Å²	147	128 Å²	128	79%	0.786	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-1	-168.3	-76.5	-26.6	0	0	0	116.5	N694	N694-D696 PolarHBondContact O-N 2.98Å
697	N	30.8	Very low	29.6	Very low	137 Å²	137	125.6 Å²	125.6	73%	0.733	69%	0.686	S	S	*	*			trans	-111	100.7	175.6	-72	-18.8	0	0	0	111.1	L699	N697-L699 PolarHBondContact O-N 2.83Å
698	K	29	Very low	29.9	Very low	211 Å²	211	121.9 Å²	121.9	92%	0.917	66%	0.66	S	S	*	*			trans	-55.3	79.4	159.8	-71	178.8	178.2	178.2	0	109.4	K700	K698-K700 PolarHBondContact O-N 2.79Å
699	L	30.5	Very low	30.3	Very low	157 Å²	157	121.6 Å²	121.6	82%	0.822	66%	0.66	S	S	*	*			trans	-67.1	103.5	171.9	-89.4	146.6	0	0	0	107.7	N697	N697-L699 PolarHBondContact O-N 2.83Å
700	K	26.1	Very low	30.8	Very low	175 Å²	175	121.9 Å²	121.9	76%	0.761	66%	0.655	S	S	*	*			trans	-59.8	128.8	166.6	-72.4	179.9	175.4	179.9	0	108.2	K698 T702	K698-K700 PolarHBondContact O-N 2.79Å; K700-T702 PolarHBondContact O-N 3.3Å; K700-T702 PolarHBondContact O-OG1 2.67Å
701	P	31.9	Very low	31.6	Very low	107 Å²	107	114.4 Å²	114.4	70%	0.695	62%	0.62	S	S	*	*			trans	-69.3	106.3	-176.2	27.9	-31.8	0	0	0	108.7
702	T	31.1	Very low	32.7	Very low	133 Å²	133	111.7 Å²	111.7	82%	0.816	61%	0.605	S	S	*	*			trans	-105.3	21	-176.2	-34.9	0	0	0	0	112.1	K700	K700-T702 PolarHBondContact O-N 3.3Å; K700-T702 PolarHBondContact O-OG1 2.67Å
703	S	33.5	Very low	34	Very low	65 Å²	65	106.6 Å²	106.6	46%	0.455	57%	0.572	S	S	.	*			trans	-136.2	14.5	-171.3	56.8	0	0	0	0	116.1
704	T	29.9	Very low	35.3	Very low	51 Å²	51	103.6 Å²	103.6	31%	0.313	56%	0.562	S	S	.	*	H	α-helix	trans	-66.6	-45.8	168.7	34.5	0	0	0	0	112.2	K706 L707 I708 M985	T704-K706 VanDerWaalsContact C-N 3.27Å; T704-K706 PolarHBondContact O-N 3.4Å; T704-L707 PolarHBondContact O-N 3.06Å; T704-I708 WeakPolarHBondContact O-CD1 3.45Å; T704-I708 VanDerWaalsContact O-CG1 3.28Å; T704-I708 WeakPolarHBondContact O-CG1 3.42Å; T704-I708 PolarHBondContact O-N 3.37Å; T704-M985 HydrophobicContact CG2-CE 3.01Å
705	G	28.4	Very low	37.2	Very low	44 Å²	44	102.9 Å²	102.9	45%	0.454	55%	0.548	S	S	.	.	H	α-helix	trans	-60.8	-29.4	-175.1	0	0	0	0	0	115.1
706	K	34	Very low	39	Very low	177 Å²	177	99.8 Å²	99.8	77%	0.77	53%	0.531	S	S	*	.	H	α-helix	trans	-81.6	-24.7	176.6	-74.6	-174.1	177.6	-178.4	0	113.6	T704 L710	T704-K706 VanDerWaalsContact C-N 3.27Å; T704-K706 PolarHBondContact O-N 3.4Å; K706-L710 WeakPolarHBondContact O-CD1 3.14Å
707	L	31.5	Very low	40.9	Very low	70 Å²	70	94.9 Å²	94.9	37%	0.366	50%	0.504	S	S	.	.	H	α-helix	trans	-79	-36.4	175	-85.4	156	0	0	0	111.1	T704 N709 L710 F711	T704-L707 PolarHBondContact O-N 3.06Å; L707-N709 PolarHBondContact O-N 3.18Å; L707-L710 PolarHBondContact O-N 2.84Å; L707-F711 HydrophobicContact CB-CE2 4.5Å; L707-F711 HydrophobicContact CD2-CE2 4.33Å; L707-F711 WeakPolarHBondContact O-CD2 3.48Å; L707-F711 VanDerWaalsContact O-CE2 3.29Å; L707-F711 WeakPolarHBondContact O-CE2 3.47Å
708	I	34.5	Very low	42.9	Very low	36 Å²	36	91.1 Å²	91.1	19%	0.185	49%	0.488	C	S	.	.	H	α-helix	trans	-61.4	-44.6	-178.1	-64.6	160.6	0	0	0	111.5	T704 L710 F711	T704-I708 WeakPolarHBondContact O-CD1 3.45Å; T704-I708 VanDerWaalsContact O-CG1 3.28Å; T704-I708 WeakPolarHBondContact O-CG1 3.42Å; T704-I708 PolarHBondContact O-N 3.37Å; I708-L710 PolarHBondContact O-N 3.41Å; I708-L710 VanDerWaalsContact O-N 3.08Å; I708-F711 PolarHBondContact O-N 3.07Å; I708-F711 VanDerWaalsContact O-N 3.11Å
709	N	34.6	Very low	45.1	Very low	124 Å²	124	84.7 Å²	84.7	66%	0.663	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-63.9	-17.2	180	-69.7	8.1	0	0	0	114.5	L707 F711	L707-N709 PolarHBondContact O-N 3.18Å; N709-F711 VanDerWaalsContact C-N 3.33Å
710	L	38.9	Very low	47.2	Very low	85 Å²	85	79 Å²	79	45%	0.445	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-85.3	-9.2	-179.9	-69.7	162.8	0	0	0	112.8	F684 K706 L707 I708	F684-L710 HydrophobicContact CD1-CD1 3.88Å; F684-L710 HydrophobicContact CE1-CB 4.05Å; F684-L710 HydrophobicContact CE1-CD1 3.87Å; F684-L710 HydrophobicContact CE1-CD2 4.29Å; F684-L710 HydrophobicContact CE1-CG 4.29Å; K706-L710 WeakPolarHBondContact O-CD1 3.14Å; L707-L710 PolarHBondContact O-N 2.84Å; I708-L710 PolarHBondContact O-N 3.41Å; I708-L710 VanDerWaalsContact O-N 3.08Å
711	F	44.5	Very low	49.3	Very low	21 Å²	21	76.2 Å²	76.2	9%	0.092	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-108.3	19.7	-179.6	-58.9	-64.3	0	0	0	113.1	L707 I708 N709 V864 M867	L707-F711 HydrophobicContact CB-CE2 4.5Å; L707-F711 HydrophobicContact CD2-CE2 4.33Å; L707-F711 WeakPolarHBondContact O-CD2 3.48Å; L707-F711 VanDerWaalsContact O-CE2 3.29Å; L707-F711 WeakPolarHBondContact O-CE2 3.47Å; I708-F711 PolarHBondContact O-N 3.07Å; I708-F711 VanDerWaalsContact O-N 3.11Å; N709-F711 VanDerWaalsContact C-N 3.33Å; F711-V864 HydrophobicContact CD2-CG1 4.14Å; F711-V864 HydrophobicContact CD2-CG2 4.19Å; F711-V864 HydrophobicContact CE2-CG1 4.23Å; F711-M867 HydrophobicContact CD1-CB 3.43Å; F711-M867 VanDerWaalsContact CD1-CB 3.43Å; F711-M867 HydrophobicContact CD1-CE 3.75Å; F711-M867 HydrophobicContact CD1-CG 3.75Å; F711-M867 HydrophobicContact CE1-CB 3.45Å; F711-M867 VanDerWaalsContact CE1-CB 3.45Å; F711-M867 HydrophobicContact CE1-CE 4.39Å; F711-M867 HydrophobicContact CE1-CG 4.28Å; F711-M867 HydrophobicContact CG-CB 4.18Å; F711-M867 HydrophobicContact CG-CG 4.34Å; F711-M867 HydrophobicContact CZ-CB 4.21Å
712	S	49.8	Very low	51	Low	48 Å²	48	76.6 Å²	76.6	34%	0.336	42%	0.42	S	S	.	.			trans	-51	143	173.2	175.1	0	0	0	0	111.2	C714 E860	S712-C714 PolarHBondContact O-N 2.86Å; S712-E860 WeakPolarHBondContact CA-OE1 3.19Å; S712-E860 PolarHBondContact OG-OE1 3.4Å
713	P	51.8	Low	52.5	Low	16 Å²	16	79.9 Å²	79.9	10%	0.104	42%	0.423	C	S	.	.			trans	-52.7	136.5	164.3	21.5	-29.2	0	0	0	109.8	V730 S731 I856 E860	P713-V730 HydrophobicContact CB-CG1 3.25Å; P713-V730 HydrophobicContact CG-CG1 3.8Å; P713-S731 CarbonylContact C-O 3.55Å; P713-I856 HydrophobicContact CG-CG2 3.89Å; P713-E860 WeakPolarHBondContact CD-OE1 3.41Å
714	C	55.5	Low	54.2	Low	76 Å²	76	82.1 Å²	82.1	51%	0.514	43%	0.43	S	S	.	.	S	Bend	trans	-78.7	-31.4	-171.7	-123.4	0	0	0	0	112.7	S712 S731 L733	S712-C714 PolarHBondContact O-N 2.86Å; C714-S731 PolarHBondContact N-O 3.11Å; C714-L733 HydrophobicContact CB-CB 4.37Å; C714-L733 WeakPolarHBondContact SG-CA 3.37Å; C714-L733 VanDerWaalsContact SG-CD1 3.55Å; C714-L733 WeakPolarHBondContact SG-CG 3.45Å
715	R	66.6	Low	56.4	Low	134 Å²	134	82.1 Å²	82.1	51%	0.506	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	132.3	-168.6	-164.2	178.3	178.9	-163.9	-5.1	109.5	I717 V730 S731 E816	R715-I717 HydrophobicContact CG-CD1 4.24Å; R715-I717 HydrophobicContact CG-CG1 3.85Å; R715-V730 CarbonylContact O-C 3.57Å; R715-V730 WeakPolarHBondContact O-CA 3.31Å; R715-S731 PolarHBondContact N-O 3.03Å; R715-S731 PolarHBondContact O-N 3.28Å; R715-E816 IonicContact NH1-OE1 3.26Å; R715-E816 PolarHBondContact NH1-OE1 3.25Å
716	I	71.5	Confident	58.9	Low	81 Å²	81	80.2 Å²	80.2	42%	0.415	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.3	171.8	-57.4	177.2	0	0	0	106.3	Y728 E729 V730 M852 I856	I716-Y728 HydrophobicContact CG2-CD1 4.07Å; I716-E729 CarbonylContact C-O 3.53Å; I716-E729 WeakPolarHBondContact CA-O 3.28Å; I716-V730 HydrophobicContact CG1-CG1 4.35Å; I716-V730 HydrophobicContact CG1-CG2 4.25Å; I716-V730 HydrophobicContact CG2-CG2 4.4Å; I716-M852 HydrophobicContact CD1-CE 4.45Å; I716-M852 HydrophobicContact CG2-CE 3.57Å; I716-I856 HydrophobicContact CD1-CD1 3.62Å; I716-I856 HydrophobicContact CD1-CG1 4.38Å
717	I	74.4	Confident	61.1	Low	44 Å²	44	74.1 Å²	74.1	23%	0.226	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.9	179.8	-51	175.4	0	0	0	107.9	R715 T719 Y728 E729	R715-I717 HydrophobicContact CG-CD1 4.24Å; R715-I717 HydrophobicContact CG-CG1 3.85Å; I717-T719 HydrophobicContact CG2-CG2 4.47Å; I717-T719 PolarHBondContact O-N 3.05Å; I717-Y728 CarbonylContact O-C 3.55Å; I717-Y728 WeakPolarHBondContact O-CA 3.29Å; I717-E729 PolarHBondContact N-O 3.48Å; I717-E729 PolarHBondContact O-N 2.89Å
718	C	73.3	Confident	63.5	Low	58 Å²	58	72 Å²	72	39%	0.392	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.2	166.4	-170	0	0	0	0	108.2	S720 I727 Y728	C718-S720 PolarHBondContact SG-O 3.48Å; C718-S720 VanDerWaalsContact SG-O 3.36Å; C718-I727 CarbonylContact C-O 3.42Å; C718-I727 WeakPolarHBondContact CA-O 3.4Å; C718-Y728 HydrophobicContact CB-CD1 3.97Å; C718-Y728 HydrophobicContact CB-CE1 3.77Å
719	T	74.7	Confident	65.6	Low	76 Å²	76	72 Å²	72	47%	0.466	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-25.2	-178.7	54.5	0	0	0	0	112.7	I717 I727 E729	I717-T719 HydrophobicContact CG2-CG2 4.47Å; I717-T719 PolarHBondContact O-N 3.05Å; T719-I727 PolarHBondContact N-O 2.96Å; T719-I727 VanDerWaalsContact OG1-CG2 3.27Å; T719-I727 WeakPolarHBondContact OG1-CG2 3.38Å; T719-I727 PolarHBondContact OG1-O 2.79Å; T719-E729 HydrophobicContact CG2-CB 3.84Å
720	S	74.3	Confident	67.8	Low	38 Å²	38	66.1 Å²	66.1	27%	0.266	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	140	174.4	-175.7	0	0	0	0	111	C718 H726 I727	C718-S720 PolarHBondContact SG-O 3.48Å; C718-S720 VanDerWaalsContact SG-O 3.36Å; S720-H726 WeakPolarHBondContact O-CA 3.4Å; S720-I727 PolarHBondContact N-O 3.24Å; S720-I727 PolarHBondContact O-N 3.07Å
721	F	70.1	Confident	69.5	Low	117 Å²	117	62.4 Å²	62.4	51%	0.513	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	82.3	176.8	-162.6	-85.2	0	0	0	108.4	H726 I797	F721-H726 AromaticContact CD1-CE1 3.8Å; F721-H726 AromaticContact CD2-CE1 3.32Å; F721-H726 WeakPolarHBondContact CD2-CE1 3.46Å; F721-H726 AromaticContact CD2-ND1 3.03Å; F721-H726 WeakPolarHBondContact CD2-ND1 3.21Å; F721-H726 AromaticContact CE1-CE1 3.65Å; F721-H726 AromaticContact CE2-CE1 3.14Å; F721-H726 WeakPolarHBondContact CE2-CE1 3.39Å; F721-H726 AromaticContact CE2-ND1 3.29Å; F721-H726 VanDerWaalsContact CE2-ND1 3.29Å; F721-H726 WeakPolarHBondContact CE2-ND1 3.4Å; F721-H726 AromaticContact CG-CE1 3.64Å; F721-H726 AromaticContact CG-ND1 3.5Å; F721-H726 AromaticContact CZ-CE1 3.32Å; F721-H726 WeakPolarHBondContact CZ-CE1 3.4Å; F721-H726 AromaticContact CZ-ND1 3.95Å; F721-I797 HydrophobicContact CE2-CD1 4.23Å; F721-I797 HydrophobicContact CZ-CD1 4.32Å
722	E	67.7	Low	70.8	Confident	114 Å²	114	61.8 Å²	61.8	53%	0.533	32%	0.317	S	S	.	.			trans	-88.7	155	170	-61.5	179	172.4	0	0	109.7	D724 N725	E722-D724 PolarHBondContact O-N 2.76Å; E722-N725 WeakPolarHBondContact CA-O 3.41Å; E722-N725 VanDerWaalsContact CB-O 3.3Å; E722-N725 WeakPolarHBondContact CB-O 3.48Å; E722-N725 PolarHBondContact N-O 3.45Å; E722-N725 PolarHBondContact O-N 3.26Å
723	K	63.7	Low	71.4	Confident	202 Å²	202	63 Å²	63	88%	0.878	32%	0.32	S	S	*	.	S	Bend	trans	-53.8	-33.4	-174.1	-72.3	-175	177	-177.8	0	114.2
724	D	67.8	Low	71.8	Confident	112 Å²	112	63.8 Å²	63.8	60%	0.599	32%	0.321	S	S	*	.	S	Bend	trans	-108.4	-26.1	-177.5	-61.4	-40.6	0	0	0	113.2	E722 Q744	E722-D724 PolarHBondContact O-N 2.76Å; D724-Q744 WeakPolarHBondContact O-CA 3.4Å
725	N	76.2	Confident	72.2	Confident	52 Å²	52	60.7 Å²	60.7	28%	0.278	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	128.4	-172	-64.7	-40.1	0	0	0	111.6	E722 T742 C743 I805	E722-N725 WeakPolarHBondContact CA-O 3.41Å; E722-N725 VanDerWaalsContact CB-O 3.3Å; E722-N725 WeakPolarHBondContact CB-O 3.48Å; E722-N725 PolarHBondContact N-O 3.45Å; E722-N725 PolarHBondContact O-N 3.26Å; N725-T742 HydrophobicContact CB-CG2 4.19Å; N725-C743 CarbonylContact C-O 3.5Å; N725-C743 WeakPolarHBondContact CA-O 3.3Å; N725-I805 WeakPolarHBondContact OD1-CD1 3.4Å
726	H	80.7	Confident	72.4	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.019	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.3	174.5	-57.8	-81.9	0	0	0	109.5	S720 F721 Y728 T742 C743 V745	S720-H726 WeakPolarHBondContact O-CA 3.4Å; F721-H726 AromaticContact CD1-CE1 3.8Å; F721-H726 AromaticContact CD2-CE1 3.32Å; F721-H726 WeakPolarHBondContact CD2-CE1 3.46Å; F721-H726 AromaticContact CD2-ND1 3.03Å; F721-H726 WeakPolarHBondContact CD2-ND1 3.21Å; F721-H726 AromaticContact CE1-CE1 3.65Å; F721-H726 AromaticContact CE2-CE1 3.14Å; F721-H726 WeakPolarHBondContact CE2-CE1 3.39Å; F721-H726 AromaticContact CE2-ND1 3.29Å; F721-H726 VanDerWaalsContact CE2-ND1 3.29Å; F721-H726 WeakPolarHBondContact CE2-ND1 3.4Å; F721-H726 AromaticContact CG-CE1 3.64Å; F721-H726 AromaticContact CG-ND1 3.5Å; F721-H726 AromaticContact CZ-CE1 3.32Å; F721-H726 WeakPolarHBondContact CZ-CE1 3.4Å; F721-H726 AromaticContact CZ-ND1 3.95Å; H726-Y728 HydrophobicContact CB-CD2 4.22Å; H726-Y728 HydrophobicContact CB-CE2 3.44Å; H726-Y728 VanDerWaalsContact CB-CE2 3.44Å; H726-T742 CarbonylContact O-C 3.51Å; H726-T742 WeakPolarHBondContact O-CA 3.49Å; H726-C743 PolarHBondContact N-O 3.3Å; H726-C743 PolarHBondContact O-N 3.2Å; H726-V745 WeakPolarHBondContact NE2-CG2 3.44Å
727	I	80.7	Confident	72.6	Confident	48 Å²	48	51.2 Å²	51.2	25%	0.246	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.3	175.3	-54.3	178.3	0	0	0	108.2	C718 T719 S720 I740 L741 T742	C718-I727 CarbonylContact C-O 3.42Å; C718-I727 WeakPolarHBondContact CA-O 3.4Å; T719-I727 PolarHBondContact N-O 2.96Å; T719-I727 VanDerWaalsContact OG1-CG2 3.27Å; T719-I727 WeakPolarHBondContact OG1-CG2 3.38Å; T719-I727 PolarHBondContact OG1-O 2.79Å; S720-I727 PolarHBondContact N-O 3.24Å; S720-I727 PolarHBondContact O-N 3.07Å; I727-I740 HydrophobicContact CG2-CG2 3.57Å; I727-L741 WeakPolarHBondContact CA-O 3.32Å; I727-T742 HydrophobicContact CG1-CG2 4.39Å
728	Y	82	Confident	73	Confident	25 Å²	25	49.2 Å²	49.2	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.3	177	-64	-83.9	0	0	0	110.4	I716 I717 C718 H726 I740 L741 C743 L802 M852	I716-Y728 HydrophobicContact CG2-CD1 4.07Å; I717-Y728 CarbonylContact O-C 3.55Å; I717-Y728 WeakPolarHBondContact O-CA 3.29Å; C718-Y728 HydrophobicContact CB-CD1 3.97Å; C718-Y728 HydrophobicContact CB-CE1 3.77Å; H726-Y728 HydrophobicContact CB-CD2 4.22Å; H726-Y728 HydrophobicContact CB-CE2 3.44Å; H726-Y728 VanDerWaalsContact CB-CE2 3.44Å; Y728-I740 CarbonylContact O-C 3.55Å; Y728-I740 WeakPolarHBondContact O-CA 3.02Å; Y728-L741 PolarHBondContact N-O 3.46Å; Y728-L741 PolarHBondContact O-N 3.28Å; Y728-C743 HydrophobicContact CD2-CB 4.12Å; Y728-C743 HydrophobicContact CE2-CB 4.01Å; Y728-L802 HydrophobicContact CE2-CD1 3.72Å; Y728-L802 HydrophobicContact CE2-CD2 4.33Å; Y728-L802 VanDerWaalsContact OH-CD1 3.26Å; Y728-L802 WeakPolarHBondContact OH-CD1 3.49Å; Y728-M852 HydrophobicContact CD1-CE 3.75Å; Y728-M852 HydrophobicContact CD1-SD 4.48Å; Y728-M852 HydrophobicContact CD2-CE 3.96Å; Y728-M852 HydrophobicContact CD2-SD 4.05Å; Y728-M852 HydrophobicContact CE1-CE 4.33Å; Y728-M852 HydrophobicContact CE2-CE 4.5Å; Y728-M852 HydrophobicContact CE2-SD 4.13Å; Y728-M852 HydrophobicContact CG-CE 3.54Å; Y728-M852 HydrophobicContact CG-SD 4.22Å
729	E	79.7	Confident	73.6	Confident	36 Å²	36	46.4 Å²	46.4	17%	0.168	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.1	168.1	-177	173.5	-159.7	0	0	109.2	I716 I717 T719 N738	I716-E729 CarbonylContact C-O 3.53Å; I716-E729 WeakPolarHBondContact CA-O 3.28Å; I717-E729 PolarHBondContact N-O 3.48Å; I717-E729 PolarHBondContact O-N 2.89Å; T719-E729 HydrophobicContact CG2-CB 3.84Å; E729-N738 HydrophobicContact CG-CB 4.08Å; E729-N738 PolarHBondContact OE1-ND2 2.82Å
730	V	80.4	Confident	74.1	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	105	178.6	-178.4	0	0	0	0	108.3	P713 R715 I716 N738 F739 L741	P713-V730 HydrophobicContact CB-CG1 3.25Å; P713-V730 HydrophobicContact CG-CG1 3.8Å; R715-V730 CarbonylContact O-C 3.57Å; R715-V730 WeakPolarHBondContact O-CA 3.31Å; I716-V730 HydrophobicContact CG1-CG1 4.35Å; I716-V730 HydrophobicContact CG1-CG2 4.25Å; I716-V730 HydrophobicContact CG2-CG2 4.4Å; V730-N738 CarbonylContact O-C 3.57Å; V730-N738 WeakPolarHBondContact O-CA 3.18Å; V730-F739 HydrophobicContact CB-CB 4.21Å; V730-F739 PolarHBondContact N-O 2.81Å; V730-F739 PolarHBondContact O-N 3.45Å; V730-L741 HydrophobicContact CG2-CD1 3.74Å; V730-L741 HydrophobicContact CG2-CG 4.25Å
731	S	75	Confident	74.7	Confident	8 Å²	8	42.9 Å²	42.9	6%	0.056	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.8	-180	-45.6	0	0	0	0	111.4	P713 C714 R715 N738	P713-S731 CarbonylContact C-O 3.55Å; C714-S731 PolarHBondContact N-O 3.11Å; R715-S731 PolarHBondContact N-O 3.03Å; R715-S731 PolarHBondContact O-N 3.28Å; S731-N738 WeakPolarHBondContact CA-OD1 3.44Å; S731-N738 WeakPolarHBondContact CB-OD1 3.32Å
732	T	72	Confident	75.4	Confident	7 Å²	7	38.5 Å²	38.5	4%	0.043	19%	0.192	C	C	.	.			trans	-76	160.3	176.3	51	0	0	0	0	113.1	F734 G735 L736 M737 F739 I863	T732-F734 PolarHBondContact O-N 2.78Å; T732-F734 VanDerWaalsContact O-N 3.14Å; T732-G735 PolarHBondContact O-N 3.5Å; T732-L736 PolarHBondContact OG1-N 2.81Å; T732-M737 HydrophobicContact CG2-CG 3.49Å; T732-M737 VanDerWaalsContact CG2-CG 3.49Å; T732-M737 WeakPolarHBondContact CG2-O 3.22Å; T732-M737 HydrophobicContact CG2-SD 4.28Å; T732-M737 PolarHBondContact N-O 2.82Å; T732-M737 PolarHBondContact OG1-N 2.84Å; T732-M737 PolarHBondContact OG1-O 3.44Å; T732-F739 HydrophobicContact CG2-CE2 4.38Å; T732-I863 HydrophobicContact CG2-CD1 3.64Å
733	L	60.6	Low	76.2	Confident	75 Å²	75	33.1 Å²	33.1	39%	0.393	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.3	-172.9	-166.3	124.3	0	0	0	115.4	C714 M867	C714-L733 HydrophobicContact CB-CB 4.37Å; C714-L733 WeakPolarHBondContact SG-CA 3.37Å; C714-L733 VanDerWaalsContact SG-CD1 3.55Å; C714-L733 WeakPolarHBondContact SG-CG 3.45Å; L733-M867 HydrophobicContact CB-CE 4.25Å
734	F	60.7	Low	77.1	Confident	31 Å²	31	27.6 Å²	27.6	14%	0.136	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	6.5	177.9	-67.7	-54.7	0	0	0	113.6	T732 L736 P818 V819 M867	T732-F734 PolarHBondContact O-N 2.78Å; T732-F734 VanDerWaalsContact O-N 3.14Å; F734-L736 HydrophobicContact CB-CD1 3.64Å; F734-L736 HydrophobicContact CB-CD2 4.37Å; F734-L736 HydrophobicContact CB-CG 3.55Å; F734-L736 HydrophobicContact CD2-CD1 4.2Å; F734-L736 HydrophobicContact CG-CD1 4.34Å; F734-L736 PolarHBondContact O-N 2.76Å; F734-P818 WeakPolarHBondContact O-CD 3.37Å; F734-P818 WeakPolarHBondContact O-CG 3.41Å; F734-V819 HydrophobicContact CB-CG2 3.9Å; F734-V819 HydrophobicContact CD1-CG2 4.19Å; F734-V819 HydrophobicContact CG-CG2 4.37Å; F734-V819 WeakPolarHBondContact O-CG2 3.26Å; F734-M867 HydrophobicContact CD2-CE 3.18Å; F734-M867 HydrophobicContact CD2-SD 3.61Å; F734-M867 HydrophobicContact CE2-CE 3.23Å; F734-M867 HydrophobicContact CE2-SD 3.96Å; F734-M867 HydrophobicContact CG-CE 4.28Å; F734-M867 HydrophobicContact CZ-CE 4.36Å
735	G	64.3	Low	77.6	Confident	12 Å²	12	24.2 Å²	24.2	12%	0.124	13%	0.127	C	C	.	.	S	Bend	trans	52.3	46.7	-173.3	0	0	0	0	0	111	T732 P812	T732-G735 PolarHBondContact O-N 3.5Å; G735-P812 WeakPolarHBondContact O-CG 3.33Å
736	L	70.3	Confident	77.2	Confident	11 Å²	11	24 Å²	24	6%	0.058	13%	0.129	C	C	.	.	S	Bend	trans	-98.1	-28.9	-178.1	-68.3	175.3	0	0	0	112.5	T732 F734 P812 V819 V824 A828	T732-L736 PolarHBondContact OG1-N 2.81Å; F734-L736 HydrophobicContact CB-CD1 3.64Å; F734-L736 HydrophobicContact CB-CD2 4.37Å; F734-L736 HydrophobicContact CB-CG 3.55Å; F734-L736 HydrophobicContact CD2-CD1 4.2Å; F734-L736 HydrophobicContact CG-CD1 4.34Å; F734-L736 PolarHBondContact O-N 2.76Å; L736-P812 WeakPolarHBondContact O-CD 3.36Å; L736-V819 HydrophobicContact CD2-CB 4.44Å; L736-V824 HydrophobicContact CD1-CG1 3.63Å; L736-V824 HydrophobicContact CD2-CG1 3.64Å; L736-V824 HydrophobicContact CG-CG1 4.3Å; L736-A828 HydrophobicContact CB-CB 3.93Å; L736-A828 HydrophobicContact CD2-CB 4.28Å
737	M	76.7	Confident	76	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.025	17%	0.166	C	C	.	.			trans	-157.2	148	-179.3	64.7	-163.2	72.9	0	0	108.9	T732 F739 I810 F831 I832 I863	T732-M737 HydrophobicContact CG2-CG 3.49Å; T732-M737 VanDerWaalsContact CG2-CG 3.49Å; T732-M737 WeakPolarHBondContact CG2-O 3.22Å; T732-M737 HydrophobicContact CG2-SD 4.28Å; T732-M737 PolarHBondContact N-O 2.82Å; T732-M737 PolarHBondContact OG1-N 2.84Å; T732-M737 PolarHBondContact OG1-O 3.44Å; M737-F739 HydrophobicContact CG-CE2 4.04Å; M737-F739 HydrophobicContact SD-CE2 4.12Å; M737-F739 HydrophobicContact SD-CZ 4.4Å; M737-I810 WeakPolarHBondContact CA-O 3.31Å; M737-F831 HydrophobicContact CE-CD1 3.51Å; M737-F831 HydrophobicContact CE-CE1 4.07Å; M737-F831 HydrophobicContact SD-CD1 3.49Å; M737-F831 WeakPolarHBondContact SD-CD1 3.45Å; M737-F831 HydrophobicContact SD-CE1 3.53Å; M737-F831 VanDerWaalsContact SD-CE1 3.53Å; M737-I832 HydrophobicContact CB-CD1 4.02Å; M737-I832 HydrophobicContact CB-CG1 4Å; M737-I863 HydrophobicContact SD-CD1 4.46Å; M737-I863 HydrophobicContact SD-CG1 4.31Å
738	N	82.3	Confident	74.2	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.2	175	-62.7	-10.8	0	0	0	109.2	E729 V730 S731 I810	E729-N738 HydrophobicContact CG-CB 4.08Å; E729-N738 PolarHBondContact OE1-ND2 2.82Å; V730-N738 CarbonylContact O-C 3.57Å; V730-N738 WeakPolarHBondContact O-CA 3.18Å; S731-N738 WeakPolarHBondContact CA-OD1 3.44Å; S731-N738 WeakPolarHBondContact CB-OD1 3.32Å; N738-I810 HydrophobicContact CB-CG1 4.06Å; N738-I810 PolarHBondContact N-O 2.79Å; N738-I810 PolarHBondContact O-N 3.22Å
739	F	85.4	Confident	71.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.5	171.3	-65.5	-104.8	0	0	0	108.5	V730 T732 M737 L741 V807 Q808 V809 L835 L843 I859 I863	V730-F739 HydrophobicContact CB-CB 4.21Å; V730-F739 PolarHBondContact N-O 2.81Å; V730-F739 PolarHBondContact O-N 3.45Å; T732-F739 HydrophobicContact CG2-CE2 4.38Å; M737-F739 HydrophobicContact CG-CE2 4.04Å; M737-F739 HydrophobicContact SD-CE2 4.12Å; M737-F739 HydrophobicContact SD-CZ 4.4Å; F739-L741 HydrophobicContact CB-CD2 4.44Å; F739-V807 HydrophobicContact CD1-CG1 4.33Å; F739-Q808 CarbonylContact C-O 3.53Å; F739-Q808 WeakPolarHBondContact CA-O 3.32Å; F739-V809 HydrophobicContact CD1-CG2 3.71Å; F739-V809 HydrophobicContact CE1-CG2 3.64Å; F739-V809 HydrophobicContact CZ-CG2 4.41Å; F739-L835 HydrophobicContact CE1-CD1 4.2Å; F739-L835 HydrophobicContact CZ-CD1 4.14Å; F739-L843 HydrophobicContact CE1-CD1 4.38Å; F739-I859 HydrophobicContact CB-CD1 4.13Å; F739-I859 HydrophobicContact CD1-CD1 3.93Å; F739-I859 HydrophobicContact CD1-CG1 4.12Å; F739-I859 HydrophobicContact CD2-CG2 3.94Å; F739-I859 HydrophobicContact CE1-CG1 4.23Å; F739-I859 HydrophobicContact CE1-CG2 4.37Å; F739-I859 HydrophobicContact CE2-CG2 3.79Å; F739-I859 HydrophobicContact CG-CD1 3.93Å; F739-I859 HydrophobicContact CG-CG1 4.45Å; F739-I859 HydrophobicContact CG-CG2 4.35Å; F739-I859 HydrophobicContact CZ-CG2 4.01Å; F739-I863 HydrophobicContact CE2-CD1 3.55Å; F739-I863 HydrophobicContact CE2-CG1 4.28Å; F739-I863 HydrophobicContact CZ-CD1 3.95Å; F739-I863 HydrophobicContact CZ-CG1 4.23Å
740	I	85.5	Confident	69.7	Low	39 Å²	39	45.4 Å²	45.4	20%	0.2	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.2	170.9	-58.7	174.2	0	0	0	107.5	I727 Y728 V807 Q808 I810	I727-I740 HydrophobicContact CG2-CG2 3.57Å; Y728-I740 CarbonylContact O-C 3.55Å; Y728-I740 WeakPolarHBondContact O-CA 3.02Å; I740-V807 CarbonylContact O-C 3.52Å; I740-V807 WeakPolarHBondContact O-CA 3.28Å; I740-Q808 HydrophobicContact CB-CB 4.29Å; I740-Q808 PolarHBondContact N-O 3.12Å; I740-Q808 PolarHBondContact O-N 3.46Å; I740-I810 HydrophobicContact CD1-CD1 3.61Å; I740-I810 HydrophobicContact CD1-CG1 4.01Å; I740-I810 HydrophobicContact CD1-CG2 4.35Å; I740-I810 HydrophobicContact CG1-CD1 4.19Å; I740-I810 HydrophobicContact CG1-CG1 4.27Å
741	L	87.3	Confident	67.5	Low	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.8	179.3	-54.5	179.7	0	0	0	109.3	I727 Y728 V730 F739 V804 S806 V807 V855 I859	I727-L741 WeakPolarHBondContact CA-O 3.32Å; Y728-L741 PolarHBondContact N-O 3.46Å; Y728-L741 PolarHBondContact O-N 3.28Å; V730-L741 HydrophobicContact CG2-CD1 3.74Å; V730-L741 HydrophobicContact CG2-CG 4.25Å; F739-L741 HydrophobicContact CB-CD2 4.44Å; L741-V804 HydrophobicContact CD2-CG1 4.33Å; L741-S806 WeakPolarHBondContact CA-O 3.42Å; L741-V807 HydrophobicContact CD2-CB 4.18Å; L741-V807 HydrophobicContact CD2-CG1 3.82Å; L741-V807 HydrophobicContact CD2-CG2 3.63Å; L741-V855 HydrophobicContact CD1-CG1 4.01Å; L741-V855 HydrophobicContact CD2-CG1 4.12Å; L741-I859 HydrophobicContact CD1-CD1 4.33Å; L741-I859 HydrophobicContact CD2-CD1 4.33Å
742	T	84.3	Confident	65.6	Low	26 Å²	26	57.4 Å²	57.4	16%	0.16	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.4	166.3	-45.9	0	0	0	0	108.3	N725 H726 I727 V804 I805 S806	N725-T742 HydrophobicContact CB-CG2 4.19Å; H726-T742 CarbonylContact O-C 3.51Å; H726-T742 WeakPolarHBondContact O-CA 3.49Å; I727-T742 HydrophobicContact CG1-CG2 4.39Å; T742-V804 CarbonylContact O-C 3.59Å; T742-I805 PolarHBondContact O-N 2.66Å; T742-S806 WeakPolarHBondContact CB-OG 3.41Å; T742-S806 PolarHBondContact N-O 3.48Å; T742-S806 PolarHBondContact O-N 3.43Å; T742-S806 PolarHBondContact OG1-OG 2.91Å
743	C	85.1	Confident	64	Low	0 Å²	0	62 Å²	62	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.4	-176.4	-56.1	0	0	0	0	111.1	N725 H726 Y728 L802 K803	N725-C743 CarbonylContact C-O 3.5Å; N725-C743 WeakPolarHBondContact CA-O 3.3Å; H726-C743 PolarHBondContact N-O 3.3Å; H726-C743 PolarHBondContact O-N 3.2Å; Y728-C743 HydrophobicContact CD2-CB 4.12Å; Y728-C743 HydrophobicContact CE2-CB 4.01Å; C743-L802 HydrophobicContact CB-CB 4.1Å; C743-L802 HydrophobicContact CB-CD2 4.17Å; C743-K803 CarbonylContact C-O 3.54Å; C743-K803 WeakPolarHBondContact CA-O 3.38Å
744	Q	83	Confident	62.7	Low	86 Å²	86	66.4 Å²	66.4	40%	0.402	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144	169.9	167.5	175.6	39.8	0	0	109.8	D724 C746 K803 I805	D724-Q744 WeakPolarHBondContact O-CA 3.4Å; Q744-C746 PolarHBondContact O-N 3.2Å; Q744-K803 PolarHBondContact N-O 3.33Å; Q744-K803 PolarHBondContact O-N 2.91Å; Q744-I805 HydrophobicContact CB-CD1 3.31Å; Q744-I805 HydrophobicContact CB-CG1 4.05Å; Q744-I805 HydrophobicContact CG-CD1 4.4Å
745	V	77.5	Confident	61.3	Low	41 Å²	41	75.9 Å²	75.9	25%	0.248	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	127.7	176	-170.3	0	0	0	0	109.6	H726 N747 I797 L802	H726-V745 WeakPolarHBondContact NE2-CG2 3.44Å; V745-N747 PolarHBondContact O-N 3.28Å; V745-I797 HydrophobicContact CG2-CD1 3.81Å; V745-L802 HydrophobicContact CG2-CD2 4.23Å
746	C	68.7	Low	59.7	Low	48 Å²	48	84.2 Å²	84.2	32%	0.324	43%	0.431	S	S	.	.			trans	-68.2	110.8	170.2	-69.4	0	0	0	0	108.7	Q744 M748 N801	Q744-C746 PolarHBondContact O-N 3.2Å; C746-M748 PolarHBondContact O-N 3.05Å; C746-N801 WeakPolarHBondContact CB-O 3.2Å; C746-N801 PolarHBondContact N-O 3.46Å
747	N	54.6	Low	57.6	Low	148 Å²	148	91.3 Å²	91.3	79%	0.791	47%	0.469	S	S	*	.			trans	-68.9	53.7	176	-78.1	-9.8	0	0	0	113.2	V745	V745-N747 PolarHBondContact O-N 3.28Å
748	M	41.9	Very low	55.4	Low	149 Å²	149	98.8 Å²	98.8	73%	0.734	51%	0.509	S	S	*	.	S	Bend	trans	-117.4	105.9	172.2	-64.5	-70.1	-70.5	0	0	106.9	C746	C746-M748 PolarHBondContact O-N 3.05Å
749	L	34.2	Very low	52.7	Low	143 Å²	143	107.6 Å²	107.6	75%	0.749	55%	0.55	S	S	*	.			trans	73.5	70.7	173.1	-59.7	149.2	0	0	0	115.4
750	V	34.2	Very low	50	Low	123 Å²	123	115.9 Å²	115.9	75%	0.745	59%	0.594	S	S	*	*			trans	-85.1	94.1	139.1	-178.1	0	0	0	0	104.9	D752	V750-D752 PolarHBondContact O-N 3.31Å
751	D	33.1	Very low	47.2	Very low	116 Å²	116	121.6 Å²	121.6	62%	0.62	62%	0.619	S	S	*	*			trans	-65.8	111	168	-96.3	-33.7	0	0	0	107.7	T753	D751-T753 PolarHBondContact O-N 3.48Å
752	D	35.7	Very low	44.5	Very low	145 Å²	145	128.5 Å²	128.5	78%	0.775	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-68	31	174.8	-89.5	-35.9	0	0	0	112.9	V750	V750-D752 PolarHBondContact O-N 3.31Å
753	T	38.1	Very low	41.7	Very low	102 Å²	102	135.6 Å²	135.6	63%	0.626	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-87.2	-8.3	-174.9	44	0	0	0	0	115.5	D751 R755	D751-T753 PolarHBondContact O-N 3.48Å; T753-R755 VanDerWaalsContact C-N 3.27Å; T753-R755 PolarHBondContact O-N 3.24Å
754	D	33.4	Very low	39.1	Very low	169 Å²	169	141.9 Å²	141.9	90%	0.904	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-84.8	6.7	176.3	-76.1	-16	0	0	0	114.4
755	R	31.5	Very low	36.5	Very low	229 Å²	229	145.5 Å²	145.5	86%	0.864	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-105.8	6.6	176.7	-93.6	-175.7	172.7	168	-0.9	117	T753	T753-R755 VanDerWaalsContact C-N 3.27Å; T753-R755 PolarHBondContact O-N 3.24Å
756	K	31.1	Very low	34	Very low	188 Å²	188	151.3 Å²	151.3	82%	0.817	78%	0.777	S	S	*	*	S	Bend	trans	-143.8	74.6	176.3	-71.8	-174.8	179.7	172.8	0	113.3
757	N	26.7	Very low	32	Very low	160 Å²	160	155.6 Å²	155.6	86%	0.856	80%	0.796	S	S	*	*			trans	-156.5	77.2	154.3	-105.6	-14.3	0	0	0	110.4
758	N	29.2	Very low	30.9	Very low	161 Å²	161	155.6 Å²	155.6	86%	0.861	80%	0.795	S	S	*	*			trans	-163.1	67.5	152.9	-97.6	-13.7	0	0	0	109
759	H	25.7	Very low	30.3	Very low	187 Å²	187	154.8 Å²	154.8	87%	0.866	79%	0.794	S	S	*	*			trans	-148	91.8	161.4	-111.6	52.9	0	0	0	107.8
760	N	30.4	Very low	30.1	Very low	173 Å²	173	154.3 Å²	154.3	93%	0.925	79%	0.792	S	S	*	*			trans	-144.4	121.1	154.8	-108.5	-13.4	0	0	0	110.3
761	H	26	Very low	30	Very low	159 Å²	159	154.8 Å²	154.8	74%	0.736	79%	0.79	S	S	*	*			trans	-58.2	144.5	173.9	-91.2	-76.8	0	0	0	113.8
762	N	29.3	Very low	30	Very low	146 Å²	146	156.3 Å²	156.3	78%	0.781	80%	0.798	S	S	*	*				176.2	104.2	124.3	-89.4	-14.6	0	0	0	108.4
763	Q	26.4	Very low	29.6	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.813	79%	0.792	S	S	*	*				43.7	98	95.1	-77.6	-172.8	-6.4	0	0	114.7
764	C	30.6	Very low	29.5	Very low	132 Å²	132	155.7 Å²	155.7	89%	0.892	81%	0.806	S	S	*	*			trans	-142.7	103.5	152.5	-84.2	0	0	0	0	109.2
765	N	28.1	Very low	29.3	Very low	162 Å²	162	150.8 Å²	150.8	87%	0.866	80%	0.795	S	S	*	*			trans	28.6	116.4	153.4	-78.7	1.2	0	0	0	122.6
766	E	25.4	Very low	29.6	Very low	163 Å²	163	148 Å²	148	76%	0.762	80%	0.798	S	S	*	*			trans	-31.3	136.4	136.5	-64.3	172.2	153.1	0	0	116.2
767	N	27.5	Very low	29.7	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	80%	0.796	S	S	*	*				158.7	153.4	105.1	-86.2	-49	0	0	0	114
768	I	30.7	Very low	30.2	Very low	149 Å²	149	145.4 Å²	145.4	76%	0.764	79%	0.793	S	S	*	*			trans	91.5	90.9	161.1	-45	-175.5	0	0	0	114.4
769	D	30	Very low	30.6	Very low	132 Å²	132	146.5 Å²	146.5	71%	0.706	79%	0.793	S	S	*	*				86.4	124.9	74.7	-84.3	-15.4	0	0	0	114.3
770	D	30	Very low	30.7	Very low	132 Å²	132	146.8 Å²	146.8	71%	0.706	79%	0.791	S	S	*	*			trans	61.7	111.5	141.6	-58.6	-20.7	0	0	0	120.9
771	N	31	Very low	30.8	Very low	134 Å²	134	148 Å²	148	72%	0.717	79%	0.791	S	S	*	*				172.8	128.7	94.3	-108.5	-3.4	0	0	0	113.7
772	D	32.7	Very low	31	Very low	147 Å²	147	149.6 Å²	149.6	79%	0.786	80%	0.799	S	S	*	*			trans	51.1	125.2	133.5	-58.7	-23.6	0	0	0	122.7
773	G	27	Very low	31.1	Very low	63 Å²	63	146.3 Å²	146.3	65%	0.649	80%	0.8	S	S	*	*				134.3	106.5	117.1	0	0	0	0	0	116.7
774	D	37.2	Very low	31.3	Very low	172 Å²	172	147 Å²	147	92%	0.92	80%	0.803	S	S	*	*			trans	68.6	112.2	154.4	-48.2	-28.5	0	0	0	115.9
775	G	28	Very low	31.6	Very low	66 Å²	66	148.6 Å²	148.6	68%	0.68	80%	0.803	S	S	*	*			cis	116.4	108	45.4	0	0	0	0	0	106.7
776	D	38.7	Very low	32	Very low	170 Å²	170	148.1 Å²	148.1	91%	0.909	80%	0.8	S	S	*	*			trans	-175.4	116.8	140.3	-89.4	-20.5	0	0	0	108.1
777	D	33.2	Very low	32.4	Very low	148 Å²	148	146.6 Å²	146.6	79%	0.791	80%	0.797	S	S	*	*			trans	-57.5	140.2	169.9	-62.4	-60.1	0	0	0	110.5
778	D	37.6	Very low	32.9	Very low	146 Å²	146	147.5 Å²	147.5	78%	0.781	80%	0.802	S	S	*	*				175.9	129.8	113.2	-86	-27.2	0	0	0	112.1
779	E	37.7	Very low	33.3	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	80%	0.803	S	S	*	*			trans	70.3	91.1	151.6	-59.8	-169.1	173.9	0	0	119.5
780	K	27.2	Very low	33.6	Very low	194 Å²	194	148.5 Å²	148.5	84%	0.843	81%	0.809	S	S	*	*			trans	-56.8	120.1	145.5	-60.5	172.4	178.6	179.7	0	110.1
781	E	32.4	Very low	34.1	Very low	198 Å²	198	148.7 Å²	148.7	93%	0.925	81%	0.81	S	S	*	*			trans	-131.3	130.7	137.2	-93.7	-168.3	166	0	0	108.7
782	E	30.2	Very low	34.4	Very low	193 Å²	193	149.7 Å²	149.7	90%	0.902	82%	0.815	S	S	*	*			trans	-76	142.3	-172.2	-59.8	170.5	162.8	0	0	110.5
783	G	31.3	Very low	34.7	Very low	76 Å²	76	150.7 Å²	150.7	78%	0.784	82%	0.817	S	S	*	*			trans	162.2	78.1	170.7	0	0	0	0	0	112.2	D785	G783-D785 PolarHBondContact O-N 3.42Å
784	E	31.8	Very low	35.2	Very low	190 Å²	190	156.2 Å²	156.2	89%	0.888	83%	0.826	S	S	*	*			trans	-46.6	125.3	164.7	-62	168.9	159	0	0	110.7
785	D	36.9	Very low	35.8	Very low	165 Å²	165	153.1 Å²	153.1	88%	0.882	81%	0.808	S	S	*	*			trans	-171.8	65.1	146.5	-86.5	-25.3	0	0	0	106.4	G783	G783-D785 PolarHBondContact O-N 3.42Å
786	D	35.4	Very low	36.9	Very low	151 Å²	151	156.4 Å²	156.4	81%	0.807	82%	0.816	S	S	*	*			trans	-76.8	130.2	161.6	-83.3	-30.9	0	0	0	108.4
787	D	34.7	Very low	38	Very low	132 Å²	132	150 Å²	150	71%	0.706	78%	0.781	S	S	*	*			trans	70.2	105.3	150.2	-53.8	-28.3	0	0	0	118.7
788	D	37	Very low	39.7	Very low	156 Å²	156	145.1 Å²	145.1	83%	0.834	76%	0.758	S	S	*	*				-163.2	114.4	110.8	-93.3	-26.9	0	0	0	111.3	N790	D788-N790 PolarHBondContact O-N 3.4Å
789	D	39.5	Very low	41.1	Very low	146 Å²	146	141 Å²	141	78%	0.781	74%	0.74	S	S	*	*			trans	-52.9	99.7	164.9	-70.7	-49	0	0	0	110.5	D791	D789-D791 PolarHBondContact O-N 2.95Å
790	N	36.7	Very low	42.7	Very low	157 Å²	157	139 Å²	139	84%	0.84	73%	0.73	S	S	*	*			trans	-76.1	66.9	158.8	-80.4	-54.9	0	0	0	108.9	D788 D792	D788-N790 PolarHBondContact O-N 3.4Å; N790-D792 PolarHBondContact O-N 3.04Å; N790-D792 VanDerWaalsContact O-N 3.07Å
791	D	40.2	Very low	44.9	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	71%	0.709	S	S	*	*			trans	-60.9	107.3	155.3	-85.4	-28.5	0	0	0	106.4	D789 M793	D789-D791 PolarHBondContact O-N 2.95Å; D791-M793 VanDerWaalsContact C-N 3.35Å; D791-M793 PolarHBondContact O-N 3.12Å
792	D	37.6	Very low	47.1	Very low	156 Å²	156	124 Å²	124	83%	0.834	67%	0.665	S	S	*	*			trans	-41.3	97.5	173	-80.4	-40.7	0	0	0	109.6	N790 Q794	N790-D792 PolarHBondContact O-N 3.04Å; N790-D792 VanDerWaalsContact O-N 3.07Å; D792-Q794 PolarHBondContact O-N 3.17Å
793	M	38.9	Very low	49.6	Very low	167 Å²	167	118.8 Å²	118.8	82%	0.823	64%	0.64	S	S	*	*			trans	-58.3	103.1	174.8	-74.5	-141	-72.9	0	0	107.1	D791 I795	D791-M793 VanDerWaalsContact C-N 3.35Å; D791-M793 PolarHBondContact O-N 3.12Å; M793-I795 PolarHBondContact O-N 2.87Å
794	Q	38	Very low	52.1	Low	179 Å²	179	115.2 Å²	115.2	84%	0.836	60%	0.603	S	S	*	*			trans	-65.5	85.2	168.4	-77.6	-177.3	1.4	0	0	107.7	D792 T796	D792-Q794 PolarHBondContact O-N 3.17Å; Q794-T796 PolarHBondContact O-N 3.36Å; Q794-T796 PolarHBondContact O-OG1 3.21Å
795	I	48.1	Very low	54.6	Low	107 Å²	107	109.5 Å²	109.5	55%	0.549	58%	0.578	S	S	.	*			trans	-64.1	106.9	171	-61	173.4	0	0	0	106.2	M793 I797	M793-I795 PolarHBondContact O-N 2.87Å; I795-I797 HydrophobicContact CG2-CG1 3.87Å; I795-I797 PolarHBondContact O-N 3.08Å
796	T	52.9	Low	56.9	Low	136 Å²	136	103.2 Å²	103.2	83%	0.834	55%	0.547	S	S	*	.			trans	-83.5	93.1	178.5	-44.3	0	0	0	0	107.6	Q794	Q794-T796 PolarHBondContact O-N 3.36Å; Q794-T796 PolarHBondContact O-OG1 3.21Å
797	I	60.6	Low	59.3	Low	35 Å²	35	96.5 Å²	96.5	18%	0.179	51%	0.511	C	S	.	.			trans	-79.7	126.3	176.5	-50.7	174.5	0	0	0	108.1	F721 V745 I795 N801 L802	F721-I797 HydrophobicContact CE2-CD1 4.23Å; F721-I797 HydrophobicContact CZ-CD1 4.32Å; V745-I797 HydrophobicContact CG2-CD1 3.81Å; I795-I797 HydrophobicContact CG2-CG1 3.87Å; I795-I797 PolarHBondContact O-N 3.08Å; I797-N801 HydrophobicContact CG2-CB 4.05Å; I797-L802 HydrophobicContact CB-CD1 4.43Å; I797-L802 HydrophobicContact CB-CG 4.45Å; I797-L802 HydrophobicContact CD1-CD2 4.4Å; I797-L802 HydrophobicContact CG2-CD1 4.21Å; I797-L802 HydrophobicContact CG2-CD2 3.89Å; I797-L802 HydrophobicContact CG2-CG 3.74Å
798	S	69.1	Low	61.7	Low	46 Å²	46	95.2 Å²	95.2	32%	0.322	50%	0.501	S	S	.	.			trans	-66	144	175.7	63.2	0	0	0	0	110.7	E800 N801	S798-E800 PolarHBondContact O-N 3.11Å; S798-E800 VanDerWaalsContact O-N 3.14Å; S798-N801 PolarHBondContact O-N 3.15Å; S798-N801 WeakPolarHBondContact OG-CB 3.46Å; S798-N801 PolarHBondContact OG-ND2 3.46Å
799	P	67.3	Low	64	Low	60 Å²	60	87.9 Å²	87.9	39%	0.39	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-62.3	-21.8	179.1	24.5	-33.7	0	0	0	113.2	N801 M852 A853	P799-N801 VanDerWaalsContact C-N 3.27Å; P799-N801 PolarHBondContact O-N 3.09Å; P799-M852 HydrophobicContact CB-CB 4.15Å; P799-M852 HydrophobicContact CB-CG 4.39Å; P799-M852 HydrophobicContact CB-SD 4.48Å; P799-M852 WeakPolarHBondContact O-CB 3.5Å; P799-M852 PolarHBondContact O-N 3.16Å; P799-A853 HydrophobicContact CB-CB 4.34Å; P799-A853 PolarHBondContact O-N 2.96Å
800	E	72.2	Confident	66	Low	140 Å²	140	83.8 Å²	83.8	65%	0.654	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-69.9	-25	173.4	-62.4	179	-177.3	0	0	112.5	S798 T851 A853	S798-E800 PolarHBondContact O-N 3.11Å; S798-E800 VanDerWaalsContact O-N 3.14Å; E800-T851 WeakPolarHBondContact O-CG2 3.21Å; E800-A853 HydrophobicContact CG-CB 4.33Å
801	N	72.2	Confident	68	Low	74 Å²	74	79.2 Å²	79.2	40%	0.396	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-92.9	0.8	-179.1	-68.5	-9.7	0	0	0	113.3	C746 I797 S798 P799	C746-N801 WeakPolarHBondContact CB-O 3.2Å; C746-N801 PolarHBondContact N-O 3.46Å; I797-N801 HydrophobicContact CG2-CB 4.05Å; S798-N801 PolarHBondContact O-N 3.15Å; S798-N801 WeakPolarHBondContact OG-CB 3.46Å; S798-N801 PolarHBondContact OG-ND2 3.46Å; P799-N801 VanDerWaalsContact C-N 3.27Å; P799-N801 PolarHBondContact O-N 3.09Å
802	L	78.3	Confident	69.6	Low	2 Å²	2	73.7 Å²	73.7	1%	0.01	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.3	179.6	-72	166.4	0	0	0	109.8	Y728 C743 V745 I797 T851 M852	Y728-L802 HydrophobicContact CE2-CD1 3.72Å; Y728-L802 HydrophobicContact CE2-CD2 4.33Å; Y728-L802 VanDerWaalsContact OH-CD1 3.26Å; Y728-L802 WeakPolarHBondContact OH-CD1 3.49Å; C743-L802 HydrophobicContact CB-CB 4.1Å; C743-L802 HydrophobicContact CB-CD2 4.17Å; V745-L802 HydrophobicContact CG2-CD2 4.23Å; I797-L802 HydrophobicContact CB-CD1 4.43Å; I797-L802 HydrophobicContact CB-CG 4.45Å; I797-L802 HydrophobicContact CD1-CD2 4.4Å; I797-L802 HydrophobicContact CG2-CD1 4.21Å; I797-L802 HydrophobicContact CG2-CD2 3.89Å; I797-L802 HydrophobicContact CG2-CG 3.74Å; L802-T851 CarbonylContact O-C 3.56Å; L802-T851 VanDerWaalsContact O-CA 3.27Å; L802-T851 WeakPolarHBondContact O-CA 3.48Å; L802-M852 HydrophobicContact CB-CB 3.94Å; L802-M852 HydrophobicContact CB-SD 4.49Å; L802-M852 HydrophobicContact CD1-SD 3.75Å; L802-M852 PolarHBondContact O-N 3.38Å
803	K	83.1	Confident	71.1	Confident	85 Å²	85	69.5 Å²	69.5	37%	0.37	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.5	178.3	-173.1	176.5	-179.2	176.2	0	110.9	C743 Q744 I805 G849 F850	C743-K803 CarbonylContact C-O 3.54Å; C743-K803 WeakPolarHBondContact CA-O 3.38Å; Q744-K803 PolarHBondContact N-O 3.33Å; Q744-K803 PolarHBondContact O-N 2.91Å; K803-I805 PolarHBondContact O-N 3.07Å; K803-G849 VanDerWaalsContact CE-CA 3.47Å; K803-G849 WeakPolarHBondContact CE-O 3.49Å; K803-F850 WeakPolarHBondContact CA-O 3.36Å
804	V	84.5	Confident	72	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125.8	-179.1	-179.1	0	0	0	0	110.7	L741 T742 V807 G849 F850 V855	L741-V804 HydrophobicContact CD2-CG1 4.33Å; T742-V804 CarbonylContact O-C 3.59Å; V804-V807 HydrophobicContact CG1-CG2 3.57Å; V804-G849 PolarHBondContact O-N 3.5Å; V804-F850 PolarHBondContact N-O 2.98Å; V804-V855 HydrophobicContact CB-CG2 4.17Å; V804-V855 HydrophobicContact CG2-CB 4.1Å; V804-V855 HydrophobicContact CG2-CG1 4.3Å; V804-V855 HydrophobicContact CG2-CG2 3.69Å
805	I	84.2	Confident	73	Confident	69 Å²	69	67.6 Å²	67.6	35%	0.354	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-34.4	177.5	-56.3	163.7	0	0	0	111.2	N725 T742 Q744 K803 I848	N725-I805 WeakPolarHBondContact OD1-CD1 3.4Å; T742-I805 PolarHBondContact O-N 2.66Å; Q744-I805 HydrophobicContact CB-CD1 3.31Å; Q744-I805 HydrophobicContact CB-CG1 4.05Å; Q744-I805 HydrophobicContact CG-CD1 4.4Å; K803-I805 PolarHBondContact O-N 3.07Å; I805-I848 WeakPolarHBondContact O-CD1 3.17Å; I805-I848 WeakPolarHBondContact O-CG2 3.47Å
806	S	84.7	Confident	73.3	Confident	34 Å²	34	66 Å²	66	24%	0.238	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	145.9	-175.8	112.6	0	0	0	0	110.9	L741 T742	L741-S806 WeakPolarHBondContact CA-O 3.42Å; T742-S806 WeakPolarHBondContact CB-OG 3.41Å; T742-S806 PolarHBondContact N-O 3.48Å; T742-S806 PolarHBondContact O-N 3.43Å; T742-S806 PolarHBondContact OG1-OG 2.91Å
807	V	86.5	Confident	73.3	Confident	9 Å²	9	62.1 Å²	62.1	6%	0.055	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.6	178.3	-177.3	0	0	0	0	109.2	F739 I740 L741 V804 L843 C847	F739-V807 HydrophobicContact CD1-CG1 4.33Å; I740-V807 CarbonylContact O-C 3.52Å; I740-V807 WeakPolarHBondContact O-CA 3.28Å; L741-V807 HydrophobicContact CD2-CB 4.18Å; L741-V807 HydrophobicContact CD2-CG1 3.82Å; L741-V807 HydrophobicContact CD2-CG2 3.63Å; V804-V807 HydrophobicContact CG1-CG2 3.57Å; V807-L843 HydrophobicContact CG1-CD2 4.01Å; V807-L843 HydrophobicContact CG1-CG 4.28Å; V807-C847 HydrophobicContact CG2-CB 3.53Å
808	Q	83.7	Confident	73	Confident	106 Å²	106	64.7 Å²	64.7	50%	0.495	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.8	172.8	-56.5	-179.2	10.6	0	0	109.8	F739 I740	F739-Q808 CarbonylContact C-O 3.53Å; F739-Q808 WeakPolarHBondContact CA-O 3.32Å; I740-Q808 HydrophobicContact CB-CB 4.29Å; I740-Q808 PolarHBondContact N-O 3.12Å; I740-Q808 PolarHBondContact O-N 3.46Å
809	V	85.7	Confident	72.6	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.2	178.9	-173.1	0	0	0	0	108.7	F739 I832 L835 N836 L843	F739-V809 HydrophobicContact CD1-CG2 3.71Å; F739-V809 HydrophobicContact CE1-CG2 3.64Å; F739-V809 HydrophobicContact CZ-CG2 4.41Å; V809-I832 HydrophobicContact CG1-CG1 4.22Å; V809-L835 HydrophobicContact CB-CB 4.46Å; V809-L835 HydrophobicContact CG1-CD1 4.16Å; V809-L835 HydrophobicContact CG2-CB 4.2Å; V809-L835 HydrophobicContact CG2-CD1 4.01Å; V809-N836 PolarHBondContact O-ND2 3.42Å; V809-N836 PolarHBondContact O-OD1 2.97Å; V809-L843 HydrophobicContact CG2-CD2 3.59Å
810	I	81.5	Confident	72.6	Confident	61 Å²	61	68 Å²	68	31%	0.313	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156.6	-177.6	59.1	159.7	0	0	0	111.2	M737 N738 I740	M737-I810 WeakPolarHBondContact CA-O 3.31Å; N738-I810 HydrophobicContact CB-CG1 4.06Å; N738-I810 PolarHBondContact N-O 2.79Å; N738-I810 PolarHBondContact O-N 3.22Å; I740-I810 HydrophobicContact CD1-CD1 3.61Å; I740-I810 HydrophobicContact CD1-CG1 4.01Å; I740-I810 HydrophobicContact CD1-CG2 4.35Å; I740-I810 HydrophobicContact CG1-CD1 4.19Å; I740-I810 HydrophobicContact CG1-CG1 4.27Å
811	A	79.4	Confident	72.9	Confident	61 Å²	61	61.3 Å²	61.3	50%	0.504	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-69.5	143.8	164.4	0	0	0	0	0	109.1	I832	A811-I832 HydrophobicContact CB-CD1 3.98Å
812	P	72.7	Confident	73.2	Confident	18 Å²	18	61.2 Å²	61.2	12%	0.117	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-66	156.1	173.7	18	-14.4	0	0	0	110.4	G735 L736	G735-P812 WeakPolarHBondContact O-CG 3.33Å; L736-P812 WeakPolarHBondContact O-CD 3.36Å
813	S	68.7	Low	73.3	Confident	68 Å²	68	61.3 Å²	61.3	48%	0.476	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-64.5	150.2	176	69	0	0	0	0	111.5	V815 E816	S813-V815 PolarHBondContact O-N 3.04Å; S813-E816 PolarHBondContact O-N 3.17Å
814	D	59.8	Low	73.3	Confident	166 Å²	166	57.4 Å²	57.4	89%	0.888	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-54.9	-21.1	-178.2	-67.3	-31.8	0	0	0	113.8
815	V	58.2	Low	73.1	Confident	140 Å²	140	60.7 Å²	60.7	85%	0.848	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-76.5	-24	178.9	-169.8	0	0	0	0	112.2	S813	S813-V815 PolarHBondContact O-N 3.04Å
816	E	53.6	Low	73	Confident	73 Å²	73	58.9 Å²	58.9	34%	0.341	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-112.7	17.3	-173.3	-66.7	-165.8	149.9	0	0	113.8	R715 S813 P818	R715-E816 IonicContact NH1-OE1 3.26Å; R715-E816 PolarHBondContact NH1-OE1 3.25Å; S813-E816 PolarHBondContact O-N 3.17Å; E816-P818 WeakPolarHBondContact O-CD 3.47Å
817	C	52.8	Low	72.9	Confident	55 Å²	55	57.5 Å²	57.5	37%	0.372	33%	0.329	S	S	.	.			trans	-90.2	96.1	176.6	-162.1	0	0	0	0	110.7	V819	C817-V819 VanDerWaalsContact C-N 3.3Å; C817-V819 PolarHBondContact O-N 2.71Å
818	P	53.9	Low	72.7	Confident	90 Å²	90	57.4 Å²	57.4	58%	0.584	33%	0.329	S	S	*	.			trans	-78.6	-11.9	-175.3	33	-38.2	0	0	0	113.5	F734 E816	F734-P818 WeakPolarHBondContact O-CD 3.37Å; F734-P818 WeakPolarHBondContact O-CG 3.41Å; E816-P818 WeakPolarHBondContact O-CD 3.47Å
819	V	62.1	Low	72.7	Confident	8 Å²	8	59.7 Å²	59.7	5%	0.048	33%	0.333	C	S	.	.			trans	-102.2	97.1	-171.2	-174.6	0	0	0	0	110.7	F734 L736 C817 C821 V824	F734-V819 HydrophobicContact CB-CG2 3.9Å; F734-V819 HydrophobicContact CD1-CG2 4.19Å; F734-V819 HydrophobicContact CG-CG2 4.37Å; F734-V819 WeakPolarHBondContact O-CG2 3.26Å; L736-V819 HydrophobicContact CD2-CB 4.44Å; C817-V819 VanDerWaalsContact C-N 3.3Å; C817-V819 PolarHBondContact O-N 2.71Å; V819-C821 HydrophobicContact CG1-CB 3.55Å; V819-C821 PolarHBondContact O-N 3.19Å; V819-V824 HydrophobicContact CG1-CB 4.31Å; V819-V824 HydrophobicContact CG1-CG1 4.26Å
820	E	67.7	Low	72.5	Confident	166 Å²	166	60.9 Å²	60.9	78%	0.776	34%	0.341	S	S	*	.			trans	-70.7	61.2	167.7	-62.4	-178.8	172.5	0	0	111.3	W877	E820-W877 WeakPolarHBondContact O-CH2 3.45Å; E820-W877 VanDerWaalsContact O-CZ2 3.24Å; E820-W877 WeakPolarHBondContact O-CZ2 3.29Å; E820-W877 VanDerWaalsContact O-CZ3 3.32Å; E820-W877 WeakPolarHBondContact O-CZ3 3.41Å
821	C	77	Confident	72.5	Confident	1 Å²	1	58 Å²	58	1%	0.007	33%	0.326	C	S	.	.			trans	-138.3	96.7	-179.6	-167	0	0	0	0	111	V819 P823 V824 E825 W877	V819-C821 HydrophobicContact CG1-CB 3.55Å; V819-C821 PolarHBondContact O-N 3.19Å; C821-P823 VanDerWaalsContact C-CD 3.4Å; C821-P823 VanDerWaalsContact C-N 3.32Å; C821-V824 HydrophobicContact CB-CB 4.05Å; C821-V824 HydrophobicContact CB-CG2 3.91Å; C821-V824 WeakPolarHBondContact O-CB 3.43Å; C821-V824 PolarHBondContact O-N 3.42Å; C821-E825 PolarHBondContact O-N 3.12Å; C821-W877 HydrophobicContact CB-CD2 4.37Å; C821-W877 HydrophobicContact CB-CE3 4.24Å; C821-W877 VanDerWaalsContact SG-CG 3.54Å
822	P	79.9	Confident	72.7	Confident	71 Å²	71	56.1 Å²	56.1	46%	0.461	31%	0.307	S	S	.	.	H	α-helix	trans	-53.6	-36.2	-177.4	-24.3	31.6	0	0	0	115.6	S826	P822-S826 PolarHBondContact O-N 2.8Å; P822-S826 PolarHBondContact O-OG 3.14Å
823	P	80.1	Confident	73.1	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-38.5	173.6	-24.6	34.6	0	0	0	113.5	C821 S826 V827 L873 V883	C821-P823 VanDerWaalsContact C-CD 3.4Å; C821-P823 VanDerWaalsContact C-N 3.32Å; P823-S826 WeakPolarHBondContact O-CB 3.44Å; P823-S826 PolarHBondContact O-N 3.22Å; P823-V827 PolarHBondContact O-N 2.9Å; P823-L873 HydrophobicContact CB-CB 4.08Å; P823-L873 HydrophobicContact CB-CD1 4.24Å; P823-V883 HydrophobicContact CB-CG1 4.27Å; P823-V883 HydrophobicContact CG-CB 4.02Å; P823-V883 HydrophobicContact CG-CG1 4.3Å; P823-V883 WeakPolarHBondContact CG-O 3.5Å
824	V	81.9	Confident	73.8	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-72.2	-41.3	180	176.7	0	0	0	0	110.5	L736 V819 C821 S826 V827 A828 A870 L873 R874	L736-V824 HydrophobicContact CD1-CG1 3.63Å; L736-V824 HydrophobicContact CD2-CG1 3.64Å; L736-V824 HydrophobicContact CG-CG1 4.3Å; V819-V824 HydrophobicContact CG1-CB 4.31Å; V819-V824 HydrophobicContact CG1-CG1 4.26Å; C821-V824 HydrophobicContact CB-CB 4.05Å; C821-V824 HydrophobicContact CB-CG2 3.91Å; C821-V824 WeakPolarHBondContact O-CB 3.43Å; C821-V824 PolarHBondContact O-N 3.42Å; V824-S826 PolarHBondContact O-N 3.29Å; V824-V827 PolarHBondContact O-N 3.32Å; V824-A828 PolarHBondContact O-N 2.9Å; V824-A870 HydrophobicContact CG1-CB 3.93Å; V824-A870 HydrophobicContact CG2-CB 4.4Å; V824-A870 WeakPolarHBondContact CG2-O 3.36Å; V824-L873 HydrophobicContact CG2-CB 4.45Å; V824-R874 HydrophobicContact CG2-CB 3.94Å
825	E	81.2	Confident	74.9	Confident	71 Å²	71	51.7 Å²	51.7	33%	0.332	27%	0.271	S	S	.	.	H	α-helix	trans	-57.6	-37.2	171.4	-67.2	173.7	-170.5	0	0	111.8	C821 A828 R829	C821-E825 PolarHBondContact O-N 3.12Å; E825-A828 PolarHBondContact O-N 2.91Å; E825-R829 WeakPolarHBondContact O-CB 3.2Å; E825-R829 PolarHBondContact O-N 3.34Å
826	S	82.4	Confident	75.9	Confident	30 Å²	30	48.7 Å²	48.7	21%	0.21	25%	0.25	C	C	.	.	H	α-helix	trans	-66	-41.6	177.4	-58.5	0	0	0	0	111.9	P822 P823 V824 R829 T830	P822-S826 PolarHBondContact O-N 2.8Å; P822-S826 PolarHBondContact O-OG 3.14Å; P823-S826 WeakPolarHBondContact O-CB 3.44Å; P823-S826 PolarHBondContact O-N 3.22Å; V824-S826 PolarHBondContact O-N 3.29Å; S826-R829 PolarHBondContact O-N 3.47Å; S826-T830 PolarHBondContact O-N 2.88Å; S826-T830 VanDerWaalsContact O-N 3.1Å; S826-T830 PolarHBondContact O-OG1 3.01Å
827	V	82.8	Confident	77.1	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.036	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-46.5	173.4	173.4	0	0	0	0	111.1	P823 V824 R829 T830 F831 F866 L869 L873 F885	P823-V827 PolarHBondContact O-N 2.9Å; V824-V827 PolarHBondContact O-N 3.32Å; V827-R829 VanDerWaalsContact C-N 3.35Å; V827-R829 PolarHBondContact O-N 2.82Å; V827-T830 PolarHBondContact O-N 3.38Å; V827-F831 WeakPolarHBondContact O-CB 3.48Å; V827-F831 PolarHBondContact O-N 3.12Å; V827-F866 HydrophobicContact CG1-CD1 4.21Å; V827-L869 HydrophobicContact CG1-CD2 4.26Å; V827-L869 HydrophobicContact CG2-CD2 3.87Å; V827-L869 HydrophobicContact CG2-CG 4.25Å; V827-L873 HydrophobicContact CG2-CD1 3.35Å; V827-F885 HydrophobicContact CB-CD1 4.38Å; V827-F885 HydrophobicContact CB-CE1 4.27Å; V827-F885 HydrophobicContact CG2-CB 4.35Å; V827-F885 HydrophobicContact CG2-CD1 3.61Å; V827-F885 HydrophobicContact CG2-CD2 3.9Å; V827-F885 HydrophobicContact CG2-CE1 3.76Å; V827-F885 HydrophobicContact CG2-CE2 4.04Å; V827-F885 HydrophobicContact CG2-CG 3.67Å; V827-F885 HydrophobicContact CG2-CZ 3.97Å
828	A	82.4	Confident	78.1	Confident	7 Å²	7	50.4 Å²	50.4	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-45.5	179.1	0	0	0	0	0	111.5	L736 V824 E825 F831 I832	L736-A828 HydrophobicContact CB-CB 3.93Å; L736-A828 HydrophobicContact CD2-CB 4.28Å; V824-A828 PolarHBondContact O-N 2.9Å; E825-A828 PolarHBondContact O-N 2.91Å; A828-F831 PolarHBondContact O-N 2.93Å; A828-I832 VanDerWaalsContact O-CG1 3.28Å; A828-I832 WeakPolarHBondContact O-CG1 3.32Å; A828-I832 PolarHBondContact O-N 3.39Å
829	R	82.4	Confident	79.3	Confident	154 Å²	154	46.1 Å²	46.1	58%	0.581	24%	0.244	S	C	*	.	H	α-helix	trans	-59.6	-49.2	177.9	-170	-176.8	-61.4	125.8	4.1	112.1	E825 S826 V827 F831 I832 E833	E825-R829 WeakPolarHBondContact O-CB 3.2Å; E825-R829 PolarHBondContact O-N 3.34Å; S826-R829 PolarHBondContact O-N 3.47Å; V827-R829 VanDerWaalsContact C-N 3.35Å; V827-R829 PolarHBondContact O-N 2.82Å; R829-F831 VanDerWaalsContact C-N 3.26Å; R829-F831 PolarHBondContact O-N 3.36Å; R829-I832 PolarHBondContact O-N 3.22Å; R829-E833 WeakPolarHBondContact O-CB 3.35Å; R829-E833 PolarHBondContact O-N 3.34Å
830	T	81.5	Confident	80	Confident	26 Å²	26	46.7 Å²	46.7	16%	0.16	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-38.1	178	-61.8	0	0	0	0	111.8	S826 V827 Y834 F885 M887	S826-T830 PolarHBondContact O-N 2.88Å; S826-T830 VanDerWaalsContact O-N 3.1Å; S826-T830 PolarHBondContact O-OG1 3.01Å; V827-T830 PolarHBondContact O-N 3.38Å; T830-Y834 WeakPolarHBondContact O-CB 3.46Å; T830-Y834 PolarHBondContact O-N 3.46Å; T830-F885 HydrophobicContact CG2-CE1 4.43Å; T830-M887 HydrophobicContact CG2-CB 4.22Å; T830-M887 HydrophobicContact CG2-SD 3.82Å
831	F	82.7	Confident	80.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-72.6	-43	-180	-175.9	-128.3	0	0	0	113.4	M737 V827 A828 R829 E833 Y834 L835 I862 I863 F866	M737-F831 HydrophobicContact CE-CD1 3.51Å; M737-F831 HydrophobicContact CE-CE1 4.07Å; M737-F831 HydrophobicContact SD-CD1 3.49Å; M737-F831 WeakPolarHBondContact SD-CD1 3.45Å; M737-F831 HydrophobicContact SD-CE1 3.53Å; M737-F831 VanDerWaalsContact SD-CE1 3.53Å; V827-F831 WeakPolarHBondContact O-CB 3.48Å; V827-F831 PolarHBondContact O-N 3.12Å; A828-F831 PolarHBondContact O-N 2.93Å; R829-F831 VanDerWaalsContact C-N 3.26Å; R829-F831 PolarHBondContact O-N 3.36Å; F831-E833 VanDerWaalsContact C-N 3.29Å; F831-E833 PolarHBondContact O-N 2.92Å; F831-Y834 HydrophobicContact CD2-CD1 4.17Å; F831-Y834 HydrophobicContact CE2-CD1 4.22Å; F831-Y834 PolarHBondContact O-N 3.07Å; F831-L835 HydrophobicContact CD1-CD1 4.05Å; F831-L835 HydrophobicContact CD2-CD1 4.39Å; F831-L835 HydrophobicContact CD2-CG 4.06Å; F831-L835 HydrophobicContact CE1-CD1 3.47Å; F831-L835 VanDerWaalsContact CE1-CD1 3.47Å; F831-L835 HydrophobicContact CE1-CG 4.18Å; F831-L835 HydrophobicContact CE2-CD1 3.83Å; F831-L835 HydrophobicContact CE2-CD2 3.82Å; F831-L835 HydrophobicContact CE2-CG 3.63Å; F831-L835 HydrophobicContact CZ-CD1 3.39Å; F831-L835 HydrophobicContact CZ-CD2 4.02Å; F831-L835 HydrophobicContact CZ-CG 3.76Å; F831-L835 PolarHBondContact O-N 3.38Å; F831-I862 HydrophobicContact CZ-CG2 3.7Å; F831-I863 HydrophobicContact CE1-CG1 4.39Å; F831-F866 HydrophobicContact CB-CD1 3.79Å; F831-F866 HydrophobicContact CB-CE1 3.73Å; F831-F866 HydrophobicContact CB-CZ 4.44Å; F831-F866 HydrophobicContact CD1-CD1 4.23Å; F831-F866 HydrophobicContact CD1-CD2 4.23Å; F831-F866 HydrophobicContact CD1-CE1 4.4Å; F831-F866 HydrophobicContact CD1-CE2 4.42Å; F831-F866 HydrophobicContact CD1-CG 4.15Å; F831-F866 AromaticContact CD2-CD1 3.79Å; F831-F866 HydrophobicContact CD2-CD1 3.79Å; F831-F866 HydrophobicContact CD2-CD2 4.02Å; F831-F866 AromaticContact CD2-CE1 3.15Å; F831-F866 HydrophobicContact CD2-CE1 3.15Å; F831-F866 AromaticContact CD2-CE2 3.44Å; F831-F866 HydrophobicContact CD2-CE2 3.44Å; F831-F866 VanDerWaalsContact CD2-CE2 3.44Å; F831-F866 HydrophobicContact CD2-CG 4.19Å; F831-F866 AromaticContact CD2-CZ 2.97Å; F831-F866 HydrophobicContact CD2-CZ 2.97Å; F831-F866 AromaticContact CE1-CD2 3.93Å; F831-F866 HydrophobicContact CE1-CD2 3.93Å; F831-F866 HydrophobicContact CE1-CE2 4.08Å; F831-F866 HydrophobicContact CE1-CG 4.29Å; F831-F866 HydrophobicContact CE2-CD1 4.36Å; F831-F866 AromaticContact CE2-CD2 3.74Å; F831-F866 HydrophobicContact CE2-CD2 3.74Å; F831-F866 AromaticContact CE2-CE1 3.74Å; F831-F866 HydrophobicContact CE2-CE1 3.74Å; F831-F866 AromaticContact CE2-CE2 3.03Å; F831-F866 HydrophobicContact CE2-CE2 3.03Å; F831-F866 HydrophobicContact CE2-CG 4.36Å; F831-F866 AromaticContact CE2-CZ 3.04Å; F831-F866 HydrophobicContact CE2-CZ 3.04Å; F831-F866 AromaticContact CG-CD1 3.67Å; F831-F866 HydrophobicContact CG-CD1 3.67Å; F831-F866 HydrophobicContact CG-CD2 4.21Å; F831-F866 AromaticContact CG-CE1 3.51Å; F831-F866 HydrophobicContact CG-CE1 3.51Å; F831-F866 HydrophobicContact CG-CE2 4.1Å; F831-F866 HydrophobicContact CG-CG 4.03Å; F831-F866 AromaticContact CG-CZ 3.76Å; F831-F866 HydrophobicContact CG-CZ 3.76Å; F831-F866 AromaticContact CZ-CD2 3.63Å; F831-F866 HydrophobicContact CZ-CD2 3.63Å; F831-F866 HydrophobicContact CZ-CE1 4.5Å; F831-F866 AromaticContact CZ-CE2 3.34Å; F831-F866 HydrophobicContact CZ-CE2 3.34Å; F831-F866 HydrophobicContact CZ-CG 4.35Å; F831-F866 AromaticContact CZ-CZ 3.84Å; F831-F866 HydrophobicContact CZ-CZ 3.84Å
832	I	83.4	Confident	80.3	Confident	21 Å²	21	49 Å²	49	11%	0.108	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-44.2	174.4	-67.8	164	0	0	0	110	M737 V809 A811 A828 R829 Y834 L835 N836	M737-I832 HydrophobicContact CB-CD1 4.02Å; M737-I832 HydrophobicContact CB-CG1 4Å; V809-I832 HydrophobicContact CG1-CG1 4.22Å; A811-I832 HydrophobicContact CB-CD1 3.98Å; A828-I832 VanDerWaalsContact O-CG1 3.28Å; A828-I832 WeakPolarHBondContact O-CG1 3.32Å; A828-I832 PolarHBondContact O-N 3.39Å; R829-I832 PolarHBondContact O-N 3.22Å; I832-Y834 VanDerWaalsContact C-N 3.35Å; I832-Y834 PolarHBondContact O-N 2.88Å; I832-L835 PolarHBondContact O-N 2.87Å; I832-N836 WeakPolarHBondContact CG2-ND2 3.5Å; I832-N836 WeakPolarHBondContact O-CB 3.34Å; I832-N836 PolarHBondContact O-N 2.86Å; I832-N836 PolarHBondContact O-ND2 2.82Å
833	E	81.7	Confident	80.3	Confident	126 Å²	126	45.8 Å²	45.8	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-59.7	-44.7	176	-174.9	177.4	-179.3	0	0	111.7	R829 F831 N836 T837	R829-E833 WeakPolarHBondContact O-CB 3.35Å; R829-E833 PolarHBondContact O-N 3.34Å; F831-E833 VanDerWaalsContact C-N 3.29Å; F831-E833 PolarHBondContact O-N 2.92Å; E833-N836 PolarHBondContact O-N 2.92Å; E833-T837 WeakPolarHBondContact O-CB 3.42Å; E833-T837 WeakPolarHBondContact O-CG2 3.49Å; E833-T837 PolarHBondContact O-N 3.05Å; E833-T837 PolarHBondContact O-OG1 3.49Å
834	Y	81.4	Confident	80.3	Confident	33 Å²	33	51.8 Å²	51.8	13%	0.129	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-49	176.6	170.3	-106.6	0	0	0	112.6	T830 F831 I832 N836 T837 A838 G839 L954 T955 P956	T830-Y834 WeakPolarHBondContact O-CB 3.46Å; T830-Y834 PolarHBondContact O-N 3.46Å; F831-Y834 HydrophobicContact CD2-CD1 4.17Å; F831-Y834 HydrophobicContact CE2-CD1 4.22Å; F831-Y834 PolarHBondContact O-N 3.07Å; I832-Y834 VanDerWaalsContact C-N 3.35Å; I832-Y834 PolarHBondContact O-N 2.88Å; Y834-N836 PolarHBondContact O-N 3.13Å; Y834-T837 CarbonylContact O-C 3.49Å; Y834-T837 PolarHBondContact O-N 3.05Å; Y834-T837 VanDerWaalsContact O-N 3.11Å; Y834-T837 PolarHBondContact O-OG1 2.88Å; Y834-A838 HydrophobicContact CD2-CB 4.11Å; Y834-A838 HydrophobicContact CE2-CB 3.97Å; Y834-A838 PolarHBondContact O-N 3.47Å; Y834-G839 WeakPolarHBondContact O-CA 3.24Å; Y834-G839 PolarHBondContact O-N 3.38Å; Y834-L954 HydrophobicContact CE1-CD1 4.14Å; Y834-L954 HydrophobicContact CE1-CG 3.95Å; Y834-L954 WeakPolarHBondContact OH-CD1 3.44Å; Y834-T955 PolarHBondContact OH-O 3.11Å; Y834-P956 HydrophobicContact CD1-CB 4.41Å; Y834-P956 HydrophobicContact CD1-CG 4.18Å; Y834-P956 HydrophobicContact CD2-CB 3.79Å; Y834-P956 HydrophobicContact CD2-CG 4.39Å; Y834-P956 HydrophobicContact CE2-CB 4.23Å; Y834-P956 HydrophobicContact CG-CB 3.89Å; Y834-P956 HydrophobicContact CG-CG 3.98Å
835	L	82.9	Confident	80.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-27.9	179.7	-71.4	-174	0	0	0	113	F739 V809 F831 I832 S840 L843 L954	F739-L835 HydrophobicContact CE1-CD1 4.2Å; F739-L835 HydrophobicContact CZ-CD1 4.14Å; V809-L835 HydrophobicContact CB-CB 4.46Å; V809-L835 HydrophobicContact CG1-CD1 4.16Å; V809-L835 HydrophobicContact CG2-CB 4.2Å; V809-L835 HydrophobicContact CG2-CD1 4.01Å; F831-L835 HydrophobicContact CD1-CD1 4.05Å; F831-L835 HydrophobicContact CD2-CD1 4.39Å; F831-L835 HydrophobicContact CD2-CG 4.06Å; F831-L835 HydrophobicContact CE1-CD1 3.47Å; F831-L835 VanDerWaalsContact CE1-CD1 3.47Å; F831-L835 HydrophobicContact CE1-CG 4.18Å; F831-L835 HydrophobicContact CE2-CD1 3.83Å; F831-L835 HydrophobicContact CE2-CD2 3.82Å; F831-L835 HydrophobicContact CE2-CG 3.63Å; F831-L835 HydrophobicContact CZ-CD1 3.39Å; F831-L835 HydrophobicContact CZ-CD2 4.02Å; F831-L835 HydrophobicContact CZ-CG 3.76Å; F831-L835 PolarHBondContact O-N 3.38Å; I832-L835 PolarHBondContact O-N 2.87Å; L835-S840 WeakPolarHBondContact O-CA 3.37Å; L835-S840 VanDerWaalsContact O-CB 3.23Å; L835-S840 WeakPolarHBondContact O-CB 3.23Å; L835-S840 PolarHBondContact O-N 2.71Å; L835-L843 HydrophobicContact CB-CD2 4.47Å; L835-L954 HydrophobicContact CD2-CD2 3.44Å; L835-L954 VanDerWaalsContact CD2-CD2 3.44Å; L835-L954 HydrophobicContact CD2-CG 3.93Å
836	N	80.4	Confident	80	Confident	77 Å²	77	55.1 Å²	55.1	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-85.3	-11.8	175.4	-73.8	-29.6	0	0	0	113.8	V809 I832 E833 Y834	V809-N836 PolarHBondContact O-ND2 3.42Å; V809-N836 PolarHBondContact O-OD1 2.97Å; I832-N836 WeakPolarHBondContact CG2-ND2 3.5Å; I832-N836 WeakPolarHBondContact O-CB 3.34Å; I832-N836 PolarHBondContact O-N 2.86Å; I832-N836 PolarHBondContact O-ND2 2.82Å; E833-N836 PolarHBondContact O-N 2.92Å; Y834-N836 PolarHBondContact O-N 3.13Å
837	T	79.1	Confident	79.9	Confident	90 Å²	90	53.7 Å²	53.7	55%	0.552	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-101	-179.3	58.3	0	0	0	0	111.3	E833 Y834 G839 S840	E833-T837 WeakPolarHBondContact O-CB 3.42Å; E833-T837 WeakPolarHBondContact O-CG2 3.49Å; E833-T837 PolarHBondContact O-N 3.05Å; E833-T837 PolarHBondContact O-OG1 3.49Å; Y834-T837 CarbonylContact O-C 3.49Å; Y834-T837 PolarHBondContact O-N 3.05Å; Y834-T837 VanDerWaalsContact O-N 3.11Å; Y834-T837 PolarHBondContact O-OG1 2.88Å; T837-G839 VanDerWaalsContact C-N 3.32Å; T837-G839 PolarHBondContact O-N 3.37Å; T837-S840 WeakPolarHBondContact O-CB 3.24Å; T837-S840 PolarHBondContact O-N 3.42Å
838	A	74.2	Confident	79.9	Confident	74 Å²	74	56.7 Å²	56.7	61%	0.612	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-31.6	-174.1	0	0	0	0	0	113.3	Y834	Y834-A838 HydrophobicContact CD2-CB 4.11Å; Y834-A838 HydrophobicContact CE2-CB 3.97Å; Y834-A838 PolarHBondContact O-N 3.47Å
839	G	77.7	Confident	79.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.1	178.9	0	0	0	0	0	114.5	Y834 T837 E841 I842 L843	Y834-G839 WeakPolarHBondContact O-CA 3.24Å; Y834-G839 PolarHBondContact O-N 3.38Å; T837-G839 VanDerWaalsContact C-N 3.32Å; T837-G839 PolarHBondContact O-N 3.37Å; G839-E841 PolarHBondContact O-N 3.43Å; G839-I842 PolarHBondContact O-N 3.28Å; G839-L843 WeakPolarHBondContact O-CB 3.44Å; G839-L843 PolarHBondContact O-N 3.35Å
840	S	77.4	Confident	79.7	Confident	21 Å²	21	55.4 Å²	55.4	15%	0.147	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-43	-169.1	-169.5	0	0	0	0	113.2	L835 T837 I842 L843 R844	L835-S840 WeakPolarHBondContact O-CA 3.37Å; L835-S840 VanDerWaalsContact O-CB 3.23Å; L835-S840 WeakPolarHBondContact O-CB 3.23Å; L835-S840 PolarHBondContact O-N 2.71Å; T837-S840 WeakPolarHBondContact O-CB 3.24Å; T837-S840 PolarHBondContact O-N 3.42Å; S840-I842 PolarHBondContact O-N 3.28Å; S840-L843 PolarHBondContact O-N 3.47Å; S840-R844 WeakPolarHBondContact O-CB 3.49Å; S840-R844 VanDerWaalsContact O-CG 3.27Å; S840-R844 WeakPolarHBondContact O-CG 3.43Å; S840-R844 PolarHBondContact O-N 3.15Å
841	E	74.1	Confident	79.6	Confident	154 Å²	154	55.9 Å²	55.9	72%	0.72	30%	0.298	S	S	*	.	H	α-helix	trans	-66.7	-38.3	179.5	-170.7	173.2	-169.9	0	0	111.8	G839 R844 T845	G839-E841 PolarHBondContact O-N 3.43Å; E841-R844 PolarHBondContact O-N 3.17Å; E841-T845 WeakPolarHBondContact O-CB 3.43Å; E841-T845 PolarHBondContact O-N 2.94Å; E841-T845 PolarHBondContact O-OG1 3.43Å
842	I	76.6	Confident	79.4	Confident	60 Å²	60	56.2 Å²	56.2	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-70.8	-43	178.6	-55.6	170.2	0	0	0	110	G839 S840 R844 T845 R846 L954	G839-I842 PolarHBondContact O-N 3.28Å; S840-I842 PolarHBondContact O-N 3.28Å; I842-R844 PolarHBondContact O-N 3.02Å; I842-T845 PolarHBondContact O-N 3.42Å; I842-R846 WeakPolarHBondContact O-CG 3.36Å; I842-R846 PolarHBondContact O-N 3.42Å; I842-L954 HydrophobicContact CB-CD1 3.66Å; I842-L954 HydrophobicContact CD1-CD1 3.88Å; I842-L954 HydrophobicContact CG1-CD1 4.37Å; I842-L954 HydrophobicContact CG2-CD1 3.62Å
843	L	81.1	Confident	79	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-57.6	-48.9	174.3	-178.7	66.6	0	0	0	110.9	F739 V807 V809 L835 G839 S840 T845 R846 C847 I862 L954	F739-L843 HydrophobicContact CE1-CD1 4.38Å; V807-L843 HydrophobicContact CG1-CD2 4.01Å; V807-L843 HydrophobicContact CG1-CG 4.28Å; V809-L843 HydrophobicContact CG2-CD2 3.59Å; L835-L843 HydrophobicContact CB-CD2 4.47Å; G839-L843 WeakPolarHBondContact O-CB 3.44Å; G839-L843 PolarHBondContact O-N 3.35Å; S840-L843 PolarHBondContact O-N 3.47Å; L843-T845 VanDerWaalsContact C-N 3.34Å; L843-T845 PolarHBondContact O-N 2.94Å; L843-R846 PolarHBondContact O-N 3.24Å; L843-R846 VanDerWaalsContact O-N 3.16Å; L843-C847 WeakPolarHBondContact O-CB 3.47Å; L843-C847 PolarHBondContact O-N 3.47Å; L843-C847 PolarHBondContact O-SG 2.78Å; L843-C847 VanDerWaalsContact O-SG 3.37Å; L843-I862 HydrophobicContact CD1-CD1 3.87Å; L843-L954 HydrophobicContact CB-CD2 3.96Å; L843-L954 HydrophobicContact CD1-CD2 4.34Å
844	R	80.1	Confident	78.8	Confident	131 Å²	131	54.1 Å²	54.1	49%	0.494	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-43.7	177.1	-76.3	179.2	179	169.5	2.4	112.2	S840 E841 I842 R846 C847 I848	S840-R844 WeakPolarHBondContact O-CB 3.49Å; S840-R844 VanDerWaalsContact O-CG 3.27Å; S840-R844 WeakPolarHBondContact O-CG 3.43Å; S840-R844 PolarHBondContact O-N 3.15Å; E841-R844 PolarHBondContact O-N 3.17Å; I842-R844 PolarHBondContact O-N 3.02Å; R844-R846 PolarHBondContact O-N 3.01Å; R844-C847 PolarHBondContact O-N 3.01Å; R844-I848 HydrophobicContact CB-CD1 3.78Å; R844-I848 HydrophobicContact CB-CG1 4.33Å; R844-I848 HydrophobicContact CG-CD1 3.82Å; R844-I848 VanDerWaalsContact O-CB 3.29Å; R844-I848 WeakPolarHBondContact O-CB 3.43Å; R844-I848 WeakPolarHBondContact O-CG1 3.33Å; R844-I848 PolarHBondContact O-N 3.15Å
845	T	76.1	Confident	78.6	Confident	98 Å²	98	52.5 Å²	52.5	60%	0.601	29%	0.291	S	S	*	.	H	α-helix	trans	-63.6	-31.4	178.4	-55	0	0	0	0	112.5	E841 I842 L843	E841-T845 WeakPolarHBondContact O-CB 3.43Å; E841-T845 PolarHBondContact O-N 2.94Å; E841-T845 PolarHBondContact O-OG1 3.43Å; I842-T845 PolarHBondContact O-N 3.42Å; L843-T845 VanDerWaalsContact C-N 3.34Å; L843-T845 PolarHBondContact O-N 2.94Å
846	R	79.1	Confident	78.4	Confident	46 Å²	46	53.9 Å²	53.9	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-84.2	-23.4	179.6	-69.8	-176.5	-174.6	-169	3.4	113.7	I842 L843 R844 F850 T858 E952	I842-R846 WeakPolarHBondContact O-CG 3.36Å; I842-R846 PolarHBondContact O-N 3.42Å; L843-R846 PolarHBondContact O-N 3.24Å; L843-R846 VanDerWaalsContact O-N 3.16Å; R844-R846 PolarHBondContact O-N 3.01Å; R846-F850 VanDerWaalsContact O-CD2 3.23Å; R846-F850 WeakPolarHBondContact O-CD2 3.49Å; R846-T858 HydrophobicContact CB-CG2 3.99Å; R846-E952 VanDerWaalsContact CZ-O 3.25Å; R846-E952 PolarHBondContact NH1-O 3.33Å; R846-E952 PolarHBondContact NH2-O 2.93Å
847	C	80.9	Confident	78.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-111.5	-36.8	-173.8	-58	0	0	0	0	114.5	V807 L843 R844 G849 F850 V855	V807-C847 HydrophobicContact CG2-CB 3.53Å; L843-C847 WeakPolarHBondContact O-CB 3.47Å; L843-C847 PolarHBondContact O-N 3.47Å; L843-C847 PolarHBondContact O-SG 2.78Å; L843-C847 VanDerWaalsContact O-SG 3.37Å; R844-C847 PolarHBondContact O-N 3.01Å; C847-G849 PolarHBondContact O-N 3.31Å; C847-F850 PolarHBondContact O-N 3.27Å; C847-V855 HydrophobicContact CB-CG1 3.99Å; C847-V855 HydrophobicContact CB-CG2 4.03Å; C847-V855 VanDerWaalsContact O-CG2 3.29Å; C847-V855 WeakPolarHBondContact O-CG2 3.48Å
848	I	82.5	Confident	77.9	Confident	69 Å²	69	51.8 Å²	51.8	35%	0.354	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	129.8	-176.8	-61.7	178.5	0	0	0	109.9	I805 R844	I805-I848 WeakPolarHBondContact O-CD1 3.17Å; I805-I848 WeakPolarHBondContact O-CG2 3.47Å; R844-I848 HydrophobicContact CB-CD1 3.78Å; R844-I848 HydrophobicContact CB-CG1 4.33Å; R844-I848 HydrophobicContact CG-CD1 3.82Å; R844-I848 VanDerWaalsContact O-CB 3.29Å; R844-I848 WeakPolarHBondContact O-CB 3.43Å; R844-I848 WeakPolarHBondContact O-CG1 3.33Å; R844-I848 PolarHBondContact O-N 3.15Å
849	G	79.2	Confident	78.2	Confident	38 Å²	38	48.3 Å²	48.3	39%	0.392	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-4.7	178.9	0	0	0	0	0	114.8	K803 V804 C847	K803-G849 VanDerWaalsContact CE-CA 3.47Å; K803-G849 WeakPolarHBondContact CE-O 3.49Å; V804-G849 PolarHBondContact O-N 3.5Å; C847-G849 PolarHBondContact O-N 3.31Å
850	F	82.6	Confident	77.9	Confident	96 Å²	96	49.6 Å²	49.6	42%	0.421	26%	0.257	S	S	.	.	S	Bend	trans	-95.3	163.6	176.5	-65.1	-84.8	0	0	0	111.5	K803 V804 R846 C847 D854 V855	K803-F850 WeakPolarHBondContact CA-O 3.36Å; V804-F850 PolarHBondContact N-O 2.98Å; R846-F850 VanDerWaalsContact O-CD2 3.23Å; R846-F850 WeakPolarHBondContact O-CD2 3.49Å; C847-F850 PolarHBondContact O-N 3.27Å; F850-D854 HydrophobicContact CB-CB 4.19Å; F850-V855 HydrophobicContact CB-CG2 3.85Å
851	T	78.3	Confident	77.7	Confident	36 Å²	36	49.8 Å²	49.8	22%	0.221	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-71.3	155.2	175.7	70.2	0	0	0	0	110.4	E800 L802 A853 D854 V855	E800-T851 WeakPolarHBondContact O-CG2 3.21Å; L802-T851 CarbonylContact O-C 3.56Å; L802-T851 VanDerWaalsContact O-CA 3.27Å; L802-T851 WeakPolarHBondContact O-CA 3.48Å; T851-A853 PolarHBondContact O-N 3.03Å; T851-D854 PolarHBondContact N-OD2 3.27Å; T851-D854 PolarHBondContact O-N 2.76Å; T851-D854 PolarHBondContact OG1-N 2.82Å; T851-D854 PolarHBondContact OG1-OD2 3.33Å; T851-V855 WeakPolarHBondContact O-CG2 3.44Å; T851-V855 PolarHBondContact O-N 3.23Å
852	M	78.8	Confident	77.8	Confident	7 Å²	7	42.6 Å²	42.6	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-35.1	177.9	-173.4	177.6	-175.4	0	0	111.5	I716 Y728 P799 L802 V855 I856	I716-M852 HydrophobicContact CD1-CE 4.45Å; I716-M852 HydrophobicContact CG2-CE 3.57Å; Y728-M852 HydrophobicContact CD1-CE 3.75Å; Y728-M852 HydrophobicContact CD1-SD 4.48Å; Y728-M852 HydrophobicContact CD2-CE 3.96Å; Y728-M852 HydrophobicContact CD2-SD 4.05Å; Y728-M852 HydrophobicContact CE1-CE 4.33Å; Y728-M852 HydrophobicContact CE2-CE 4.5Å; Y728-M852 HydrophobicContact CE2-SD 4.13Å; Y728-M852 HydrophobicContact CG-CE 3.54Å; Y728-M852 HydrophobicContact CG-SD 4.22Å; P799-M852 HydrophobicContact CB-CB 4.15Å; P799-M852 HydrophobicContact CB-CG 4.39Å; P799-M852 HydrophobicContact CB-SD 4.48Å; P799-M852 WeakPolarHBondContact O-CB 3.5Å; P799-M852 PolarHBondContact O-N 3.16Å; L802-M852 HydrophobicContact CB-CB 3.94Å; L802-M852 HydrophobicContact CB-SD 4.49Å; L802-M852 HydrophobicContact CD1-SD 3.75Å; L802-M852 PolarHBondContact O-N 3.38Å; M852-V855 PolarHBondContact O-N 3.11Å; M852-I856 HydrophobicContact CE-CD1 4.5Å; M852-I856 HydrophobicContact CG-CD1 4.09Å; M852-I856 WeakPolarHBondContact O-CD1 2.88Å; M852-I856 VanDerWaalsContact O-CG1 3.24Å; M852-I856 WeakPolarHBondContact O-CG1 3.24Å; M852-I856 PolarHBondContact O-N 3.18Å
853	A	74.6	Confident	77.7	Confident	33 Å²	33	39.9 Å²	39.9	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-50.3	174.5	0	0	0	0	0	112.4	P799 E800 T851 V855 I856 E857	P799-A853 HydrophobicContact CB-CB 4.34Å; P799-A853 PolarHBondContact O-N 2.96Å; E800-A853 HydrophobicContact CG-CB 4.33Å; T851-A853 PolarHBondContact O-N 3.03Å; A853-V855 VanDerWaalsContact C-N 3.28Å; A853-V855 PolarHBondContact O-N 3.38Å; A853-I856 PolarHBondContact O-N 3.13Å; A853-E857 PolarHBondContact O-N 3.21Å
854	D	77.2	Confident	77.4	Confident	69 Å²	69	39.9 Å²	39.9	37%	0.369	21%	0.21	S	C	.	.	H	α-helix	trans	-62.6	-36.7	178.2	-59.4	-43.5	0	0	0	111.9	F850 T851 T858	F850-D854 HydrophobicContact CB-CB 4.19Å; T851-D854 PolarHBondContact N-OD2 3.27Å; T851-D854 PolarHBondContact O-N 2.76Å; T851-D854 PolarHBondContact OG1-N 2.82Å; T851-D854 PolarHBondContact OG1-OD2 3.33Å; D854-T858 WeakPolarHBondContact O-CB 3.5Å; D854-T858 PolarHBondContact O-N 3.42Å; D854-T858 PolarHBondContact O-OG1 3.21Å
855	V	78.1	Confident	77.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.9	-39.3	179	172.6	0	0	0	0	111.3	L741 V804 C847 F850 T851 M852 A853 T858 I859	L741-V855 HydrophobicContact CD1-CG1 4.01Å; L741-V855 HydrophobicContact CD2-CG1 4.12Å; V804-V855 HydrophobicContact CB-CG2 4.17Å; V804-V855 HydrophobicContact CG2-CB 4.1Å; V804-V855 HydrophobicContact CG2-CG1 4.3Å; V804-V855 HydrophobicContact CG2-CG2 3.69Å; C847-V855 HydrophobicContact CB-CG1 3.99Å; C847-V855 HydrophobicContact CB-CG2 4.03Å; C847-V855 VanDerWaalsContact O-CG2 3.29Å; C847-V855 WeakPolarHBondContact O-CG2 3.48Å; F850-V855 HydrophobicContact CB-CG2 3.85Å; T851-V855 WeakPolarHBondContact O-CG2 3.44Å; T851-V855 PolarHBondContact O-N 3.23Å; M852-V855 PolarHBondContact O-N 3.11Å; A853-V855 VanDerWaalsContact C-N 3.28Å; A853-V855 PolarHBondContact O-N 3.38Å; V855-T858 WeakPolarHBondContact O-CB 3.28Å; V855-T858 PolarHBondContact O-N 2.93Å; V855-I859 HydrophobicContact CG1-CD1 3.73Å; V855-I859 HydrophobicContact CG1-CG1 4.22Å; V855-I859 WeakPolarHBondContact O-CB 3.45Å; V855-I859 VanDerWaalsContact O-CG1 3.24Å; V855-I859 WeakPolarHBondContact O-CG1 3.3Å; V855-I859 PolarHBondContact O-N 3.49Å
856	I	77.7	Confident	77.2	Confident	28 Å²	28	29.3 Å²	29.3	14%	0.144	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-49	175.1	-71.3	162.5	0	0	0	110.4	P713 I716 M852 A853 T858 I859 E860	P713-I856 HydrophobicContact CG-CG2 3.89Å; I716-I856 HydrophobicContact CD1-CD1 3.62Å; I716-I856 HydrophobicContact CD1-CG1 4.38Å; M852-I856 HydrophobicContact CE-CD1 4.5Å; M852-I856 HydrophobicContact CG-CD1 4.09Å; M852-I856 WeakPolarHBondContact O-CD1 2.88Å; M852-I856 VanDerWaalsContact O-CG1 3.24Å; M852-I856 WeakPolarHBondContact O-CG1 3.24Å; M852-I856 PolarHBondContact O-N 3.18Å; A853-I856 PolarHBondContact O-N 3.13Å; I856-T858 VanDerWaalsContact C-N 3.25Å; I856-T858 PolarHBondContact O-N 3.33Å; I856-I859 PolarHBondContact O-N 3.19Å; I856-I859 VanDerWaalsContact O-N 3.16Å; I856-E860 WeakPolarHBondContact O-CG 3.4Å; I856-E860 PolarHBondContact O-N 2.99Å
857	E	74	Confident	77.1	Confident	112 Å²	112	27.3 Å²	27.3	52%	0.523	15%	0.152	S	C	.	.	H	α-helix	trans	-59.4	-38.5	176.9	-174.4	179.9	-177.7	0	0	111.8	A853 T861	A853-E857 PolarHBondContact O-N 3.21Å; E857-T861 PolarHBondContact O-N 3.43Å; E857-T861 VanDerWaalsContact O-N 3.16Å; E857-T861 PolarHBondContact O-OG1 2.86Å
858	T	76.3	Confident	76.9	Confident	12 Å²	12	28.2 Å²	28.2	7%	0.074	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-43.7	176.6	-61.3	0	0	0	0	111.9	R846 D854 V855 I856 T861 I862	R846-T858 HydrophobicContact CB-CG2 3.99Å; D854-T858 WeakPolarHBondContact O-CB 3.5Å; D854-T858 PolarHBondContact O-N 3.42Å; D854-T858 PolarHBondContact O-OG1 3.21Å; V855-T858 WeakPolarHBondContact O-CB 3.28Å; V855-T858 PolarHBondContact O-N 2.93Å; I856-T858 VanDerWaalsContact C-N 3.25Å; I856-T858 PolarHBondContact O-N 3.33Å; T858-T861 PolarHBondContact O-N 2.93Å; T858-I862 HydrophobicContact CG2-CD1 3.87Å; T858-I862 VanDerWaalsContact O-CG1 3.28Å; T858-I862 WeakPolarHBondContact O-CG1 3.4Å; T858-I862 PolarHBondContact O-N 3.17Å
859	I	78.9	Confident	76.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-44.4	177.4	-73.9	170.2	0	0	0	110.5	F739 L741 V855 I856 T861 I862 I863	F739-I859 HydrophobicContact CB-CD1 4.13Å; F739-I859 HydrophobicContact CD1-CD1 3.93Å; F739-I859 HydrophobicContact CD1-CG1 4.12Å; F739-I859 HydrophobicContact CD2-CG2 3.94Å; F739-I859 HydrophobicContact CE1-CG1 4.23Å; F739-I859 HydrophobicContact CE1-CG2 4.37Å; F739-I859 HydrophobicContact CE2-CG2 3.79Å; F739-I859 HydrophobicContact CG-CD1 3.93Å; F739-I859 HydrophobicContact CG-CG1 4.45Å; F739-I859 HydrophobicContact CG-CG2 4.35Å; F739-I859 HydrophobicContact CZ-CG2 4.01Å; L741-I859 HydrophobicContact CD1-CD1 4.33Å; L741-I859 HydrophobicContact CD2-CD1 4.33Å; V855-I859 HydrophobicContact CG1-CD1 3.73Å; V855-I859 HydrophobicContact CG1-CG1 4.22Å; V855-I859 WeakPolarHBondContact O-CB 3.45Å; V855-I859 VanDerWaalsContact O-CG1 3.24Å; V855-I859 WeakPolarHBondContact O-CG1 3.3Å; V855-I859 PolarHBondContact O-N 3.49Å; I856-I859 PolarHBondContact O-N 3.19Å; I856-I859 VanDerWaalsContact O-N 3.16Å; I859-T861 VanDerWaalsContact C-N 3.3Å; I859-T861 PolarHBondContact O-N 3.32Å; I859-I862 PolarHBondContact O-N 2.79Å; I859-I863 HydrophobicContact CG2-CD1 3.46Å; I859-I863 VanDerWaalsContact CG2-CD1 3.46Å; I859-I863 HydrophobicContact CG2-CG1 4.41Å; I859-I863 WeakPolarHBondContact O-CD1 3.4Å; I859-I863 VanDerWaalsContact O-CG1 3.29Å; I859-I863 WeakPolarHBondContact O-CG1 3.5Å; I859-I863 PolarHBondContact O-N 3.26Å; I859-I863 VanDerWaalsContact O-N 3.11Å
860	E	72.6	Confident	77	Confident	28 Å²	28	23.3 Å²	23.3	13%	0.131	12%	0.123	C	C	.	.	H	α-helix	trans	-54.5	-49.4	175.6	-73.2	178.4	176.1	0	0	111	S712 P713 I856 I862 I863 V864	S712-E860 WeakPolarHBondContact CA-OE1 3.19Å; S712-E860 PolarHBondContact OG-OE1 3.4Å; P713-E860 WeakPolarHBondContact CD-OE1 3.41Å; I856-E860 WeakPolarHBondContact O-CG 3.4Å; I856-E860 PolarHBondContact O-N 2.99Å; E860-I862 VanDerWaalsContact C-N 3.32Å; E860-I862 PolarHBondContact O-N 2.91Å; E860-I863 PolarHBondContact O-N 3.17Å; E860-V864 WeakPolarHBondContact O-CG2 3.41Å; E860-V864 PolarHBondContact O-N 2.68Å
861	T	72.4	Confident	76.7	Confident	25 Å²	25	20.2 Å²	20.2	15%	0.153	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-40.8	179.4	-57.8	0	0	0	0	112.4	E857 T858 I859 I863 Y953	E857-T861 PolarHBondContact O-N 3.43Å; E857-T861 VanDerWaalsContact O-N 3.16Å; E857-T861 PolarHBondContact O-OG1 2.86Å; T858-T861 PolarHBondContact O-N 2.93Å; I859-T861 VanDerWaalsContact C-N 3.3Å; I859-T861 PolarHBondContact O-N 3.32Å; T861-I863 VanDerWaalsContact C-N 3.32Å; T861-I863 PolarHBondContact O-N 2.76Å; T861-Y953 HydrophobicContact CG2-CE1 4.37Å
862	I	76.6	Confident	76.7	Confident	2 Å²	2	19 Å²	19	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-65.5	-34.7	-179.7	-74.8	169.2	0	0	0	111.6	F831 L843 T858 I859 E860 L954	F831-I862 HydrophobicContact CZ-CG2 3.7Å; L843-I862 HydrophobicContact CD1-CD1 3.87Å; T858-I862 HydrophobicContact CG2-CD1 3.87Å; T858-I862 VanDerWaalsContact O-CG1 3.28Å; T858-I862 WeakPolarHBondContact O-CG1 3.4Å; T858-I862 PolarHBondContact O-N 3.17Å; I859-I862 PolarHBondContact O-N 2.79Å; E860-I862 VanDerWaalsContact C-N 3.32Å; E860-I862 PolarHBondContact O-N 2.91Å; I862-L954 HydrophobicContact CD1-CD2 4.2Å; I862-L954 HydrophobicContact CG1-CB 4.13Å; I862-L954 HydrophobicContact CG2-CB 4.28Å
863	I	75.6	Confident	76.9	Confident	4 Å²	4	18.7 Å²	18.7	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-86.9	-23.9	-171.9	-66.6	166.3	0	0	0	113	T732 M737 F739 F831 I859 E860 T861 F866 M867	T732-I863 HydrophobicContact CG2-CD1 3.64Å; M737-I863 HydrophobicContact SD-CD1 4.46Å; M737-I863 HydrophobicContact SD-CG1 4.31Å; F739-I863 HydrophobicContact CE2-CD1 3.55Å; F739-I863 HydrophobicContact CE2-CG1 4.28Å; F739-I863 HydrophobicContact CZ-CD1 3.95Å; F739-I863 HydrophobicContact CZ-CG1 4.23Å; F831-I863 HydrophobicContact CE1-CG1 4.39Å; I859-I863 HydrophobicContact CG2-CD1 3.46Å; I859-I863 VanDerWaalsContact CG2-CD1 3.46Å; I859-I863 HydrophobicContact CG2-CG1 4.41Å; I859-I863 WeakPolarHBondContact O-CD1 3.4Å; I859-I863 VanDerWaalsContact O-CG1 3.29Å; I859-I863 WeakPolarHBondContact O-CG1 3.5Å; I859-I863 PolarHBondContact O-N 3.26Å; I859-I863 VanDerWaalsContact O-N 3.11Å; E860-I863 PolarHBondContact O-N 3.17Å; T861-I863 VanDerWaalsContact C-N 3.32Å; T861-I863 PolarHBondContact O-N 2.76Å; I863-F866 WeakPolarHBondContact O-CB 3.27Å; I863-F866 PolarHBondContact O-N 3.27Å; I863-M867 HydrophobicContact CG2-CG 3.39Å; I863-M867 HydrophobicContact CG2-SD 3.96Å; I863-M867 WeakPolarHBondContact O-CG 3.19Å; I863-M867 PolarHBondContact O-N 2.98Å; I863-M867 VanDerWaalsContact O-N 3.13Å
864	V	74.5	Confident	77.2	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.018	10%	0.103	C	C	.	.	H	α-helix	trans	-47.4	-51.6	-174.6	-179.6	0	0	0	0	114.1	F711 E860 F866 M867 V868 Y984	F711-V864 HydrophobicContact CD2-CG1 4.14Å; F711-V864 HydrophobicContact CD2-CG2 4.19Å; F711-V864 HydrophobicContact CE2-CG1 4.23Å; E860-V864 WeakPolarHBondContact O-CG2 3.41Å; E860-V864 PolarHBondContact O-N 2.68Å; V864-F866 PolarHBondContact O-N 3.43Å; V864-M867 PolarHBondContact O-N 2.87Å; V864-M867 VanDerWaalsContact O-N 3.12Å; V864-V868 HydrophobicContact CG1-CG2 4.35Å; V864-V868 WeakPolarHBondContact O-CG2 3.45Å; V864-V868 PolarHBondContact O-N 3Å; V864-V868 VanDerWaalsContact O-N 3.07Å; V864-Y984 HydrophobicContact CG1-CE1 3.78Å
865	P	73.2	Confident	77.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-35.1	-176.8	-22.4	34.7	0	0	0	113.1	L869 Y953 T955 L982 Y984	P865-L869 PolarHBondContact O-N 3.22Å; P865-L869 VanDerWaalsContact O-N 3.17Å; P865-Y953 HydrophobicContact CG-CD1 3.58Å; P865-Y953 HydrophobicContact CG-CE1 3.99Å; P865-Y953 HydrophobicContact CG-CG 3.96Å; P865-T955 HydrophobicContact CB-CG2 4.05Å; P865-T955 HydrophobicContact CG-CG2 4.08Å; P865-L982 HydrophobicContact CB-CB 4.28Å; P865-Y984 HydrophobicContact CB-CD1 4.48Å
866	F	77.1	Confident	77.4	Confident	8 Å²	8	18.1 Å²	18.1	4%	0.035	9%	0.094	C	C	.	.	H	α-helix	trans	-71	-38.2	178.4	-60.2	-85.2	0	0	0	111.9	V827 F831 I863 V864 L869 A870 T955 P956 L982	V827-F866 HydrophobicContact CG1-CD1 4.21Å; F831-F866 HydrophobicContact CB-CD1 3.79Å; F831-F866 HydrophobicContact CB-CE1 3.73Å; F831-F866 HydrophobicContact CB-CZ 4.44Å; F831-F866 HydrophobicContact CD1-CD1 4.23Å; F831-F866 HydrophobicContact CD1-CD2 4.23Å; F831-F866 HydrophobicContact CD1-CE1 4.4Å; F831-F866 HydrophobicContact CD1-CE2 4.42Å; F831-F866 HydrophobicContact CD1-CG 4.15Å; F831-F866 AromaticContact CD2-CD1 3.79Å; F831-F866 HydrophobicContact CD2-CD1 3.79Å; F831-F866 HydrophobicContact CD2-CD2 4.02Å; F831-F866 AromaticContact CD2-CE1 3.15Å; F831-F866 HydrophobicContact CD2-CE1 3.15Å; F831-F866 AromaticContact CD2-CE2 3.44Å; F831-F866 HydrophobicContact CD2-CE2 3.44Å; F831-F866 VanDerWaalsContact CD2-CE2 3.44Å; F831-F866 HydrophobicContact CD2-CG 4.19Å; F831-F866 AromaticContact CD2-CZ 2.97Å; F831-F866 HydrophobicContact CD2-CZ 2.97Å; F831-F866 AromaticContact CE1-CD2 3.93Å; F831-F866 HydrophobicContact CE1-CD2 3.93Å; F831-F866 HydrophobicContact CE1-CE2 4.08Å; F831-F866 HydrophobicContact CE1-CG 4.29Å; F831-F866 HydrophobicContact CE2-CD1 4.36Å; F831-F866 AromaticContact CE2-CD2 3.74Å; F831-F866 HydrophobicContact CE2-CD2 3.74Å; F831-F866 AromaticContact CE2-CE1 3.74Å; F831-F866 HydrophobicContact CE2-CE1 3.74Å; F831-F866 AromaticContact CE2-CE2 3.03Å; F831-F866 HydrophobicContact CE2-CE2 3.03Å; F831-F866 HydrophobicContact CE2-CG 4.36Å; F831-F866 AromaticContact CE2-CZ 3.04Å; F831-F866 HydrophobicContact CE2-CZ 3.04Å; F831-F866 AromaticContact CG-CD1 3.67Å; F831-F866 HydrophobicContact CG-CD1 3.67Å; F831-F866 HydrophobicContact CG-CD2 4.21Å; F831-F866 AromaticContact CG-CE1 3.51Å; F831-F866 HydrophobicContact CG-CE1 3.51Å; F831-F866 HydrophobicContact CG-CE2 4.1Å; F831-F866 HydrophobicContact CG-CG 4.03Å; F831-F866 AromaticContact CG-CZ 3.76Å; F831-F866 HydrophobicContact CG-CZ 3.76Å; F831-F866 AromaticContact CZ-CD2 3.63Å; F831-F866 HydrophobicContact CZ-CD2 3.63Å; F831-F866 HydrophobicContact CZ-CE1 4.5Å; F831-F866 AromaticContact CZ-CE2 3.34Å; F831-F866 HydrophobicContact CZ-CE2 3.34Å; F831-F866 HydrophobicContact CZ-CG 4.35Å; F831-F866 AromaticContact CZ-CZ 3.84Å; F831-F866 HydrophobicContact CZ-CZ 3.84Å; I863-F866 WeakPolarHBondContact O-CB 3.27Å; I863-F866 PolarHBondContact O-N 3.27Å; V864-F866 PolarHBondContact O-N 3.43Å; F866-L869 PolarHBondContact O-N 3.02Å; F866-A870 WeakPolarHBondContact O-CB 3.29Å; F866-A870 PolarHBondContact O-N 2.84Å; F866-T955 HydrophobicContact CE2-CG2 3.9Å; F866-T955 HydrophobicContact CZ-CG2 3.92Å; F866-P956 HydrophobicContact CE1-CG 4.38Å; F866-P956 HydrophobicContact CZ-CG 4.47Å; F866-L982 HydrophobicContact CD1-CD1 3.85Å; F866-L982 HydrophobicContact CE1-CD1 3.3Å; F866-L982 HydrophobicContact CZ-CD1 3.8Å
867	M	77.1	Confident	77.5	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.015	10%	0.104	C	C	.	.	H	α-helix	trans	-67.8	-38.7	178.4	-63.6	-68.4	-84.2	0	0	111.6	F711 L733 F734 I863 V864 A870 S871	F711-M867 HydrophobicContact CD1-CB 3.43Å; F711-M867 VanDerWaalsContact CD1-CB 3.43Å; F711-M867 HydrophobicContact CD1-CE 3.75Å; F711-M867 HydrophobicContact CD1-CG 3.75Å; F711-M867 HydrophobicContact CE1-CB 3.45Å; F711-M867 VanDerWaalsContact CE1-CB 3.45Å; F711-M867 HydrophobicContact CE1-CE 4.39Å; F711-M867 HydrophobicContact CE1-CG 4.28Å; F711-M867 HydrophobicContact CG-CB 4.18Å; F711-M867 HydrophobicContact CG-CG 4.34Å; F711-M867 HydrophobicContact CZ-CB 4.21Å; L733-M867 HydrophobicContact CB-CE 4.25Å; F734-M867 HydrophobicContact CD2-CE 3.18Å; F734-M867 HydrophobicContact CD2-SD 3.61Å; F734-M867 HydrophobicContact CE2-CE 3.23Å; F734-M867 HydrophobicContact CE2-SD 3.96Å; F734-M867 HydrophobicContact CG-CE 4.28Å; F734-M867 HydrophobicContact CZ-CE 4.36Å; I863-M867 HydrophobicContact CG2-CG 3.39Å; I863-M867 HydrophobicContact CG2-SD 3.96Å; I863-M867 WeakPolarHBondContact O-CG 3.19Å; I863-M867 PolarHBondContact O-N 2.98Å; I863-M867 VanDerWaalsContact O-N 3.13Å; V864-M867 PolarHBondContact O-N 2.87Å; V864-M867 VanDerWaalsContact O-N 3.12Å; M867-A870 PolarHBondContact O-N 3.37Å; M867-S871 WeakPolarHBondContact O-CB 3.32Å; M867-S871 PolarHBondContact O-N 3.41Å
868	V	78.4	Confident	77.6	Confident	19 Å²	19	20 Å²	20	12%	0.115	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-50	173.6	175.8	0	0	0	0	110.1	V864 S871 D872 Y984 C1017	V864-V868 HydrophobicContact CG1-CG2 4.35Å; V864-V868 WeakPolarHBondContact O-CG2 3.45Å; V864-V868 PolarHBondContact O-N 3Å; V864-V868 VanDerWaalsContact O-N 3.07Å; V868-S871 PolarHBondContact O-N 3.02Å; V868-S871 PolarHBondContact O-OG 3.34Å; V868-D872 PolarHBondContact O-N 3.42Å; V868-Y984 HydrophobicContact CG2-CD1 4.43Å; V868-C1017 HydrophobicContact CG1-CB 4.09Å
869	L	80.5	Confident	77.5	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-46.7	177.2	176.7	62.6	0	0	0	112.5	V827 P865 F866 S871 D872 L873 F885 I962 L982 L1020	V827-L869 HydrophobicContact CG1-CD2 4.26Å; V827-L869 HydrophobicContact CG2-CD2 3.87Å; V827-L869 HydrophobicContact CG2-CG 4.25Å; P865-L869 PolarHBondContact O-N 3.22Å; P865-L869 VanDerWaalsContact O-N 3.17Å; F866-L869 PolarHBondContact O-N 3.02Å; L869-S871 PolarHBondContact O-N 3.32Å; L869-D872 WeakPolarHBondContact O-CB 3.48Å; L869-D872 PolarHBondContact O-N 3.28Å; L869-D872 VanDerWaalsContact O-N 3.14Å; L869-L873 HydrophobicContact CD1-CD1 4.3Å; L869-L873 HydrophobicContact CD1-CD2 4.41Å; L869-L873 HydrophobicContact CD1-CG 4.1Å; L869-L873 HydrophobicContact CG-CD1 4.15Å; L869-L873 HydrophobicContact CG-CG 4.35Å; L869-L873 WeakPolarHBondContact O-CG 3.35Å; L869-L873 PolarHBondContact O-N 3.16Å; L869-F885 HydrophobicContact CD2-CD2 4.17Å; L869-F885 HydrophobicContact CD2-CE2 3.69Å; L869-F885 HydrophobicContact CD2-CZ 4.35Å; L869-I962 HydrophobicContact CD1-CD1 3.64Å; L869-L982 HydrophobicContact CD2-CD2 3.58Å; L869-L1020 HydrophobicContact CD1-CD1 4.04Å
870	A	81.4	Confident	77.5	Confident	4 Å²	4	30.4 Å²	30.4	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-38.5	178.3	0	0	0	0	0	111.4	V824 F866 M867 R874	V824-A870 HydrophobicContact CG1-CB 3.93Å; V824-A870 HydrophobicContact CG2-CB 4.4Å; V824-A870 WeakPolarHBondContact CG2-O 3.36Å; F866-A870 WeakPolarHBondContact O-CB 3.29Å; F866-A870 PolarHBondContact O-N 2.84Å; M867-A870 PolarHBondContact O-N 3.37Å; A870-R874 WeakPolarHBondContact O-CB 3.4Å; A870-R874 PolarHBondContact O-N 3.37Å
871	S	77.3	Confident	77.9	Confident	32 Å²	32	30.1 Å²	30.1	22%	0.224	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-43.5	176.7	78.5	0	0	0	0	112.4	M867 V868 L869 R874 C875	M867-S871 WeakPolarHBondContact O-CB 3.32Å; M867-S871 PolarHBondContact O-N 3.41Å; V868-S871 PolarHBondContact O-N 3.02Å; V868-S871 PolarHBondContact O-OG 3.34Å; L869-S871 PolarHBondContact O-N 3.32Å; S871-R874 PolarHBondContact O-N 3.16Å; S871-C875 WeakPolarHBondContact O-CB 3.43Å; S871-C875 PolarHBondContact O-N 3.03Å; S871-C875 PolarHBondContact O-SG 2.91Å
872	D	79.1	Confident	78.4	Confident	10 Å²	10	32 Å²	32	5%	0.053	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-48.8	176.5	-96.7	-7.4	0	0	0	111.5	V868 L869 R874 C875 L876 G1018 N1019 L1020	V868-D872 PolarHBondContact O-N 3.42Å; L869-D872 WeakPolarHBondContact O-CB 3.48Å; L869-D872 PolarHBondContact O-N 3.28Å; L869-D872 VanDerWaalsContact O-N 3.14Å; D872-R874 VanDerWaalsContact C-N 3.33Å; D872-R874 PolarHBondContact O-N 2.95Å; D872-C875 PolarHBondContact O-N 2.74Å; D872-L876 WeakPolarHBondContact O-CG 3.36Å; D872-L876 PolarHBondContact O-N 3.14Å; D872-G1018 VanDerWaalsContact OD2-C 3.26Å; D872-G1018 WeakPolarHBondContact OD2-CA 3.24Å; D872-G1018 PolarHBondContact OD2-N 2.89Å; D872-N1019 PolarHBondContact OD2-N 2.94Å; D872-N1019 VanDerWaalsContact OD2-N 3.13Å; D872-L1020 HydrophobicContact CB-CB 4.28Å; D872-L1020 HydrophobicContact CB-CD1 4.43Å; D872-L1020 WeakPolarHBondContact OD2-CB 3.41Å; D872-L1020 PolarHBondContact OD2-N 2.74Å; D872-L1020 VanDerWaalsContact OD2-N 3.07Å
873	L	82.9	Confident	78.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-40.9	179.7	-63.3	-179.8	0	0	0	111.5	P823 V824 V827 L869 L876 W877 V883 F885 I962	P823-L873 HydrophobicContact CB-CB 4.08Å; P823-L873 HydrophobicContact CB-CD1 4.24Å; V824-L873 HydrophobicContact CG2-CB 4.45Å; V827-L873 HydrophobicContact CG2-CD1 3.35Å; L869-L873 HydrophobicContact CD1-CD1 4.3Å; L869-L873 HydrophobicContact CD1-CD2 4.41Å; L869-L873 HydrophobicContact CD1-CG 4.1Å; L869-L873 HydrophobicContact CG-CD1 4.15Å; L869-L873 HydrophobicContact CG-CG 4.35Å; L869-L873 WeakPolarHBondContact O-CG 3.35Å; L869-L873 PolarHBondContact O-N 3.16Å; L873-L876 PolarHBondContact O-N 3.35Å; L873-W877 WeakPolarHBondContact O-CB 3.29Å; L873-W877 PolarHBondContact O-N 2.82Å; L873-V883 HydrophobicContact CD2-CG1 3.68Å; L873-F885 HydrophobicContact CD1-CB 4Å; L873-F885 HydrophobicContact CD1-CD2 4.37Å; L873-F885 HydrophobicContact CD1-CG 4.31Å; L873-I962 HydrophobicContact CD2-CG1 4.37Å; L873-I962 HydrophobicContact CD2-CG2 3.61Å
874	R	80.8	Confident	79.4	Confident	64 Å²	64	36.2 Å²	36.2	24%	0.242	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-42.3	175	-170.1	177.5	179.7	-146.9	1.2	111.2	V824 A870 S871 D872 W877 L878	V824-R874 HydrophobicContact CG2-CB 3.94Å; A870-R874 WeakPolarHBondContact O-CB 3.4Å; A870-R874 PolarHBondContact O-N 3.37Å; S871-R874 PolarHBondContact O-N 3.16Å; D872-R874 VanDerWaalsContact C-N 3.33Å; D872-R874 PolarHBondContact O-N 2.95Å; R874-W877 PolarHBondContact O-N 3.49Å; R874-L878 HydrophobicContact CG-CD1 4.05Å; R874-L878 HydrophobicContact CG-CG 4.31Å; R874-L878 WeakPolarHBondContact O-CB 3.27Å; R874-L878 VanDerWaalsContact O-CG 3.26Å; R874-L878 WeakPolarHBondContact O-CG 2.95Å; R874-L878 PolarHBondContact O-N 2.89Å
875	C	79.6	Confident	79.9	Confident	26 Å²	26	37 Å²	37	18%	0.176	19%	0.185	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176.7	-69.9	0	0	0	0	111.5	S871 D872 L878 A879 Y1021	S871-C875 WeakPolarHBondContact O-CB 3.43Å; S871-C875 PolarHBondContact O-N 3.03Å; S871-C875 PolarHBondContact O-SG 2.91Å; D872-C875 PolarHBondContact O-N 2.74Å; C875-L878 PolarHBondContact O-N 3.45Å; C875-A879 VanDerWaalsContact O-CB 3.31Å; C875-A879 WeakPolarHBondContact O-CB 3.39Å; C875-A879 PolarHBondContact O-N 3.26Å; C875-Y1021 HydrophobicContact CB-CD1 4.41Å; C875-Y1021 HydrophobicContact CB-CD2 3.66Å; C875-Y1021 HydrophobicContact CB-CE2 4.18Å; C875-Y1021 HydrophobicContact CB-CG 3.79Å
876	L	79.6	Confident	80.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-43.4	175.9	-71.1	166.7	0	0	0	111.8	D872 L873 A879 K880 Y881 V883 V964 L1020 Y1021 I1024	D872-L876 WeakPolarHBondContact O-CG 3.36Å; D872-L876 PolarHBondContact O-N 3.14Å; L873-L876 PolarHBondContact O-N 3.35Å; L876-A879 PolarHBondContact O-N 3.5Å; L876-K880 PolarHBondContact O-N 3.24Å; L876-Y881 HydrophobicContact CB-CD2 4.18Å; L876-Y881 HydrophobicContact CD2-CD2 3.68Å; L876-Y881 HydrophobicContact CD2-CE2 4.08Å; L876-Y881 WeakPolarHBondContact O-CB 3.47Å; L876-Y881 WeakPolarHBondContact O-CD2 3.34Å; L876-Y881 PolarHBondContact O-N 3.23Å; L876-V883 HydrophobicContact CB-CG2 3.49Å; L876-V883 VanDerWaalsContact CB-CG2 3.49Å; L876-V883 HydrophobicContact CD1-CG2 4.37Å; L876-V964 HydrophobicContact CD1-CG2 3.88Å; L876-V964 HydrophobicContact CD2-CG1 4.33Å; L876-L1020 HydrophobicContact CD1-CB 4.33Å; L876-Y1021 HydrophobicContact CD2-CD2 4.06Å; L876-Y1021 HydrophobicContact CG-CD2 4.27Å; L876-I1024 HydrophobicContact CD2-CB 3.69Å; L876-I1024 HydrophobicContact CD2-CG1 3.84Å; L876-I1024 HydrophobicContact CD2-CG2 3.85Å
877	W	79.3	Confident	80	Confident	94 Å²	94	43 Å²	43	36%	0.356	22%	0.222	S	C	.	.	H	α-helix	trans	-65.9	-44	177.9	-177	83.6	0	0	0	112.3	E820 C821 L873 R874 A879 K880	E820-W877 WeakPolarHBondContact O-CH2 3.45Å; E820-W877 VanDerWaalsContact O-CZ2 3.24Å; E820-W877 WeakPolarHBondContact O-CZ2 3.29Å; E820-W877 VanDerWaalsContact O-CZ3 3.32Å; E820-W877 WeakPolarHBondContact O-CZ3 3.41Å; C821-W877 HydrophobicContact CB-CD2 4.37Å; C821-W877 HydrophobicContact CB-CE3 4.24Å; C821-W877 VanDerWaalsContact SG-CG 3.54Å; L873-W877 WeakPolarHBondContact O-CB 3.29Å; L873-W877 PolarHBondContact O-N 2.82Å; R874-W877 PolarHBondContact O-N 3.49Å; W877-A879 VanDerWaalsContact C-N 3.28Å; W877-A879 PolarHBondContact O-N 3.49Å; W877-K880 WeakPolarHBondContact O-CA 3.48Å; W877-K880 PolarHBondContact O-N 2.79Å
878	L	75.7	Confident	79.2	Confident	85 Å²	85	44.4 Å²	44.4	45%	0.445	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-33.5	174.6	-74.4	174.6	0	0	0	112.4	R874 C875 K880	R874-L878 HydrophobicContact CG-CD1 4.05Å; R874-L878 HydrophobicContact CG-CG 4.31Å; R874-L878 WeakPolarHBondContact O-CB 3.27Å; R874-L878 VanDerWaalsContact O-CG 3.26Å; R874-L878 WeakPolarHBondContact O-CG 2.95Å; R874-L878 PolarHBondContact O-N 2.89Å; C875-L878 PolarHBondContact O-N 3.45Å; L878-K880 PolarHBondContact O-N 3.41Å; L878-K880 VanDerWaalsContact O-N 3.13Å
879	A	75.5	Confident	77.9	Confident	38 Å²	38	46.5 Å²	46.5	31%	0.314	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	5.6	170.8	0	0	0	0	0	113.6	C875 L876 W877 Y881 Y1021	C875-A879 VanDerWaalsContact O-CB 3.31Å; C875-A879 WeakPolarHBondContact O-CB 3.39Å; C875-A879 PolarHBondContact O-N 3.26Å; L876-A879 PolarHBondContact O-N 3.5Å; W877-A879 VanDerWaalsContact C-N 3.28Å; W877-A879 PolarHBondContact O-N 3.49Å; A879-Y881 VanDerWaalsContact C-N 3.29Å; A879-Y881 HydrophobicContact CB-CD2 3.72Å; A879-Y881 HydrophobicContact CB-CE2 3.46Å; A879-Y881 VanDerWaalsContact CB-CE2 3.46Å; A879-Y881 PolarHBondContact O-N 3.33Å; A879-Y1021 HydrophobicContact CB-CE2 3.92Å
880	K	77.9	Confident	76.3	Confident	194 Å²	194	51.2 Å²	51.2	84%	0.843	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	24.9	179.2	-52.9	-177.7	177.4	-178.6	0	114	L876 W877 L878	L876-K880 PolarHBondContact O-N 3.24Å; W877-K880 WeakPolarHBondContact O-CA 3.48Å; W877-K880 PolarHBondContact O-N 2.79Å; L878-K880 PolarHBondContact O-N 3.41Å; L878-K880 VanDerWaalsContact O-N 3.13Å
881	Y	80.8	Confident	74.4	Confident	22 Å²	22	56.1 Å²	56.1	9%	0.086	30%	0.296	C	S	.	.			trans	-77.6	144.2	165.9	-54.3	-61.1	0	0	0	109.9	L876 A879 V883 V964 V966 I1024 Q1028	L876-Y881 HydrophobicContact CB-CD2 4.18Å; L876-Y881 HydrophobicContact CD2-CD2 3.68Å; L876-Y881 HydrophobicContact CD2-CE2 4.08Å; L876-Y881 WeakPolarHBondContact O-CB 3.47Å; L876-Y881 WeakPolarHBondContact O-CD2 3.34Å; L876-Y881 PolarHBondContact O-N 3.23Å; A879-Y881 VanDerWaalsContact C-N 3.29Å; A879-Y881 HydrophobicContact CB-CD2 3.72Å; A879-Y881 HydrophobicContact CB-CE2 3.46Å; A879-Y881 VanDerWaalsContact CB-CE2 3.46Å; A879-Y881 PolarHBondContact O-N 3.33Å; Y881-V883 PolarHBondContact O-N 2.9Å; Y881-V964 HydrophobicContact CG-CG1 4.24Å; Y881-V966 HydrophobicContact CD1-CB 4.45Å; Y881-V966 HydrophobicContact CD1-CG1 4.37Å; Y881-V966 HydrophobicContact CD1-CG2 4Å; Y881-V966 HydrophobicContact CE1-CG1 4.05Å; Y881-V966 HydrophobicContact CE1-CG2 4.13Å; Y881-I1024 HydrophobicContact CD1-CG2 4.37Å; Y881-I1024 HydrophobicContact CD2-CG2 3.98Å; Y881-I1024 HydrophobicContact CE1-CG2 4.06Å; Y881-I1024 HydrophobicContact CE2-CG2 3.62Å; Y881-I1024 HydrophobicContact CG-CG2 4.35Å; Y881-Q1028 PolarHBondContact OH-OE1 3.07Å
882	D	84.1	Confident	72.5	Confident	64 Å²	64	59.8 Å²	59.8	34%	0.342	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	106.2	171.7	170.6	18.4	0	0	0	107.4	R965	D882-R965 HydrophobicContact CB-CB 4.07Å; D882-R965 PolarHBondContact N-O 2.82Å; D882-R965 PolarHBondContact O-N 2.8Å; D882-R965 WeakPolarHBondContact OD2-CD 3.23Å; D882-R965 IonicContact OD2-CZ 3.36Å; D882-R965 IonicContact OD2-NE 3.61Å; D882-R965 IonicContact OD2-NH1 3.51Å; D882-R965 PolarHBondContact OD2-NH1 3.41Å
883	V	86.1	Confident	70.6	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.03	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.5	-171.3	-176.6	0	0	0	0	108.6	P823 L873 L876 Y881 I962 T963 V964	P823-V883 HydrophobicContact CB-CG1 4.27Å; P823-V883 HydrophobicContact CG-CB 4.02Å; P823-V883 HydrophobicContact CG-CG1 4.3Å; P823-V883 WeakPolarHBondContact CG-O 3.5Å; L873-V883 HydrophobicContact CD2-CG1 3.68Å; L876-V883 HydrophobicContact CB-CG2 3.49Å; L876-V883 VanDerWaalsContact CB-CG2 3.49Å; L876-V883 HydrophobicContact CD1-CG2 4.37Å; Y881-V883 PolarHBondContact O-N 2.9Å; V883-I962 HydrophobicContact CG1-CG2 4.27Å; V883-T963 CarbonylContact C-O 3.55Å; V883-T963 VanDerWaalsContact CA-O 3.3Å; V883-T963 WeakPolarHBondContact CA-O 3.5Å; V883-V964 HydrophobicContact CG1-CG2 4.42Å; V883-V964 HydrophobicContact CG2-CG1 4.36Å; V883-V964 HydrophobicContact CG2-CG2 4.43Å
884	N	86.1	Confident	68.4	Low	90 Å²	90	67.3 Å²	67.3	48%	0.481	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.8	169.2	-60.3	-67.7	0	0	0	110.1	I962 T963	N884-I962 WeakPolarHBondContact O-CA 3.26Å; N884-T963 WeakPolarHBondContact CB-OG1 3.34Å; N884-T963 PolarHBondContact N-O 3.44Å; N884-T963 PolarHBondContact O-N 3.43Å; N884-T963 PolarHBondContact O-OG1 3.17Å
885	F	86.1	Confident	66.1	Low	20 Å²	20	73.3 Å²	73.3	9%	0.088	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135.9	174.5	169	-95.7	0	0	0	109.3	V827 T830 L869 L873 F960 I962	V827-F885 HydrophobicContact CB-CD1 4.38Å; V827-F885 HydrophobicContact CB-CE1 4.27Å; V827-F885 HydrophobicContact CG2-CB 4.35Å; V827-F885 HydrophobicContact CG2-CD1 3.61Å; V827-F885 HydrophobicContact CG2-CD2 3.9Å; V827-F885 HydrophobicContact CG2-CE1 3.76Å; V827-F885 HydrophobicContact CG2-CE2 4.04Å; V827-F885 HydrophobicContact CG2-CG 3.67Å; V827-F885 HydrophobicContact CG2-CZ 3.97Å; T830-F885 HydrophobicContact CG2-CE1 4.43Å; L869-F885 HydrophobicContact CD2-CD2 4.17Å; L869-F885 HydrophobicContact CD2-CE2 3.69Å; L869-F885 HydrophobicContact CD2-CZ 4.35Å; L873-F885 HydrophobicContact CD1-CB 4Å; L873-F885 HydrophobicContact CD1-CD2 4.37Å; L873-F885 HydrophobicContact CD1-CG 4.31Å; F885-F960 HydrophobicContact CE2-CB 4.05Å; F885-F960 AromaticContact CE2-CD1 3.88Å; F885-F960 HydrophobicContact CE2-CD1 3.88Å; F885-F960 HydrophobicContact CE2-CG 4.32Å; F885-F960 AromaticContact CZ-CD1 3.7Å; F885-F960 HydrophobicContact CZ-CD1 3.7Å; F885-F960 HydrophobicContact CZ-CE1 4.38Å; F885-I962 HydrophobicContact CD2-CG1 3.86Å
886	G	79.2	Confident	64.2	Low	31 Å²	31	77 Å²	77	32%	0.32	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	147.6	172.4	0	0	0	0	0	112	S961	G886-S961 PolarHBondContact N-O 2.94Å; G886-S961 PolarHBondContact O-N 3.14Å
887	M	71.5	Confident	61.8	Low	102 Å²	102	81.3 Å²	81.3	50%	0.502	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	122.1	169.4	-160.3	168.1	82	0	0	108.3	T830 P956 F960	T830-M887 HydrophobicContact CG2-CB 4.22Å; T830-M887 HydrophobicContact CG2-SD 3.82Å; M887-P956 HydrophobicContact SD-CB 4.12Å; M887-F960 HydrophobicContact CG-CD1 4.24Å; M887-F960 HydrophobicContact CG-CE1 4.16Å; M887-F960 HydrophobicContact SD-CE1 4.09Å
888	T	62	Low	59.5	Low	33 Å²	33	81.4 Å²	81.4	20%	0.202	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-84.1	128.3	176.6	41.1	0	0	0	0	109.3	I890 Q893 P959	T888-I890 PolarHBondContact O-N 3.26Å; T888-Q893 PolarHBondContact OG1-NE2 3.41Å; T888-P959 PolarHBondContact N-O 2.79Å; T888-P959 VanDerWaalsContact N-O 3.07Å; T888-P959 WeakPolarHBondContact OG1-CG 3.39Å; T888-P959 PolarHBondContact OG1-O 3.19Å
889	S	50.4	Low	57.3	Low	62 Å²	62	88.9 Å²	88.9	43%	0.434	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-60.6	138	165	-179.7	0	0	0	0	108.5	D891 D892	S889-D891 PolarHBondContact O-N 2.85Å; S889-D891 PolarHBondContact OG-N 3.44Å; S889-D892 PolarHBondContact O-N 3.37Å
890	I	47.3	Very low	55.3	Low	99 Å²	99	91.3 Å²	91.3	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-55.3	-25.6	175.2	-66.2	170.2	0	0	0	110.7	T888 D892 Q893 L894	T888-I890 PolarHBondContact O-N 3.26Å; I890-D892 VanDerWaalsContact C-N 3.34Å; I890-D892 PolarHBondContact O-N 3.33Å; I890-Q893 PolarHBondContact O-N 3.11Å; I890-L894 PolarHBondContact O-N 3.29Å
891	D	41.7	Very low	53.3	Low	107 Å²	107	85.9 Å²	85.9	57%	0.572	46%	0.461	S	S	*	.	H	α-helix	trans	-65.5	-30.8	176.4	-67.1	-31.1	0	0	0	113.6	S889 L894	S889-D891 PolarHBondContact O-N 2.85Å; S889-D891 PolarHBondContact OG-N 3.44Å; D891-L894 PolarHBondContact O-N 3.32Å
892	D	37.7	Very low	51.3	Low	110 Å²	110	89.8 Å²	89.8	59%	0.588	49%	0.489	S	S	*	.	H	α-helix	trans	-75.7	-28.2	179.4	-74.4	-26.2	0	0	0	112.2	S889 I890 T896	S889-D892 PolarHBondContact O-N 3.37Å; I890-D892 VanDerWaalsContact C-N 3.34Å; I890-D892 PolarHBondContact O-N 3.33Å; D892-T896 PolarHBondContact O-OG1 3.37Å
893	Q	38.9	Very low	49.2	Very low	59 Å²	59	95.5 Å²	95.5	28%	0.276	51%	0.511	S	S	.	.	H	α-helix	trans	-80.7	-22.4	175.3	-68.3	-166.9	6.6	0	0	113	T888 I890 F895 T896	T888-Q893 PolarHBondContact OG1-NE2 3.41Å; I890-Q893 PolarHBondContact O-N 3.11Å; Q893-F895 PolarHBondContact O-N 3.19Å; Q893-T896 PolarHBondContact O-N 2.98Å
894	L	35	Very low	47.1	Very low	108 Å²	108	101.6 Å²	101.6	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-24.1	173.2	-81	169	0	0	0	112.5	I890 D891	I890-L894 PolarHBondContact O-N 3.29Å; D891-L894 PolarHBondContact O-N 3.32Å
895	F	33.9	Very low	44.7	Very low	191 Å²	191	100.4 Å²	100.4	84%	0.838	53%	0.531	S	S	*	.	H	α-helix	trans	-95	-15.4	179.9	-88	-79.9	0	0	0	115.6	Q893	Q893-F895 PolarHBondContact O-N 3.19Å
896	T	38.3	Very low	42.3	Very low	104 Å²	104	109.1 Å²	109.1	64%	0.638	56%	0.563	S	S	*	*	S	Bend	trans	-134.2	96.6	-177.1	0.6	0	0	0	0	111.4	D892 Q893	D892-T896 PolarHBondContact O-OG1 3.37Å; Q893-T896 PolarHBondContact O-N 2.98Å
897	A	30.5	Very low	40.5	Very low	89 Å²	89	114.9 Å²	114.9	74%	0.736	58%	0.581	S	S	*	*	S	Bend	trans	68.2	81.9	161.7	0	0	0	0	0	116.7
898	C	30.6	Very low	39	Very low	96 Å²	96	114.5 Å²	114.5	65%	0.649	58%	0.581	S	S	*	*				169.5	132.2	112.4	-87.4	0	0	0	0	110	F900	C898-F900 VanDerWaalsContact O-CD2 3.26Å; C898-F900 WeakPolarHBondContact O-CD2 3.41Å; C898-F900 PolarHBondContact O-N 3.45Å
899	Y	30.6	Very low	37.8	Very low	242 Å²	242	117.9 Å²	117.9	95%	0.949	60%	0.596	S	S	*	*			trans	-56	90.8	176.8	-62.7	-90.6	0	0	0	112.1	T901	Y899-T901 PolarHBondContact O-N 3.45Å
900	F	32.5	Very low	36.7	Very low	89 Å²	89	117.4 Å²	117.4	39%	0.39	60%	0.602	S	S	.	*			trans	-75.3	111.1	168.1	-75.8	-80.5	0	0	0	109.2	C898 K904 L905 L908	C898-F900 VanDerWaalsContact O-CD2 3.26Å; C898-F900 WeakPolarHBondContact O-CD2 3.41Å; C898-F900 PolarHBondContact O-N 3.45Å; F900-K904 HydrophobicContact CD1-CB 4.04Å; F900-L905 HydrophobicContact CB-CD1 4.04Å; F900-L908 HydrophobicContact CD1-CD1 3.97Å; F900-L908 HydrophobicContact CE1-CD1 3.72Å; F900-L908 HydrophobicContact CZ-CD1 4.47Å
901	T	35.1	Very low	35.9	Very low	80 Å²	80	120.9 Å²	120.9	49%	0.491	62%	0.616	S	S	.	*			trans	-57.6	146.9	167.3	57.8	0	0	0	0	110.3	Y899 K903 K904 L905	Y899-T901 PolarHBondContact O-N 3.45Å; T901-K903 PolarHBondContact O-N 2.91Å; T901-K904 PolarHBondContact O-N 3.25Å; T901-L905 PolarHBondContact O-N 3.39Å
902	P	40.3	Very low	35.3	Very low	104 Å²	104	120.2 Å²	120.2	68%	0.675	62%	0.616	S	S	*	*	H	α-helix	trans	-53.4	-28.8	-177.9	-26.5	32.3	0	0	0	114.2	R906	P902-R906 VanDerWaalsContact O-CB 3.31Å; P902-R906 WeakPolarHBondContact O-CB 3.33Å; P902-R906 PolarHBondContact O-N 2.94Å
903	K	39.9	Very low	35.3	Very low	184 Å²	184	120.4 Å²	120.4	80%	0.8	62%	0.623	S	S	*	*	H	α-helix	trans	-66.5	-41.2	174.4	-81.7	-174	175.3	-178.3	0	112.9	T901 H907	T901-K903 PolarHBondContact O-N 2.91Å; K903-H907 PolarHBondContact O-N 3.03Å
904	K	40.8	Very low	34.8	Very low	134 Å²	134	128.3 Å²	128.3	58%	0.583	65%	0.65	S	S	*	*	H	α-helix	trans	-73.6	-37.3	175.6	-74.4	-171.5	175.3	-175.1	0	111.5	F900 T901 R906 H907 L908	F900-K904 HydrophobicContact CD1-CB 4.04Å; T901-K904 PolarHBondContact O-N 3.25Å; K904-R906 VanDerWaalsContact C-N 3.3Å; K904-R906 PolarHBondContact O-N 3.39Å; K904-H907 PolarHBondContact O-N 3.19Å; K904-H907 VanDerWaalsContact O-N 3.13Å; K904-L908 WeakPolarHBondContact O-CD1 3.34Å; K904-L908 PolarHBondContact O-N 3.47Å
905	L	36.7	Very low	34.4	Very low	65 Å²	65	128.8 Å²	128.8	34%	0.34	66%	0.662	S	S	.	*	H	α-helix	trans	-62.6	-37.8	173.6	-155.1	93.2	0	0	0	111.6	F900 T901 H907 L908 I909	F900-L905 HydrophobicContact CB-CD1 4.04Å; T901-L905 PolarHBondContact O-N 3.39Å; L905-H907 VanDerWaalsContact C-N 3.31Å; L905-H907 PolarHBondContact O-N 3.04Å; L905-L908 PolarHBondContact O-N 3.41Å; L905-I909 HydrophobicContact CD2-CD1 3.53Å; L905-I909 HydrophobicContact CG-CD1 3.7Å; L905-I909 HydrophobicContact CG-CG1 4.31Å; L905-I909 WeakPolarHBondContact O-CB 3.05Å; L905-I909 WeakPolarHBondContact O-CG1 2.93Å; L905-I909 PolarHBondContact O-N 3.43Å
906	R	35.1	Very low	34.1	Very low	202 Å²	202	126.4 Å²	126.4	76%	0.762	66%	0.664	S	S	*	*	H	α-helix	trans	-70.4	-25.3	175.4	-154	-174.4	-77.3	-179.4	-6.1	112.6	P902 K904 G910	P902-R906 VanDerWaalsContact O-CB 3.31Å; P902-R906 WeakPolarHBondContact O-CB 3.33Å; P902-R906 PolarHBondContact O-N 2.94Å; K904-R906 VanDerWaalsContact C-N 3.3Å; K904-R906 PolarHBondContact O-N 3.39Å; R906-G910 WeakPolarHBondContact O-CA 3.39Å; R906-G910 PolarHBondContact O-N 3.36Å
907	H	41.6	Very low	33.5	Very low	153 Å²	153	125.5 Å²	125.5	71%	0.708	67%	0.667	S	S	*	*	H	α-helix	trans	-75.8	-37.4	167.1	-87	-8.6	0	0	0	112.7	K903 K904 L905 Q911	K903-H907 PolarHBondContact O-N 3.03Å; K904-H907 PolarHBondContact O-N 3.19Å; K904-H907 VanDerWaalsContact O-N 3.13Å; L905-H907 VanDerWaalsContact C-N 3.31Å; L905-H907 PolarHBondContact O-N 3.04Å; H907-Q911 PolarHBondContact O-N 3.01Å
908	L	39.7	Very low	33.3	Very low	93 Å²	93	127.7 Å²	127.7	49%	0.487	67%	0.671	S	S	.	*	H	α-helix	trans	-69.3	-46.4	176	-96.1	110	0	0	0	112.9	F900 K904 L905	F900-L908 HydrophobicContact CD1-CD1 3.97Å; F900-L908 HydrophobicContact CE1-CD1 3.72Å; F900-L908 HydrophobicContact CZ-CD1 4.47Å; K904-L908 WeakPolarHBondContact O-CD1 3.34Å; K904-L908 PolarHBondContact O-N 3.47Å; L905-L908 PolarHBondContact O-N 3.41Å
909	I	37.4	Very low	32.9	Very low	104 Å²	104	132.1 Å²	132.1	53%	0.533	68%	0.682	S	S	.	*	H	α-helix	trans	-78.8	-29.2	178.7	-60.5	171.8	0	0	0	111	L905 Q911 T912	L905-I909 HydrophobicContact CD2-CD1 3.53Å; L905-I909 HydrophobicContact CG-CD1 3.7Å; L905-I909 HydrophobicContact CG-CG1 4.31Å; L905-I909 WeakPolarHBondContact O-CB 3.05Å; L905-I909 WeakPolarHBondContact O-CG1 2.93Å; L905-I909 PolarHBondContact O-N 3.43Å; I909-Q911 PolarHBondContact O-N 2.67Å; I909-T912 PolarHBondContact O-N 3.06Å; I909-T912 PolarHBondContact O-OG1 2.83Å
910	G	27.5	Very low	32.6	Very low	53 Å²	53	124.7 Å²	124.7	55%	0.546	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	-7.7	178.4	0	0	0	0	0	114.6	R906 T912	R906-G910 WeakPolarHBondContact O-CA 3.39Å; R906-G910 PolarHBondContact O-N 3.36Å; G910-T912 VanDerWaalsContact C-N 3.26Å
911	Q	30.8	Very low	32.3	Very low	172 Å²	172	125.9 Å²	125.9	80%	0.804	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	33.5	166.4	-73	-171.8	-22.1	0	0	111.9	H907 I909	H907-Q911 PolarHBondContact O-N 3.01Å; I909-Q911 PolarHBondContact O-N 2.67Å
912	T	29	Very low	31.9	Very low	93 Å²	93	130.5 Å²	130.5	57%	0.571	70%	0.7	S	S	*	*	S	Bend	trans	-71.4	130.7	154.1	32.1	0	0	0	0	107.4	I909 G910 R914	I909-T912 PolarHBondContact O-N 3.06Å; I909-T912 PolarHBondContact O-OG1 2.83Å; G910-T912 VanDerWaalsContact C-N 3.26Å; T912-R914 PolarHBondContact O-N 3.04Å
913	P	37.9	Very low	31.1	Very low	113 Å²	113	136.7 Å²	136.7	73%	0.734	71%	0.71	S	S	*	*	S	Bend	trans	-72.2	79.6	-178	29.1	-32.2	0	0	0	108.7
914	R	28.6	Very low	30.6	Very low	225 Å²	225	133.7 Å²	133.7	85%	0.849	71%	0.708	S	S	*	*			trans	-147.3	53.7	-179.4	-134.9	-179.7	-174.2	162.6	3.8	110.9	T912	T912-R914 PolarHBondContact O-N 3.04Å
915	S	26.1	Very low	30.2	Very low	118 Å²	118	132.9 Å²	132.9	83%	0.825	72%	0.716	S	S	*	*	S	Bend	trans	-168	43	158.4	-97.7	0	0	0	0	115.7
916	T	26.4	Very low	29.7	Very low	141 Å²	141	138.6 Å²	138.6	87%	0.865	74%	0.738	S	S	*	*	S	Bend	trans	-134.1	1	151.1	37.9	0	0	0	0	113.4
917	A	27.2	Very low	29.3	Very low	86 Å²	86	138.1 Å²	138.1	71%	0.711	75%	0.745	S	S	*	*	S	Bend	trans	-99.2	54.8	169.3	0	0	0	0	0	112.1
918	V	24.7	Very low	28.7	Very low	134 Å²	134	136 Å²	136	81%	0.812	75%	0.747	S	S	*	*	S	Bend	trans	-151.9	59.8	156.8	-164.3	0	0	0	0	110.4
919	Q	23.2	Very low	28.1	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	77%	0.767	S	S	*	*			trans	-142.2	42.2	138.9	-75.5	-161.4	-11.7	0	0	109.1	S921	Q919-S921 PolarHBondContact O-N 2.83Å; Q919-S921 VanDerWaalsContact O-N 3.15Å
920	S	25	Very low	27.5	Very low	86 Å²	86	145.5 Å²	145.5	60%	0.601	78%	0.784	S	S	*	*			trans	-80.3	74.8	156.2	58.1	0	0	0	0	107.8	H922	S920-H922 VanDerWaalsContact C-N 3.31Å; S920-H922 PolarHBondContact O-N 3.1Å
921	S	25.3	Very low	27.4	Very low	113 Å²	113	151.4 Å²	151.4	79%	0.79	80%	0.802	S	S	*	*			trans	-63.8	104.8	154.5	-84.4	0	0	0	0	106.2	Q919 R923	Q919-S921 PolarHBondContact O-N 2.83Å; Q919-S921 VanDerWaalsContact O-N 3.15Å; S921-R923 PolarHBondContact O-N 3.16Å
922	H	26.3	Very low	27.1	Very low	178 Å²	178	151.4 Å²	151.4	82%	0.824	80%	0.802	S	S	*	*			trans	-42.4	99.9	171.8	-62.4	-80.1	0	0	0	111.3	S920	S920-H922 VanDerWaalsContact C-N 3.31Å; S920-H922 PolarHBondContact O-N 3.1Å
923	R	24.5	Very low	26.8	Very low	233 Å²	233	155.5 Å²	155.5	88%	0.879	81%	0.814	S	S	*	*			trans	-137.4	100.4	154.2	-84.5	-167.4	176.4	-174.9	-1.2	108	S921	S921-R923 PolarHBondContact O-N 3.16Å
924	T	29.2	Very low	26.3	Very low	122 Å²	122	159.6 Å²	159.6	75%	0.748	82%	0.824	S	S	*	*			trans	-57.7	135.1	166.2	45	0	0	0	0	108.8	F926	T924-F926 PolarHBondContact O-N 3.42Å
925	P	31.5	Very low	26.1	Very low	116 Å²	116	153.5 Å²	153.5	75%	0.753	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	32	-166.1	32.7	-36.5	0	0	0	114.4
926	F	27.4	Very low	26	Very low	185 Å²	185	156.2 Å²	156.2	81%	0.811	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	9.1	179.6	-89	-78.4	0	0	0	115.3	T924	T924-F926 PolarHBondContact O-N 3.42Å
927	Q	25.7	Very low	25.9	Very low	193 Å²	193	157.2 Å²	157.2	90%	0.902	81%	0.811	S	S	*	*	S	Bend	trans	-138.3	71	172.6	-69.6	-173.1	-0.2	0	0	112.4
928	S	29	Very low	25.7	Very low	109 Å²	109	156.5 Å²	156.5	76%	0.762	81%	0.812	S	S	*	*			trans	-150.9	54.1	158.5	66.6	0	0	0	0	111
929	K	28.1	Very low	25.9	Very low	207 Å²	207	159.1 Å²	159.1	90%	0.9	82%	0.816	S	S	*	*	S	Bend	trans	-105.8	87.3	149.9	-81.5	-174.1	177.7	-179.4	0	106
930	Q	23.5	Very low	26.1	Very low	188 Å²	188	155.2 Å²	155.2	88%	0.879	81%	0.809	S	S	*	*			trans	155.7	86.5	157.2	-88.6	-174	6.2	0	0	109.5
931	L	25.4	Very low	26.1	Very low	177 Å²	177	158.7 Å²	158.7	93%	0.927	82%	0.82	S	S	*	*			trans	-158.8	95.1	145.3	-116	144.3	0	0	0	107.4
932	H	24.2	Very low	26.3	Very low	173 Å²	173	159.2 Å²	159.2	80%	0.801	81%	0.812	S	S	*	*			trans	-66.8	148.9	161.5	-99.2	-54.7	0	0	0	109.8
933	Q	23	Very low	26.4	Very low	178 Å²	178	156.3 Å²	156.3	83%	0.832	81%	0.809	S	S	*	*			trans	67.4	91.2	152.9	-69.4	173.5	-10.6	0	0	117.9
934	Q	28.1	Very low	26.4	Very low	200 Å²	200	150.4 Å²	150.4	94%	0.935	80%	0.798	S	S	*	*				-146.9	137.2	127.2	-105.7	173.8	13.8	0	0	109.2
935	S	24.7	Very low	26.3	Very low	97 Å²	97	154 Å²	154	68%	0.678	80%	0.804	S	S	*	*			trans	-87.4	166.1	-163.4	45.1	0	0	0	0	114.9
936	F	23.8	Very low	26.1	Very low	175 Å²	175	158.3 Å²	158.3	77%	0.768	81%	0.811	S	S	*	*			trans	90.4	94.3	163.8	-69	-86.3	0	0	0	117.4
937	I	23.2	Very low	26.1	Very low	161 Å²	161	153.1 Å²	153.1	83%	0.826	80%	0.797	S	S	*	*				75	104.7	87.4	-65.5	175.8	0	0	0	112.4
938	G	24.7	Very low	26.4	Very low	72 Å²	72	149.9 Å²	149.9	74%	0.742	79%	0.785	S	S	*	*			trans	165.8	89.4	172.1	0	0	0	0	0	112.2
939	E	29	Very low	26.5	Very low	189 Å²	189	148.3 Å²	148.3	88%	0.883	78%	0.775	S	S	*	*			trans	64.6	114.3	168.2	-69.1	-178.4	159.7	0	0	119.1	I941	E939-I941 PolarHBondContact O-N 3.31Å
940	S	27.3	Very low	26.6	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	77%	0.771	S	S	*	*			trans	-55.8	102	173.7	54	0	0	0	0	111.8	I942	S940-I942 PolarHBondContact O-N 3.44Å
941	I	25	Very low	27.5	Very low	159 Å²	159	144.1 Å²	144.1	82%	0.815	75%	0.751	S	S	*	*			trans	-66.9	86.1	158.8	-57	168.6	0	0	0	106.5	E939 P943	E939-I941 PolarHBondContact O-N 3.31Å; I941-P943 WeakPolarHBondContact O-CD 3.42Å
942	I	27.9	Very low	28.7	Very low	124 Å²	124	142.3 Å²	142.3	64%	0.636	74%	0.738	S	S	*	*			trans	-60	124.1	154.5	-62	169.7	0	0	0	104.5	S940 V944	S940-I942 PolarHBondContact O-N 3.44Å; I942-V944 PolarHBondContact O-N 3.14Å
943	P	28.4	Very low	30.5	Very low	117 Å²	117	136.6 Å²	136.6	76%	0.76	71%	0.71	S	S	*	*			trans	-67.1	86.4	171.4	27.2	-30.3	0	0	0	107	I941 K945	I941-P943 WeakPolarHBondContact O-CD 3.42Å; P943-K945 PolarHBondContact O-N 3.42Å
944	V	25.6	Very low	32.6	Very low	108 Å²	108	128.3 Å²	128.3	66%	0.655	67%	0.671	S	S	*	*			trans	-55.9	111.6	166.7	177.9	0	0	0	0	104.4	I942 K946	I942-V944 PolarHBondContact O-N 3.14Å; V944-K946 PolarHBondContact O-N 3.31Å
945	K	27.3	Very low	34.6	Very low	199 Å²	199	119.8 Å²	119.8	87%	0.865	63%	0.633	S	S	*	*			trans	-37.3	108.4	163.1	-85.1	-178	171.3	-176.1	0	106.1	P943 S947	P943-K945 PolarHBondContact O-N 3.42Å; K945-S947 PolarHBondContact O-N 3.49Å
946	K	27.6	Very low	36.7	Very low	206 Å²	206	115.4 Å²	115.4	90%	0.896	60%	0.602	S	S	*	*			trans	-46.7	105.8	-170.6	-78.1	174.7	176.1	175.4	0	107.5	V944 L948	V944-K946 PolarHBondContact O-N 3.31Å; K946-L948 PolarHBondContact O-N 3.04Å
947	S	25.9	Very low	38.7	Very low	76 Å²	76	111.9 Å²	111.9	53%	0.531	60%	0.599	S	S	.	*			trans	-52.9	135.7	173.5	51.1	0	0	0	0	107	K945 S949	K945-S947 PolarHBondContact O-N 3.49Å; S947-S949 PolarHBondContact O-N 3.45Å; S947-S949 PolarHBondContact O-OG 2.93Å; S947-S949 PolarHBondContact OG-OG 2.9Å
948	L	33.8	Very low	40.6	Very low	124 Å²	124	104.9 Å²	104.9	65%	0.649	57%	0.567	S	S	*	*	S	Bend	trans	-54.4	16.2	-177.6	-73.4	154.6	0	0	0	115.8	K946 F950	K946-L948 PolarHBondContact O-N 3.04Å; L948-F950 PolarHBondContact O-N 2.99Å
949	S	30.9	Very low	43.1	Very low	77 Å²	77	101.9 Å²	101.9	54%	0.538	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	9.2	-172.5	58.1	0	0	0	0	115.5	S947	S947-S949 PolarHBondContact O-N 3.45Å; S947-S949 PolarHBondContact O-OG 2.93Å; S947-S949 PolarHBondContact OG-OG 2.9Å
950	F	30.2	Very low	45.7	Very low	186 Å²	186	92.9 Å²	92.9	82%	0.816	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	11.5	-179.5	-68.4	-72.9	0	0	0	116.2	L948 E952	L948-F950 PolarHBondContact O-N 2.99Å; F950-E952 PolarHBondContact O-N 3.38Å; F950-E952 VanDerWaalsContact O-N 3.09Å
951	Y	41.5	Very low	48.4	Very low	120 Å²	120	88.6 Å²	88.6	47%	0.471	46%	0.463	S	S	.	.			trans	-81.9	88.3	167.3	-76.1	-83	0	0	0	109.2	Y953	Y951-Y953 PolarHBondContact O-N 3.34Å; Y951-Y953 VanDerWaalsContact O-N 3.15Å
952	E	51.1	Low	51.5	Low	140 Å²	140	81 Å²	81	65%	0.654	42%	0.424	S	S	*	.			trans	-49.8	118.6	161.3	-174	175.4	-170.1	0	0	108	R846 F950 L954	R846-E952 VanDerWaalsContact CZ-O 3.25Å; R846-E952 PolarHBondContact NH1-O 3.33Å; R846-E952 PolarHBondContact NH2-O 2.93Å; F950-E952 PolarHBondContact O-N 3.38Å; F950-E952 VanDerWaalsContact O-N 3.09Å; E952-L954 PolarHBondContact O-N 2.95Å
953	Y	61.2	Low	54.4	Low	53 Å²	53	76.8 Å²	76.8	21%	0.208	40%	0.403	C	S	.	.			trans	-58.4	131.6	179.8	-73.2	-70.5	0	0	0	109.4	T861 P865 Y951 T955 D983	T861-Y953 HydrophobicContact CG2-CE1 4.37Å; P865-Y953 HydrophobicContact CG-CD1 3.58Å; P865-Y953 HydrophobicContact CG-CE1 3.99Å; P865-Y953 HydrophobicContact CG-CG 3.96Å; Y951-Y953 PolarHBondContact O-N 3.34Å; Y951-Y953 VanDerWaalsContact O-N 3.15Å; Y953-T955 PolarHBondContact O-N 2.88Å; Y953-D983 HydrophobicContact CD2-CB 4.39Å; Y953-D983 WeakPolarHBondContact CE2-OD1 3.32Å
954	L	67.1	Low	57.3	Low	3 Å²	3	71.2 Å²	71.2	2%	0.016	37%	0.367	C	S	.	.			trans	-79.6	73.3	176.8	-171.9	62.1	0	0	0	108.9	Y834 L835 I842 L843 I862 E952	Y834-L954 HydrophobicContact CE1-CD1 4.14Å; Y834-L954 HydrophobicContact CE1-CG 3.95Å; Y834-L954 WeakPolarHBondContact OH-CD1 3.44Å; L835-L954 HydrophobicContact CD2-CD2 3.44Å; L835-L954 VanDerWaalsContact CD2-CD2 3.44Å; L835-L954 HydrophobicContact CD2-CG 3.93Å; I842-L954 HydrophobicContact CB-CD1 3.66Å; I842-L954 HydrophobicContact CD1-CD1 3.88Å; I842-L954 HydrophobicContact CG1-CD1 4.37Å; I842-L954 HydrophobicContact CG2-CD1 3.62Å; L843-L954 HydrophobicContact CB-CD2 3.96Å; L843-L954 HydrophobicContact CD1-CD2 4.34Å; I862-L954 HydrophobicContact CD1-CD2 4.2Å; I862-L954 HydrophobicContact CG1-CB 4.13Å; I862-L954 HydrophobicContact CG2-CB 4.28Å; E952-L954 PolarHBondContact O-N 2.95Å
955	T	70.2	Confident	60.2	Low	22 Å²	22	69.7 Å²	69.7	14%	0.135	35%	0.35	C	S	.	.			trans	-111.7	145.3	-179.4	51.9	0	0	0	0	111.2	Y834 P865 F866 Y953 S957 L982	Y834-T955 PolarHBondContact OH-O 3.11Å; P865-T955 HydrophobicContact CB-CG2 4.05Å; P865-T955 HydrophobicContact CG-CG2 4.08Å; F866-T955 HydrophobicContact CE2-CG2 3.9Å; F866-T955 HydrophobicContact CZ-CG2 3.92Å; Y953-T955 PolarHBondContact O-N 2.88Å; T955-S957 PolarHBondContact O-N 3.45Å; T955-L982 HydrophobicContact CG2-CB 3.97Å
956	P	68.4	Low	63	Low	5 Å²	5	60.3 Å²	60.3	3%	0.032	31%	0.309	C	S	.	.			trans	-56.2	139	171.2	4.8	-5.2	0	0	0	110	Y834 F866 M887 G958 F960	Y834-P956 HydrophobicContact CD1-CB 4.41Å; Y834-P956 HydrophobicContact CD1-CG 4.18Å; Y834-P956 HydrophobicContact CD2-CB 3.79Å; Y834-P956 HydrophobicContact CD2-CG 4.39Å; Y834-P956 HydrophobicContact CE2-CB 4.23Å; Y834-P956 HydrophobicContact CG-CB 3.89Å; Y834-P956 HydrophobicContact CG-CG 3.98Å; F866-P956 HydrophobicContact CE1-CG 4.38Å; F866-P956 HydrophobicContact CZ-CG 4.47Å; M887-P956 HydrophobicContact SD-CB 4.12Å; P956-G958 PolarHBondContact O-N 3.25Å; P956-G958 VanDerWaalsContact O-N 3.12Å; P956-F960 HydrophobicContact CB-CE1 4.26Å; P956-F960 HydrophobicContact CB-CZ 3.89Å; P956-F960 HydrophobicContact CG-CE1 3.92Å; P956-F960 HydrophobicContact CG-CZ 3.72Å; P956-F960 WeakPolarHBondContact O-CZ 3.46Å
957	S	66.2	Low	65.5	Low	100 Å²	100	53.7 Å²	53.7	70%	0.699	29%	0.289	S	S	*	.			trans	-61.1	115.6	166.6	50.2	0	0	0	0	107.4	T955	T955-S957 PolarHBondContact O-N 3.45Å
958	G	64.6	Low	68.1	Low	15 Å²	15	52.5 Å²	52.5	16%	0.155	28%	0.279	C	S	.	.			trans	-62.7	-171	176	0	0	0	0	0	112.6	P956 F960	P956-G958 PolarHBondContact O-N 3.25Å; P956-G958 VanDerWaalsContact O-N 3.12Å; G958-F960 VanDerWaalsContact CA-CE2 3.44Å
959	P	77.1	Confident	70.1	Confident	8 Å²	8	57.8 Å²	57.8	5%	0.052	29%	0.29	C	S	.	.			cis	-89.6	149.1	16.9	23.6	-20.4	0	0	0	115.6	T888 T978 L979 M980	T888-P959 PolarHBondContact N-O 2.79Å; T888-P959 VanDerWaalsContact N-O 3.07Å; T888-P959 WeakPolarHBondContact OG1-CG 3.39Å; T888-P959 PolarHBondContact OG1-O 3.19Å; P959-T978 HydrophobicContact CB-CG2 3.81Å; P959-L979 CarbonylContact C-O 3.55Å; P959-L979 VanDerWaalsContact CA-O 3.31Å; P959-L979 WeakPolarHBondContact CA-O 3.2Å; P959-M980 HydrophobicContact CB-SD 4.17Å
960	F	82.4	Confident	72.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.1	175.1	-54	-85.2	0	0	0	110.2	F885 M887 P956 G958 T978 L979 L982	F885-F960 HydrophobicContact CE2-CB 4.05Å; F885-F960 AromaticContact CE2-CD1 3.88Å; F885-F960 HydrophobicContact CE2-CD1 3.88Å; F885-F960 HydrophobicContact CE2-CG 4.32Å; F885-F960 AromaticContact CZ-CD1 3.7Å; F885-F960 HydrophobicContact CZ-CD1 3.7Å; F885-F960 HydrophobicContact CZ-CE1 4.38Å; M887-F960 HydrophobicContact CG-CD1 4.24Å; M887-F960 HydrophobicContact CG-CE1 4.16Å; M887-F960 HydrophobicContact SD-CE1 4.09Å; P956-F960 HydrophobicContact CB-CE1 4.26Å; P956-F960 HydrophobicContact CB-CZ 3.89Å; P956-F960 HydrophobicContact CG-CE1 3.92Å; P956-F960 HydrophobicContact CG-CZ 3.72Å; P956-F960 WeakPolarHBondContact O-CZ 3.46Å; G958-F960 VanDerWaalsContact CA-CE2 3.44Å; F960-T978 CarbonylContact O-C 3.53Å; F960-T978 VanDerWaalsContact O-CA 3.28Å; F960-T978 WeakPolarHBondContact O-CA 3.45Å; F960-L979 HydrophobicContact CB-CB 4.31Å; F960-L979 PolarHBondContact N-O 2.84Å; F960-L979 PolarHBondContact O-N 3.46Å; F960-L982 HydrophobicContact CD1-CD2 4.31Å; F960-L982 HydrophobicContact CD2-CD2 3.76Å; F960-L982 HydrophobicContact CD2-CG 3.86Å; F960-L982 HydrophobicContact CE1-CD1 4Å; F960-L982 HydrophobicContact CE1-CD2 4.42Å; F960-L982 HydrophobicContact CE1-CG 4.17Å; F960-L982 HydrophobicContact CE2-CD1 4.12Å; F960-L982 HydrophobicContact CE2-CD2 3.93Å; F960-L982 HydrophobicContact CE2-CG 3.47Å; F960-L982 VanDerWaalsContact CE2-CG 3.47Å; F960-L982 HydrophobicContact CG-CD2 3.97Å; F960-L982 HydrophobicContact CG-CG 4.39Å; F960-L982 HydrophobicContact CZ-CD1 3.72Å; F960-L982 HydrophobicContact CZ-CD2 4.24Å; F960-L982 HydrophobicContact CZ-CG 3.63Å
961	S	84.9	Confident	74.7	Confident	19 Å²	19	50.9 Å²	50.9	13%	0.133	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.3	176.9	-179	0	0	0	0	110.2	G886 F977	G886-S961 PolarHBondContact N-O 2.94Å; G886-S961 PolarHBondContact O-N 3.14Å; S961-F977 CarbonylContact C-O 3.46Å; S961-F977 WeakPolarHBondContact CA-O 3.14Å
962	I	89.6	Confident	76.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.1	175.9	-59.6	154.9	0	0	0	107.2	L869 L873 V883 N884 F885 V964 R976 F977 L979 L1020	L869-I962 HydrophobicContact CD1-CD1 3.64Å; L873-I962 HydrophobicContact CD2-CG1 4.37Å; L873-I962 HydrophobicContact CD2-CG2 3.61Å; V883-I962 HydrophobicContact CG1-CG2 4.27Å; N884-I962 WeakPolarHBondContact O-CA 3.26Å; F885-I962 HydrophobicContact CD2-CG1 3.86Å; I962-V964 HydrophobicContact CG2-CG2 4.15Å; I962-R976 CarbonylContact O-C 3.58Å; I962-R976 WeakPolarHBondContact O-CA 3.5Å; I962-F977 HydrophobicContact CB-CB 4.23Å; I962-F977 HydrophobicContact CB-CD2 4.49Å; I962-F977 HydrophobicContact CG2-CD2 4.4Å; I962-F977 PolarHBondContact N-O 2.86Å; I962-F977 PolarHBondContact O-N 3.36Å; I962-L979 HydrophobicContact CD1-CD1 3.65Å; I962-L979 HydrophobicContact CD1-CG 4.24Å; I962-L1020 HydrophobicContact CD1-CD1 3.45Å; I962-L1020 VanDerWaalsContact CD1-CD1 3.45Å
963	T	87.8	Confident	78.4	Confident	34 Å²	34	43.1 Å²	43.1	21%	0.209	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.7	176.6	54.1	0	0	0	0	109.4	V883 N884 V975 R976	V883-T963 CarbonylContact C-O 3.55Å; V883-T963 VanDerWaalsContact CA-O 3.3Å; V883-T963 WeakPolarHBondContact CA-O 3.5Å; N884-T963 WeakPolarHBondContact CB-OG1 3.34Å; N884-T963 PolarHBondContact N-O 3.44Å; N884-T963 PolarHBondContact O-N 3.43Å; N884-T963 PolarHBondContact O-OG1 3.17Å; T963-V975 CarbonylContact C-O 3.53Å; T963-V975 WeakPolarHBondContact CA-O 3.2Å; T963-R976 HydrophobicContact CG2-CB 4.14Å; T963-R976 HydrophobicContact CG2-CG 3.93Å
964	V	90.4	Very high	79.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.7	178.2	-174.9	0	0	0	0	108.1	L876 Y881 V883 I962 V966 V975 F977 I1024	L876-V964 HydrophobicContact CD1-CG2 3.88Å; L876-V964 HydrophobicContact CD2-CG1 4.33Å; Y881-V964 HydrophobicContact CG-CG1 4.24Å; V883-V964 HydrophobicContact CG1-CG2 4.42Å; V883-V964 HydrophobicContact CG2-CG1 4.36Å; V883-V964 HydrophobicContact CG2-CG2 4.43Å; I962-V964 HydrophobicContact CG2-CG2 4.15Å; V964-V966 HydrophobicContact CG1-CG2 4.28Å; V964-V975 PolarHBondContact N-O 3.07Å; V964-V975 PolarHBondContact O-N 3.39Å; V964-F977 HydrophobicContact CG2-CD2 4.19Å; V964-F977 HydrophobicContact CG2-CE2 3.92Å; V964-I1024 HydrophobicContact CB-CD1 4.19Å; V964-I1024 HydrophobicContact CB-CG1 4.46Å; V964-I1024 HydrophobicContact CG1-CD1 4.11Å; V964-I1024 HydrophobicContact CG1-CG1 4.14Å; V964-I1024 HydrophobicContact CG1-CG2 4.23Å; V964-I1024 HydrophobicContact CG2-CG1 4.49Å
965	R	86.9	Confident	80.8	Confident	76 Å²	76	42.9 Å²	42.9	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.6	176.3	-179.6	-169.1	-71.7	162.9	-3.6	109.6	D882 R972 I973	D882-R965 HydrophobicContact CB-CB 4.07Å; D882-R965 PolarHBondContact N-O 2.82Å; D882-R965 PolarHBondContact O-N 2.8Å; D882-R965 WeakPolarHBondContact OD2-CD 3.23Å; D882-R965 IonicContact OD2-CZ 3.36Å; D882-R965 IonicContact OD2-NE 3.61Å; D882-R965 IonicContact OD2-NH1 3.51Å; D882-R965 PolarHBondContact OD2-NH1 3.41Å; R965-R972 HydrophobicContact CG-CG 4.46Å; R965-I973 WeakPolarHBondContact CA-O 3.46Å
966	V	85.6	Confident	81.7	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.3	174.9	-176	0	0	0	0	108.5	Y881 V964 Y971 R972 I973 I1024	Y881-V966 HydrophobicContact CD1-CB 4.45Å; Y881-V966 HydrophobicContact CD1-CG1 4.37Å; Y881-V966 HydrophobicContact CD1-CG2 4Å; Y881-V966 HydrophobicContact CE1-CG1 4.05Å; Y881-V966 HydrophobicContact CE1-CG2 4.13Å; V964-V966 HydrophobicContact CG1-CG2 4.28Å; V966-Y971 HydrophobicContact CG1-CE2 4.12Å; V966-R972 WeakPolarHBondContact O-CA 3.48Å; V966-I973 PolarHBondContact N-O 3.43Å; V966-I973 PolarHBondContact O-N 3.4Å; V966-I1024 HydrophobicContact CG2-CG2 3.9Å
967	S	80.3	Confident	82.6	Confident	67 Å²	67	46.1 Å²	46.1	47%	0.469	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	119.1	-179.9	-54.1	0	0	0	0	110.2	R972	S967-R972 WeakPolarHBondContact OG-CG 3.48Å; S967-R972 PolarHBondContact OG-NE 3.29Å
968	T	80	Confident	83.5	Confident	52 Å²	52	41.6 Å²	41.6	32%	0.319	20%	0.197	S	C	.	.			trans	-117.1	-178.8	170.3	71.9	0	0	0	0	110.2	N970 Y971	T968-N970 VanDerWaalsContact C-N 3.25Å; T968-N970 PolarHBondContact O-N 2.84Å; T968-N970 PolarHBondContact OG1-N 3.24Å; T968-Y971 HydrophobicContact CG2-CD1 4.49Å; T968-Y971 HydrophobicContact CG2-CD2 4.41Å; T968-Y971 HydrophobicContact CG2-CE1 3.82Å; T968-Y971 HydrophobicContact CG2-CE2 3.75Å; T968-Y971 VanDerWaalsContact CG2-CZ 3.42Å; T968-Y971 WeakPolarHBondContact CG2-OH 3.47Å; T968-Y971 PolarHBondContact N-O 2.93Å; T968-Y971 WeakPolarHBondContact OG1-CD1 3.37Å; T968-Y971 WeakPolarHBondContact OG1-CE1 3.41Å; T968-Y971 PolarHBondContact OG1-N 2.87Å; T968-Y971 VanDerWaalsContact OG1-N 3.17Å; T968-Y971 PolarHBondContact OG1-O 2.91Å
969	R	75.9	Confident	84.4	Confident	234 Å²	234	41 Å²	41	88%	0.883	19%	0.191	S	C	*	.	S	Bend	trans	-63.6	-32	173.6	-70	-175.4	179.6	178.6	0.5	112.6
970	N	77.1	Confident	84.4	Confident	108 Å²	108	44.3 Å²	44.3	58%	0.578	21%	0.206	S	C	*	.	S	Bend	trans	-99.7	-29.3	-169.3	-64.2	-13.1	0	0	0	112.9	T968 I1035	T968-N970 VanDerWaalsContact C-N 3.25Å; T968-N970 PolarHBondContact O-N 2.84Å; T968-N970 PolarHBondContact OG1-N 3.24Å; N970-I1035 HydrophobicContact CB-CD1 4.5Å
971	Y	80.4	Confident	84	Confident	10 Å²	10	45.8 Å²	45.8	4%	0.039	22%	0.216	C	C	.	.			trans	-146.6	160.4	-175.9	62.3	-93.7	0	0	0	112.7	V966 T968 I973 R998 L1001 L1031 I1035	V966-Y971 HydrophobicContact CG1-CE2 4.12Å; T968-Y971 HydrophobicContact CG2-CD1 4.49Å; T968-Y971 HydrophobicContact CG2-CD2 4.41Å; T968-Y971 HydrophobicContact CG2-CE1 3.82Å; T968-Y971 HydrophobicContact CG2-CE2 3.75Å; T968-Y971 VanDerWaalsContact CG2-CZ 3.42Å; T968-Y971 WeakPolarHBondContact CG2-OH 3.47Å; T968-Y971 PolarHBondContact N-O 2.93Å; T968-Y971 WeakPolarHBondContact OG1-CD1 3.37Å; T968-Y971 WeakPolarHBondContact OG1-CE1 3.41Å; T968-Y971 PolarHBondContact OG1-N 2.87Å; T968-Y971 VanDerWaalsContact OG1-N 3.17Å; T968-Y971 PolarHBondContact OG1-O 2.91Å; Y971-I973 HydrophobicContact CD2-CD1 4.02Å; Y971-I973 HydrophobicContact CD2-CG1 4Å; Y971-I973 HydrophobicContact CE2-CD1 4.23Å; Y971-R998 CarbonylContact C-O 3.46Å; Y971-R998 WeakPolarHBondContact CA-O 3.45Å; Y971-R998 WeakPolarHBondContact CB-O 3.4Å; Y971-L1001 HydrophobicContact CD2-CD1 4.06Å; Y971-L1001 HydrophobicContact CG-CD1 3.94Å; Y971-L1001 HydrophobicContact CG-CD2 4.48Å; Y971-L1031 HydrophobicContact CD2-CD1 4.29Å; Y971-L1031 HydrophobicContact CE1-CB 4.16Å; Y971-L1031 HydrophobicContact CE2-CD1 3.55Å; Y971-I1035 HydrophobicContact CD1-CD1 3.37Å; Y971-I1035 HydrophobicContact CE1-CD1 3.45Å; Y971-I1035 VanDerWaalsContact CE1-CD1 3.45Å
972	R	83.5	Confident	83.4	Confident	97 Å²	97	44.9 Å²	44.9	37%	0.366	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	120.9	172.6	-163.8	179.5	-155.8	-172.4	-0.4	108.8	R965 V966 S967 L997 R998	R965-R972 HydrophobicContact CG-CG 4.46Å; V966-R972 WeakPolarHBondContact O-CA 3.48Å; S967-R972 WeakPolarHBondContact OG-CG 3.48Å; S967-R972 PolarHBondContact OG-NE 3.29Å; R972-L997 HydrophobicContact CB-CB 4.11Å; R972-L997 HydrophobicContact CG-CB 4.14Å; R972-L997 HydrophobicContact CG-CD1 4.12Å; R972-L997 PolarHBondContact O-N 3.33Å; R972-R998 HydrophobicContact CB-CB 3.72Å; R972-R998 PolarHBondContact N-O 2.95Å; R972-R998 PolarHBondContact O-N 2.86Å; R972-R998 VanDerWaalsContact O-N 3.11Å
973	I	86.8	Confident	82.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.9	179.2	-53.2	170.9	0	0	0	108.2	R965 V966 Y971 V975 E995 L1001 L1006 L1031	R965-I973 WeakPolarHBondContact CA-O 3.46Å; V966-I973 PolarHBondContact N-O 3.43Å; V966-I973 PolarHBondContact O-N 3.4Å; Y971-I973 HydrophobicContact CD2-CD1 4.02Å; Y971-I973 HydrophobicContact CD2-CG1 4Å; Y971-I973 HydrophobicContact CE2-CD1 4.23Å; I973-V975 HydrophobicContact CG2-CG2 3.91Å; I973-E995 WeakPolarHBondContact CA-O 3.43Å; I973-L1001 HydrophobicContact CD1-CD1 3.3Å; I973-L1001 HydrophobicContact CG1-CD1 3.59Å; I973-L1006 HydrophobicContact CD1-CD1 4.39Å; I973-L1006 HydrophobicContact CD1-CD2 4.36Å; I973-L1031 HydrophobicContact CD1-CD1 3.43Å; I973-L1031 VanDerWaalsContact CD1-CD1 3.43Å; I973-L1031 HydrophobicContact CD1-CD2 4.42Å
974	M	89.6	Confident	81.1	Confident	51 Å²	51	47 Å²	47	25%	0.251	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.7	164.9	-164.4	-173.8	-47	0	0	108	Y994 E995 L997	M974-Y994 CarbonylContact O-C 3.41Å; M974-Y994 WeakPolarHBondContact O-CA 3.47Å; M974-E995 HydrophobicContact CB-CB 4.43Å; M974-E995 PolarHBondContact N-O 3.39Å; M974-E995 PolarHBondContact O-N 2.98Å; M974-L997 HydrophobicContact CB-CD1 4.24Å; M974-L997 HydrophobicContact CB-CG 4.48Å; M974-L997 HydrophobicContact CE-CD1 3.92Å; M974-L997 HydrophobicContact CE-CD2 4.22Å
975	V	89.1	Confident	79.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.9	175.7	-176.2	0	0	0	0	107.4	T963 V964 I973 F977 V992 E993 F1010 I1024 L1027	T963-V975 CarbonylContact C-O 3.53Å; T963-V975 WeakPolarHBondContact CA-O 3.2Å; V964-V975 PolarHBondContact N-O 3.07Å; V964-V975 PolarHBondContact O-N 3.39Å; I973-V975 HydrophobicContact CG2-CG2 3.91Å; V975-F977 HydrophobicContact CG1-CD2 4.45Å; V975-F977 HydrophobicContact CG1-CE1 4.07Å; V975-F977 HydrophobicContact CG1-CE2 3.9Å; V975-F977 HydrophobicContact CG1-CZ 3.69Å; V975-V992 HydrophobicContact CG1-CG1 3.56Å; V975-E993 CarbonylContact C-O 3.5Å; V975-E993 WeakPolarHBondContact CA-O 3.29Å; V975-F1010 HydrophobicContact CG1-CE1 3.93Å; V975-F1010 HydrophobicContact CG1-CZ 4.04Å; V975-F1010 HydrophobicContact CG2-CE1 4.42Å; V975-F1010 HydrophobicContact CG2-CZ 3.77Å; V975-I1024 HydrophobicContact CB-CD1 4.05Å; V975-I1024 HydrophobicContact CG1-CD1 4.13Å; V975-I1024 HydrophobicContact CG2-CD1 4.09Å; V975-L1027 HydrophobicContact CG2-CD2 3.94Å
976	R	88.9	Confident	78.1	Confident	96 Å²	96	51.5 Å²	51.5	36%	0.362	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.7	176.9	-176.9	173.6	77.9	178	13.6	109.1	I962 T963 V992 E993	I962-R976 CarbonylContact O-C 3.58Å; I962-R976 WeakPolarHBondContact O-CA 3.5Å; T963-R976 HydrophobicContact CG2-CB 4.14Å; T963-R976 HydrophobicContact CG2-CG 3.93Å; R976-V992 WeakPolarHBondContact O-CA 3.47Å; R976-E993 HydrophobicContact CB-CB 4.38Å; R976-E993 IonicContact CZ-OE1 2.71Å; R976-E993 IonicContact CZ-OE2 3.75Å; R976-E993 PolarHBondContact N-O 2.75Å; R976-E993 IonicContact NE-OE1 3.62Å; R976-E993 IonicContact NE-OE2 3.89Å; R976-E993 PolarHBondContact NE-OE2 2.86Å; R976-E993 IonicContact NH2-OE1 3.34Å; R976-E993 PolarHBondContact NH2-OE1 3.3Å; R976-E993 IonicContact NH2-OE2 2.84Å; R976-E993 PolarHBondContact NH2-OE2 2.78Å; R976-E993 PolarHBondContact O-N 2.75Å
977	F	88.2	Confident	76.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.2	169.5	-57.4	-76.3	0	0	0	109.3	S961 I962 V964 V975 S991 V992 P1015 L1020 I1023 I1024	S961-F977 CarbonylContact C-O 3.46Å; S961-F977 WeakPolarHBondContact CA-O 3.14Å; I962-F977 HydrophobicContact CB-CB 4.23Å; I962-F977 HydrophobicContact CB-CD2 4.49Å; I962-F977 HydrophobicContact CG2-CD2 4.4Å; I962-F977 PolarHBondContact N-O 2.86Å; I962-F977 PolarHBondContact O-N 3.36Å; V964-F977 HydrophobicContact CG2-CD2 4.19Å; V964-F977 HydrophobicContact CG2-CE2 3.92Å; V975-F977 HydrophobicContact CG1-CD2 4.45Å; V975-F977 HydrophobicContact CG1-CE1 4.07Å; V975-F977 HydrophobicContact CG1-CE2 3.9Å; V975-F977 HydrophobicContact CG1-CZ 3.69Å; F977-S991 WeakPolarHBondContact CA-O 3.29Å; F977-V992 HydrophobicContact CD1-CB 4.44Å; F977-V992 HydrophobicContact CD1-CG1 4.09Å; F977-V992 HydrophobicContact CD1-CG2 3.8Å; F977-V992 HydrophobicContact CE1-CG1 3.92Å; F977-V992 HydrophobicContact CE1-CG2 3.85Å; F977-P1015 HydrophobicContact CD1-CB 3.48Å; F977-P1015 VanDerWaalsContact CD1-CB 3.48Å; F977-P1015 HydrophobicContact CD1-CG 4.12Å; F977-P1015 HydrophobicContact CE1-CB 4.04Å; F977-P1015 HydrophobicContact CG-CB 4.38Å; F977-L1020 HydrophobicContact CB-CD2 4.17Å; F977-L1020 HydrophobicContact CD1-CD2 3.87Å; F977-L1020 HydrophobicContact CD2-CD2 3.99Å; F977-L1020 HydrophobicContact CE1-CD2 4.21Å; F977-L1020 HydrophobicContact CE2-CD2 4.31Å; F977-L1020 HydrophobicContact CG-CD2 3.74Å; F977-L1020 HydrophobicContact CZ-CD2 4.41Å; F977-I1023 HydrophobicContact CE1-CD1 4.34Å; F977-I1023 HydrophobicContact CE1-CG2 4.01Å; F977-I1023 HydrophobicContact CZ-CB 4.44Å; F977-I1023 HydrophobicContact CZ-CG2 3.99Å; F977-I1024 HydrophobicContact CE2-CD1 3.79Å; F977-I1024 HydrophobicContact CE2-CG1 3.91Å; F977-I1024 HydrophobicContact CZ-CD1 3.69Å; F977-I1024 HydrophobicContact CZ-CG1 3.92Å
978	T	83.7	Confident	75.5	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	107.8	171	-53	0	0	0	0	108.5	P959 F960 M980 G990 S991	P959-T978 HydrophobicContact CB-CG2 3.81Å; F960-T978 CarbonylContact O-C 3.53Å; F960-T978 VanDerWaalsContact O-CA 3.28Å; F960-T978 WeakPolarHBondContact O-CA 3.45Å; T978-M980 HydrophobicContact CG2-CE 4.28Å; T978-G990 CarbonylContact O-C 3.57Å; T978-G990 WeakPolarHBondContact O-CA 3.41Å; T978-S991 WeakPolarHBondContact CB-OG 3.45Å; T978-S991 PolarHBondContact N-O 2.81Å; T978-S991 PolarHBondContact O-N 2.75Å
979	L	83.3	Confident	74.7	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.4	176.1	-55.9	178.5	0	0	0	109.4	P959 F960 I962 P1015	P959-L979 CarbonylContact C-O 3.55Å; P959-L979 VanDerWaalsContact CA-O 3.31Å; P959-L979 WeakPolarHBondContact CA-O 3.2Å; F960-L979 HydrophobicContact CB-CB 4.31Å; F960-L979 PolarHBondContact N-O 2.84Å; F960-L979 PolarHBondContact O-N 3.46Å; I962-L979 HydrophobicContact CD1-CD1 3.65Å; I962-L979 HydrophobicContact CD1-CG 4.24Å; L979-P1015 HydrophobicContact CD2-CB 4.28Å
980	M	78.1	Confident	74.6	Confident	77 Å²	77	47.8 Å²	47.8	38%	0.379	25%	0.246	S	C	.	.	S	Bend	trans	-77.9	-28.2	178.8	-64.4	-63.3	169	0	0	112.3	P959 T978	P959-M980 HydrophobicContact CB-SD 4.17Å; T978-M980 HydrophobicContact CG2-CE 4.28Å
981	S	73.8	Confident	74.8	Confident	30 Å²	30	44.8 Å²	44.8	21%	0.21	23%	0.233	C	C	.	.			trans	-140.6	156.5	177.6	-177.5	0	0	0	0	109.3	D983	S981-D983 VanDerWaalsContact C-N 3.31Å; S981-D983 WeakPolarHBondContact OG-CB 3.32Å; S981-D983 PolarHBondContact OG-N 3.3Å; S981-D983 VanDerWaalsContact OG-N 3.07Å
982	L	72.3	Confident	75	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.24	C	C	.	.	S	Bend	trans	-85.8	-7.7	167.6	-67.1	178.9	0	0	0	112.7	P865 F866 L869 T955 F960 Y984 C1017	P865-L982 HydrophobicContact CB-CB 4.28Å; F866-L982 HydrophobicContact CD1-CD1 3.85Å; F866-L982 HydrophobicContact CE1-CD1 3.3Å; F866-L982 HydrophobicContact CZ-CD1 3.8Å; L869-L982 HydrophobicContact CD2-CD2 3.58Å; T955-L982 HydrophobicContact CG2-CB 3.97Å; F960-L982 HydrophobicContact CD1-CD2 4.31Å; F960-L982 HydrophobicContact CD2-CD2 3.76Å; F960-L982 HydrophobicContact CD2-CG 3.86Å; F960-L982 HydrophobicContact CE1-CD1 4Å; F960-L982 HydrophobicContact CE1-CD2 4.42Å; F960-L982 HydrophobicContact CE1-CG 4.17Å; F960-L982 HydrophobicContact CE2-CD1 4.12Å; F960-L982 HydrophobicContact CE2-CD2 3.93Å; F960-L982 HydrophobicContact CE2-CG 3.47Å; F960-L982 VanDerWaalsContact CE2-CG 3.47Å; F960-L982 HydrophobicContact CG-CD2 3.97Å; F960-L982 HydrophobicContact CG-CG 4.39Å; F960-L982 HydrophobicContact CZ-CD1 3.72Å; F960-L982 HydrophobicContact CZ-CD2 4.24Å; F960-L982 HydrophobicContact CZ-CG 3.63Å; L982-Y984 PolarHBondContact O-N 3.43Å; L982-C1017 PolarHBondContact O-SG 3.28Å
983	D	67.8	Low	75.1	Confident	36 Å²	36	45.3 Å²	45.3	19%	0.193	24%	0.242	C	C	.	.			trans	-64.6	110.9	177.3	-169	-8	0	0	0	109.9	Y953 S981 M985 D986	Y953-D983 HydrophobicContact CD2-CB 4.39Å; Y953-D983 WeakPolarHBondContact CE2-OD1 3.32Å; S981-D983 VanDerWaalsContact C-N 3.31Å; S981-D983 WeakPolarHBondContact OG-CB 3.32Å; S981-D983 PolarHBondContact OG-N 3.3Å; S981-D983 VanDerWaalsContact OG-N 3.07Å; D983-M985 PolarHBondContact O-N 2.96Å; D983-M985 WeakPolarHBondContact OD1-CA 3.49Å; D983-M985 VanDerWaalsContact OD1-CB 3.31Å; D983-M985 WeakPolarHBondContact OD1-CB 3.33Å; D983-M985 PolarHBondContact OD1-N 2.98Å; D983-D986 HydrophobicContact CB-CB 3.66Å; D983-D986 PolarHBondContact O-N 3.17Å; D983-D986 PolarHBondContact OD1-N 3.47Å
984	Y	60.7	Low	75.2	Confident	42 Å²	42	47.9 Å²	47.9	17%	0.165	25%	0.252	C	S	.	.	S	Bend	trans	-76.7	-13.7	178.9	66.4	-83.5	0	0	0	112.2	V864 P865 V868 L982	V864-Y984 HydrophobicContact CG1-CE1 3.78Å; P865-Y984 HydrophobicContact CB-CD1 4.48Å; V868-Y984 HydrophobicContact CG2-CD1 4.43Å; L982-Y984 PolarHBondContact O-N 3.43Å
985	M	57.9	Low	74.9	Confident	95 Å²	95	50.8 Å²	50.8	47%	0.468	27%	0.265	S	S	.	.	S	Bend	trans	-87.4	-25.4	172.4	-63.7	-56	-164	0	0	112.6	T704 D983 S987	T704-M985 HydrophobicContact CG2-CE 3.01Å; D983-M985 PolarHBondContact O-N 2.96Å; D983-M985 WeakPolarHBondContact OD1-CA 3.49Å; D983-M985 VanDerWaalsContact OD1-CB 3.31Å; D983-M985 WeakPolarHBondContact OD1-CB 3.33Å; D983-M985 PolarHBondContact OD1-N 2.98Å; M985-S987 PolarHBondContact O-N 3.48Å
986	D	57.1	Low	74.7	Confident	75 Å²	75	52.9 Å²	52.9	40%	0.401	28%	0.278	S	S	.	.	S	Bend	trans	-73	127.8	-177.3	-157.6	24.2	0	0	0	109.6	D983 S988	D983-D986 HydrophobicContact CB-CB 3.66Å; D983-D986 PolarHBondContact O-N 3.17Å; D983-D986 PolarHBondContact OD1-N 3.47Å; D986-S988 PolarHBondContact O-N 2.91Å; D986-S988 PolarHBondContact OD2-OG 3.17Å
987	S	52.7	Low	74.4	Confident	106 Å²	106	51.5 Å²	51.5	74%	0.741	28%	0.277	S	S	*	.			trans	-73.7	7.2	-178.6	65.9	0	0	0	0	113.2	M985 Q989	M985-S987 PolarHBondContact O-N 3.48Å; S987-Q989 PolarHBondContact O-N 2.84Å
988	S	58.1	Low	74	Confident	41 Å²	41	59.4 Å²	59.4	29%	0.287	31%	0.307	S	S	.	.			trans	-62.9	102.7	178.4	48.6	0	0	0	0	109.2	D986 G990	D986-S988 PolarHBondContact O-N 2.91Å; D986-S988 PolarHBondContact OD2-OG 3.17Å; S988-G990 PolarHBondContact O-N 3.48Å
989	Q	64.7	Low	73.7	Confident	121 Å²	121	60.7 Å²	60.7	57%	0.565	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-67.8	125.7	-174.1	-62.9	172.8	15.4	0	0	109.6	S987 K1014	S987-Q989 PolarHBondContact O-N 2.84Å; Q989-K1014 HydrophobicContact CG-CD 4.28Å; Q989-K1014 HydrophobicContact CG-CG 4.43Å
990	G	73.3	Confident	73.4	Confident	10 Å²	10	69 Å²	69	10%	0.103	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-70	161.2	164.7	0	0	0	0	0	111.3	T978 S988 P1015	T978-G990 CarbonylContact O-C 3.57Å; T978-G990 WeakPolarHBondContact O-CA 3.41Å; S988-G990 PolarHBondContact O-N 3.48Å; G990-P1015 VanDerWaalsContact C-CG 3.41Å; G990-P1015 PolarHBondContact N-O 3.48Å; G990-P1015 VanDerWaalsContact O-CD 3.28Å; G990-P1015 WeakPolarHBondContact O-CD 3.47Å; G990-P1015 VanDerWaalsContact O-CG 3.26Å; G990-P1015 WeakPolarHBondContact O-CG 3.3Å
991	S	81.1	Confident	73.4	Confident	45 Å²	45	66.6 Å²	66.6	32%	0.315	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	150.7	170.9	64.5	0	0	0	0	111	F977 T978	F977-S991 WeakPolarHBondContact CA-O 3.29Å; T978-S991 WeakPolarHBondContact CB-OG 3.45Å; T978-S991 PolarHBondContact N-O 2.81Å; T978-S991 PolarHBondContact O-N 2.75Å
992	V	85.4	Confident	73.5	Confident	31 Å²	31	67.9 Å²	67.9	19%	0.188	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.8	170.2	-166.4	0	0	0	0	108.3	V975 R976 F977 F1010 C1013 P1015	V975-V992 HydrophobicContact CG1-CG1 3.56Å; R976-V992 WeakPolarHBondContact O-CA 3.47Å; F977-V992 HydrophobicContact CD1-CB 4.44Å; F977-V992 HydrophobicContact CD1-CG1 4.09Å; F977-V992 HydrophobicContact CD1-CG2 3.8Å; F977-V992 HydrophobicContact CE1-CG1 3.92Å; F977-V992 HydrophobicContact CE1-CG2 3.85Å; V992-F1010 HydrophobicContact CB-CD1 4.2Å; V992-F1010 HydrophobicContact CG1-CD1 3.52Å; V992-F1010 HydrophobicContact CG1-CE1 3.77Å; V992-F1010 HydrophobicContact CG1-CG 4.13Å; V992-C1013 HydrophobicContact CG2-CB 4.48Å; V992-P1015 HydrophobicContact CG2-CB 4.13Å; V992-P1015 HydrophobicContact CG2-CG 3.55Å
993	E	84.9	Confident	73.8	Confident	86 Å²	86	71.6 Å²	71.6	40%	0.402	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	151.8	167.5	-67.8	174.5	-140.4	0	0	109	V975 R976	V975-E993 CarbonylContact C-O 3.5Å; V975-E993 WeakPolarHBondContact CA-O 3.29Å; R976-E993 HydrophobicContact CB-CB 4.38Å; R976-E993 IonicContact CZ-OE1 2.71Å; R976-E993 IonicContact CZ-OE2 3.75Å; R976-E993 PolarHBondContact N-O 2.75Å; R976-E993 IonicContact NE-OE1 3.62Å; R976-E993 IonicContact NE-OE2 3.89Å; R976-E993 PolarHBondContact NE-OE2 2.86Å; R976-E993 IonicContact NH2-OE1 3.34Å; R976-E993 PolarHBondContact NH2-OE1 3.3Å; R976-E993 IonicContact NH2-OE2 2.84Å; R976-E993 PolarHBondContact NH2-OE2 2.78Å; R976-E993 PolarHBondContact O-N 2.75Å
994	Y	87.7	Confident	74.5	Confident	54 Å²	54	77.3 Å²	77.3	21%	0.212	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	148.4	178.4	72.8	-87.7	0	0	0	111.5	M974 V996 T1003 L1006 E1007 F1010	M974-Y994 CarbonylContact O-C 3.41Å; M974-Y994 WeakPolarHBondContact O-CA 3.47Å; Y994-V996 HydrophobicContact CD2-CG2 4.28Å; Y994-V996 HydrophobicContact CE2-CG2 4.27Å; Y994-T1003 PolarHBondContact OH-O 2.92Å; Y994-L1006 HydrophobicContact CD2-CB 4.48Å; Y994-L1006 HydrophobicContact CD2-CD1 4.21Å; Y994-L1006 HydrophobicContact CE1-CB 4.31Å; Y994-L1006 HydrophobicContact CE2-CB 3.8Å; Y994-L1006 HydrophobicContact CE2-CD1 3.82Å; Y994-L1006 HydrophobicContact CE2-CG 4.45Å; Y994-E1007 HydrophobicContact CE1-CG 4.12Å; Y994-E1007 WeakPolarHBondContact OH-CG 3.27Å; Y994-F1010 AromaticContact CD1-CD2 3.3Å; Y994-F1010 HydrophobicContact CD1-CD2 3.3Å; Y994-F1010 AromaticContact CD1-CE2 3.63Å; Y994-F1010 HydrophobicContact CD1-CE2 3.63Å; Y994-F1010 HydrophobicContact CD1-CG 4.23Å; Y994-F1010 HydrophobicContact CD2-CE2 4.33Å; Y994-F1010 AromaticContact CE1-CD2 3.78Å; Y994-F1010 HydrophobicContact CE1-CD2 3.78Å; Y994-F1010 HydrophobicContact CE1-CE2 4.36Å; Y994-F1010 AromaticContact CG-CD2 3.83Å; Y994-F1010 HydrophobicContact CG-CD2 3.83Å; Y994-F1010 AromaticContact CG-CE2 3.62Å; Y994-F1010 HydrophobicContact CG-CE2 3.62Å
995	E	84.5	Confident	75.4	Confident	113 Å²	113	79.8 Å²	79.8	53%	0.528	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.1	176	-172.6	-173.9	177	0	0	109	I973 M974 L997	I973-E995 WeakPolarHBondContact CA-O 3.43Å; M974-E995 HydrophobicContact CB-CB 4.43Å; M974-E995 PolarHBondContact N-O 3.39Å; M974-E995 PolarHBondContact O-N 2.98Å; E995-L997 HydrophobicContact CG-CD2 4.13Å; E995-L997 PolarHBondContact O-N 2.82Å
996	V	84.7	Confident	76.6	Confident	43 Å²	43	75.4 Å²	75.4	26%	0.261	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	102.6	175.1	-176.4	0	0	0	0	108.6	Y994 L1001 L1006	Y994-V996 HydrophobicContact CD2-CG2 4.28Å; Y994-V996 HydrophobicContact CE2-CG2 4.27Å; V996-L1001 HydrophobicContact CG1-CD1 4.33Å; V996-L1006 HydrophobicContact CG2-CD1 3.85Å
997	L	83.6	Confident	77.9	Confident	68 Å²	68	76.1 Å²	76.1	36%	0.356	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-28.2	-179.7	-61	176	0	0	0	112.7	R972 M974 E995	R972-L997 HydrophobicContact CB-CB 4.11Å; R972-L997 HydrophobicContact CG-CB 4.14Å; R972-L997 HydrophobicContact CG-CD1 4.12Å; R972-L997 PolarHBondContact O-N 3.33Å; M974-L997 HydrophobicContact CB-CD1 4.24Å; M974-L997 HydrophobicContact CB-CG 4.48Å; M974-L997 HydrophobicContact CE-CD1 3.92Å; M974-L997 HydrophobicContact CE-CD2 4.22Å; E995-L997 HydrophobicContact CG-CD2 4.13Å; E995-L997 PolarHBondContact O-N 2.82Å
998	R	78.6	Confident	79.3	Confident	166 Å²	166	77.4 Å²	77.4	63%	0.626	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.7	141.4	-179.6	-173.4	179.8	173.6	-174.3	-2.5	110.5	Y971 R972	Y971-R998 CarbonylContact C-O 3.46Å; Y971-R998 WeakPolarHBondContact CA-O 3.45Å; Y971-R998 WeakPolarHBondContact CB-O 3.4Å; R972-R998 HydrophobicContact CB-CB 3.72Å; R972-R998 PolarHBondContact N-O 2.95Å; R972-R998 PolarHBondContact O-N 2.86Å; R972-R998 VanDerWaalsContact O-N 3.11Å
999	G	77.1	Confident	80.5	Confident	30 Å²	30	77 Å²	77	31%	0.309	39%	0.389	S	S	.	.	S	Bend	trans	105.5	153.4	175.1	0	0	0	0	0	112.9	L1001	G999-L1001 VanDerWaalsContact C-N 3.32Å; G999-L1001 PolarHBondContact O-N 2.77Å
1000	N	77.1	Confident	81.5	Confident	178 Å²	178	71.9 Å²	71.9	95%	0.952	37%	0.365	S	S	*	.			trans	-93	62.6	179.2	-68.8	-10.9	0	0	0	110.4
1001	L	78	Confident	81.8	Confident	27 Å²	27	79.2 Å²	79.2	14%	0.141	39%	0.394	C	S	.	.			trans	-81.4	137.1	175.7	-65.7	172.8	0	0	0	109.8	Y971 I973 V996 G999 T1003 L1006 L1031 I1035	Y971-L1001 HydrophobicContact CD2-CD1 4.06Å; Y971-L1001 HydrophobicContact CG-CD1 3.94Å; Y971-L1001 HydrophobicContact CG-CD2 4.48Å; I973-L1001 HydrophobicContact CD1-CD1 3.3Å; I973-L1001 HydrophobicContact CG1-CD1 3.59Å; V996-L1001 HydrophobicContact CG1-CD1 4.33Å; G999-L1001 VanDerWaalsContact C-N 3.32Å; G999-L1001 PolarHBondContact O-N 2.77Å; L1001-T1003 PolarHBondContact O-N 2.78Å; L1001-T1003 VanDerWaalsContact O-N 3.11Å; L1001-L1006 HydrophobicContact CB-CD1 3.98Å; L1001-L1006 HydrophobicContact CD1-CD1 4.3Å; L1001-L1031 HydrophobicContact CD1-CD2 4.04Å; L1001-L1031 HydrophobicContact CD2-CD2 3.65Å; L1001-L1031 HydrophobicContact CG-CD2 4.41Å; L1001-I1035 HydrophobicContact CD2-CD1 4.25Å; L1001-I1035 HydrophobicContact CD2-CG1 4.39Å
1002	S	77	Confident	81.6	Confident	57 Å²	57	82.1 Å²	82.1	40%	0.399	41%	0.41	S	S	.	.			trans	-66.6	111	174.8	55.4	0	0	0	0	109.9	E1004 K1005 L1006	S1002-E1004 PolarHBondContact O-N 3.36Å; S1002-K1005 PolarHBondContact O-N 2.8Å; S1002-K1005 VanDerWaalsContact OG-CB 3.31Å; S1002-K1005 WeakPolarHBondContact OG-CB 3.36Å; S1002-K1005 WeakPolarHBondContact OG-CD 2.83Å; S1002-K1005 VanDerWaalsContact OG-CG 3.28Å; S1002-K1005 WeakPolarHBondContact OG-CG 3.34Å; S1002-L1006 PolarHBondContact O-N 2.93Å
1003	T	78.7	Confident	81.3	Confident	79 Å²	79	81.7 Å²	81.7	49%	0.485	41%	0.408	S	S	.	.	H	α-helix	trans	-58.5	-36.4	176.8	49.5	0	0	0	0	111.7	Y994 L1001 K1005 L1006 E1007	Y994-T1003 PolarHBondContact OH-O 2.92Å; L1001-T1003 PolarHBondContact O-N 2.78Å; L1001-T1003 VanDerWaalsContact O-N 3.11Å; T1003-K1005 PolarHBondContact O-N 2.91Å; T1003-L1006 PolarHBondContact O-N 2.85Å; T1003-E1007 WeakPolarHBondContact O-CB 3.43Å; T1003-E1007 PolarHBondContact O-N 2.98Å
1004	E	81.1	Confident	81	Confident	156 Å²	156	83.5 Å²	83.5	73%	0.729	41%	0.414	S	S	*	.	H	α-helix	trans	-59.3	-46	178.1	-65.9	178.7	178.7	0	0	112.9	S1002 E1007 E1008	S1002-E1004 PolarHBondContact O-N 3.36Å; E1004-E1007 PolarHBondContact O-N 2.79Å; E1004-E1008 PolarHBondContact O-N 2.7Å
1005	K	80.2	Confident	80.5	Confident	95 Å²	95	80.9 Å²	80.9	41%	0.413	40%	0.404	S	S	.	.	H	α-helix	trans	-69.1	-35	178.2	-65.1	-171.2	-178.1	178.8	0	112.5	S1002 T1003 E1008 Y1009 F1030 T1034	S1002-K1005 PolarHBondContact O-N 2.8Å; S1002-K1005 VanDerWaalsContact OG-CB 3.31Å; S1002-K1005 WeakPolarHBondContact OG-CB 3.36Å; S1002-K1005 WeakPolarHBondContact OG-CD 2.83Å; S1002-K1005 VanDerWaalsContact OG-CG 3.28Å; S1002-K1005 WeakPolarHBondContact OG-CG 3.34Å; T1003-K1005 PolarHBondContact O-N 2.91Å; K1005-E1008 PolarHBondContact O-N 2.89Å; K1005-Y1009 WeakPolarHBondContact O-CB 3.03Å; K1005-Y1009 PolarHBondContact O-N 2.77Å; K1005-F1030 HydrophobicContact CB-CE1 4.2Å; K1005-F1030 HydrophobicContact CB-CZ 4.06Å; K1005-T1034 HydrophobicContact CD-CG2 4.03Å
1006	L	83.5	Confident	80.3	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	39%	0.39	C	S	.	.	H	α-helix	trans	-67.2	-44.1	175.1	-77.6	173	0	0	0	110.9	I973 Y994 V996 L1001 S1002 T1003 E1008 Y1009 F1010 L1027 L1031	I973-L1006 HydrophobicContact CD1-CD1 4.39Å; I973-L1006 HydrophobicContact CD1-CD2 4.36Å; Y994-L1006 HydrophobicContact CD2-CB 4.48Å; Y994-L1006 HydrophobicContact CD2-CD1 4.21Å; Y994-L1006 HydrophobicContact CE1-CB 4.31Å; Y994-L1006 HydrophobicContact CE2-CB 3.8Å; Y994-L1006 HydrophobicContact CE2-CD1 3.82Å; Y994-L1006 HydrophobicContact CE2-CG 4.45Å; V996-L1006 HydrophobicContact CG2-CD1 3.85Å; L1001-L1006 HydrophobicContact CB-CD1 3.98Å; L1001-L1006 HydrophobicContact CD1-CD1 4.3Å; S1002-L1006 PolarHBondContact O-N 2.93Å; T1003-L1006 PolarHBondContact O-N 2.85Å; L1006-E1008 VanDerWaalsContact C-N 3.33Å; L1006-E1008 PolarHBondContact O-N 3.21Å; L1006-Y1009 PolarHBondContact O-N 3.2Å; L1006-F1010 HydrophobicContact CB-CD2 4.49Å; L1006-F1010 HydrophobicContact CD2-CE2 4.15Å; L1006-F1010 WeakPolarHBondContact O-CD2 3.46Å; L1006-F1010 PolarHBondContact O-N 3.24Å; L1006-L1027 HydrophobicContact CD2-CD1 3.75Å; L1006-L1031 HydrophobicContact CD2-CD2 4.06Å
1007	E	84.3	Confident	79.8	Confident	90 Å²	90	75.6 Å²	75.6	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-58.6	-43.3	172.4	-97.8	175.7	-140	0	0	112	Y994 T1003 E1004 K1011	Y994-E1007 HydrophobicContact CE1-CG 4.12Å; Y994-E1007 WeakPolarHBondContact OH-CG 3.27Å; T1003-E1007 WeakPolarHBondContact O-CB 3.43Å; T1003-E1007 PolarHBondContact O-N 2.98Å; E1004-E1007 PolarHBondContact O-N 2.79Å; E1007-K1011 VanDerWaalsContact O-CB 3.26Å; E1007-K1011 WeakPolarHBondContact O-CB 3.29Å; E1007-K1011 WeakPolarHBondContact O-CG 3.44Å; E1007-K1011 PolarHBondContact O-N 3.12Å; E1007-K1011 IonicContact OE2-NZ 3.85Å
1008	E	82.2	Confident	79.5	Confident	133 Å²	133	73.6 Å²	73.6	62%	0.621	38%	0.375	S	S	*	.	H	α-helix	trans	-60.9	-46.8	175.7	-172.4	179.3	-174.8	0	0	111.6	E1004 K1005 L1006 K1011	E1004-E1008 PolarHBondContact O-N 2.7Å; K1005-E1008 PolarHBondContact O-N 2.89Å; L1006-E1008 VanDerWaalsContact C-N 3.33Å; L1006-E1008 PolarHBondContact O-N 3.21Å; E1008-K1011 PolarHBondContact O-N 3.42Å
1009	Y	83.9	Confident	79.5	Confident	33 Å²	33	67.8 Å²	67.8	13%	0.129	36%	0.357	C	S	.	.	H	α-helix	trans	-59.5	-53.4	176.6	178.9	-98.8	0	0	0	111.6	K1005 L1006 K1011 T1012 C1013 I1023 N1026 L1027 F1030	K1005-Y1009 WeakPolarHBondContact O-CB 3.03Å; K1005-Y1009 PolarHBondContact O-N 2.77Å; L1006-Y1009 PolarHBondContact O-N 3.2Å; Y1009-K1011 VanDerWaalsContact C-N 3.33Å; Y1009-K1011 PolarHBondContact O-N 2.91Å; Y1009-T1012 PolarHBondContact O-N 3.45Å; Y1009-T1012 VanDerWaalsContact O-N 3.12Å; Y1009-T1012 PolarHBondContact O-OG1 2.79Å; Y1009-C1013 VanDerWaalsContact CE1-SG 3.54Å; Y1009-C1013 PolarHBondContact O-N 3.24Å; Y1009-C1013 PolarHBondContact O-SG 2.78Å; Y1009-I1023 HydrophobicContact CE1-CG2 4.4Å; Y1009-I1023 PolarHBondContact OH-O 3.46Å; Y1009-N1026 WeakPolarHBondContact OH-CB 3.47Å; Y1009-L1027 HydrophobicContact CD1-CD1 3.75Å; Y1009-L1027 HydrophobicContact CE1-CB 3.81Å; Y1009-L1027 HydrophobicContact CE1-CD1 3.79Å; Y1009-L1027 HydrophobicContact CE1-CG 4.38Å; Y1009-L1027 PolarHBondContact OH-N 3.11Å; Y1009-L1027 VanDerWaalsContact OH-N 3.12Å; Y1009-F1030 HydrophobicContact CD2-CD1 4.47Å; Y1009-F1030 HydrophobicContact CD2-CD2 4.44Å; Y1009-F1030 HydrophobicContact CD2-CG 4.24Å; Y1009-F1030 HydrophobicContact CG-CD1 4.5Å
1010	F	85.2	Confident	79.7	Confident	14 Å²	14	66.3 Å²	66.3	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-26	-177.3	-71.3	-59.5	0	0	0	113.6	V975 V992 Y994 L1006 T1012 C1013 L1027	V975-F1010 HydrophobicContact CG1-CE1 3.93Å; V975-F1010 HydrophobicContact CG1-CZ 4.04Å; V975-F1010 HydrophobicContact CG2-CE1 4.42Å; V975-F1010 HydrophobicContact CG2-CZ 3.77Å; V992-F1010 HydrophobicContact CB-CD1 4.2Å; V992-F1010 HydrophobicContact CG1-CD1 3.52Å; V992-F1010 HydrophobicContact CG1-CE1 3.77Å; V992-F1010 HydrophobicContact CG1-CG 4.13Å; Y994-F1010 AromaticContact CD1-CD2 3.3Å; Y994-F1010 HydrophobicContact CD1-CD2 3.3Å; Y994-F1010 AromaticContact CD1-CE2 3.63Å; Y994-F1010 HydrophobicContact CD1-CE2 3.63Å; Y994-F1010 HydrophobicContact CD1-CG 4.23Å; Y994-F1010 HydrophobicContact CD2-CE2 4.33Å; Y994-F1010 AromaticContact CE1-CD2 3.78Å; Y994-F1010 HydrophobicContact CE1-CD2 3.78Å; Y994-F1010 HydrophobicContact CE1-CE2 4.36Å; Y994-F1010 AromaticContact CG-CD2 3.83Å; Y994-F1010 HydrophobicContact CG-CD2 3.83Å; Y994-F1010 AromaticContact CG-CE2 3.62Å; Y994-F1010 HydrophobicContact CG-CE2 3.62Å; L1006-F1010 HydrophobicContact CB-CD2 4.49Å; L1006-F1010 HydrophobicContact CD2-CE2 4.15Å; L1006-F1010 WeakPolarHBondContact O-CD2 3.46Å; L1006-F1010 PolarHBondContact O-N 3.24Å; F1010-T1012 PolarHBondContact O-N 3.49Å; F1010-C1013 PolarHBondContact O-N 3.37Å; F1010-C1013 VanDerWaalsContact O-N 3.14Å; F1010-L1027 HydrophobicContact CE1-CD2 4.35Å; F1010-L1027 HydrophobicContact CE2-CD1 4.27Å; F1010-L1027 HydrophobicContact CZ-CD1 3.89Å; F1010-L1027 HydrophobicContact CZ-CD2 3.7Å; F1010-L1027 HydrophobicContact CZ-CG 4.4Å
1011	K	78.7	Confident	79.9	Confident	164 Å²	164	61.4 Å²	61.4	71%	0.713	31%	0.311	S	S	*	.	H	α-helix	trans	-60.3	-29.9	170.8	-85.4	171.7	-175.1	166.1	0	112.8	E1007 E1008 Y1009	E1007-K1011 VanDerWaalsContact O-CB 3.26Å; E1007-K1011 WeakPolarHBondContact O-CB 3.29Å; E1007-K1011 WeakPolarHBondContact O-CG 3.44Å; E1007-K1011 PolarHBondContact O-N 3.12Å; E1007-K1011 IonicContact OE2-NZ 3.85Å; E1008-K1011 PolarHBondContact O-N 3.42Å; Y1009-K1011 VanDerWaalsContact C-N 3.33Å; Y1009-K1011 PolarHBondContact O-N 2.91Å
1012	T	77.5	Confident	80	Confident	106 Å²	106	62.7 Å²	62.7	65%	0.65	32%	0.322	S	S	*	.	H	α-helix	trans	-87.1	-16.9	177.3	66.6	0	0	0	0	113.3	Y1009 F1010	Y1009-T1012 PolarHBondContact O-N 3.45Å; Y1009-T1012 VanDerWaalsContact O-N 3.12Å; Y1009-T1012 PolarHBondContact O-OG1 2.79Å; F1010-T1012 PolarHBondContact O-N 3.49Å
1013	C	78.9	Confident	80.2	Confident	21 Å²	21	60.6 Å²	60.6	14%	0.142	31%	0.306	C	S	.	.			trans	-79	124.3	-178.1	-66.2	0	0	0	0	110.6	V992 Y1009 F1010 P1015 I1023	V992-C1013 HydrophobicContact CG2-CB 4.48Å; Y1009-C1013 VanDerWaalsContact CE1-SG 3.54Å; Y1009-C1013 PolarHBondContact O-N 3.24Å; Y1009-C1013 PolarHBondContact O-SG 2.78Å; F1010-C1013 PolarHBondContact O-N 3.37Å; F1010-C1013 VanDerWaalsContact O-N 3.14Å; C1013-P1015 WeakPolarHBondContact O-CD 3.21Å; C1013-I1023 HydrophobicContact CB-CD1 4.41Å; C1013-I1023 HydrophobicContact CB-CG2 4.26Å
1014	K	78.1	Confident	80.3	Confident	124 Å²	124	56.8 Å²	56.8	54%	0.539	28%	0.283	S	S	.	.			trans	-108.9	95.1	170.4	-67.8	-178.8	-179.2	179.2	0	108.8	Q989 T1016 N1019	Q989-K1014 HydrophobicContact CG-CD 4.28Å; Q989-K1014 HydrophobicContact CG-CG 4.43Å; K1014-T1016 PolarHBondContact O-N 3.33Å; K1014-N1019 PolarHBondContact O-ND2 2.99Å
1015	P	78.7	Confident	80.2	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.26	C	S	.	.			trans	-71	131.5	-178.2	31.9	-37.6	0	0	0	110.8	F977 L979 G990 V992 C1013 L1020 I1023	F977-P1015 HydrophobicContact CD1-CB 3.48Å; F977-P1015 VanDerWaalsContact CD1-CB 3.48Å; F977-P1015 HydrophobicContact CD1-CG 4.12Å; F977-P1015 HydrophobicContact CE1-CB 4.04Å; F977-P1015 HydrophobicContact CG-CB 4.38Å; L979-P1015 HydrophobicContact CD2-CB 4.28Å; G990-P1015 VanDerWaalsContact C-CG 3.41Å; G990-P1015 PolarHBondContact N-O 3.48Å; G990-P1015 VanDerWaalsContact O-CD 3.28Å; G990-P1015 WeakPolarHBondContact O-CD 3.47Å; G990-P1015 VanDerWaalsContact O-CG 3.26Å; G990-P1015 WeakPolarHBondContact O-CG 3.3Å; V992-P1015 HydrophobicContact CG2-CB 4.13Å; V992-P1015 HydrophobicContact CG2-CG 3.55Å; C1013-P1015 WeakPolarHBondContact O-CD 3.21Å; P1015-L1020 HydrophobicContact CB-CD2 3.96Å; P1015-I1023 HydrophobicContact CB-CD1 4.13Å
1016	T	79.1	Confident	80.1	Confident	37 Å²	37	50 Å²	50	23%	0.227	26%	0.259	C	S	.	.			trans	-142.7	163.5	173	60.7	0	0	0	0	109	K1014 G1018 N1019	K1014-T1016 PolarHBondContact O-N 3.33Å; T1016-G1018 PolarHBondContact O-N 3.36Å; T1016-N1019 PolarHBondContact N-OD1 2.81Å; T1016-N1019 PolarHBondContact O-N 2.75Å; T1016-N1019 PolarHBondContact O-OD1 3.35Å; T1016-N1019 PolarHBondContact OG1-ND2 3.26Å
1017	C	74.6	Confident	80	Confident	7 Å²	7	50 Å²	50	5%	0.047	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	126.4	167.3	-61.6	0	0	0	0	109.4	V868 L982	V868-C1017 HydrophobicContact CG1-CB 4.09Å; L982-C1017 PolarHBondContact O-SG 3.28Å
1018	G	76.4	Confident	79.5	Confident	26 Å²	26	49.5 Å²	49.5	27%	0.268	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-4.3	178.4	0	0	0	0	0	115.3	D872 T1016	D872-G1018 VanDerWaalsContact OD2-C 3.26Å; D872-G1018 WeakPolarHBondContact OD2-CA 3.24Å; D872-G1018 PolarHBondContact OD2-N 2.89Å; T1016-G1018 PolarHBondContact O-N 3.36Å
1019	N	79.9	Confident	79.2	Confident	44 Å²	44	48.1 Å²	48.1	24%	0.235	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	0.7	177.3	78.7	5.5	0	0	0	114.8	D872 K1014 T1016 Y1021 S1022 I1023	D872-N1019 PolarHBondContact OD2-N 2.94Å; D872-N1019 VanDerWaalsContact OD2-N 3.13Å; K1014-N1019 PolarHBondContact O-ND2 2.99Å; T1016-N1019 PolarHBondContact N-OD1 2.81Å; T1016-N1019 PolarHBondContact O-N 2.75Å; T1016-N1019 PolarHBondContact O-OD1 3.35Å; T1016-N1019 PolarHBondContact OG1-ND2 3.26Å; N1019-Y1021 VanDerWaalsContact C-N 3.34Å; N1019-Y1021 PolarHBondContact O-N 3.46Å; N1019-S1022 WeakPolarHBondContact O-CB 3.43Å; N1019-S1022 PolarHBondContact O-N 3.35Å; N1019-S1022 VanDerWaalsContact O-N 3.17Å; N1019-I1023 WeakPolarHBondContact O-CG1 3.49Å; N1019-I1023 PolarHBondContact O-N 3.44Å; N1019-I1023 WeakPolarHBondContact OD1-CD1 3.5Å
1020	L	81.1	Confident	78.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-41.4	-174.1	-60.5	175.6	0	0	0	111.6	L869 D872 L876 I962 F977 P1015 S1022 I1023 I1024	L869-L1020 HydrophobicContact CD1-CD1 4.04Å; D872-L1020 HydrophobicContact CB-CB 4.28Å; D872-L1020 HydrophobicContact CB-CD1 4.43Å; D872-L1020 WeakPolarHBondContact OD2-CB 3.41Å; D872-L1020 PolarHBondContact OD2-N 2.74Å; D872-L1020 VanDerWaalsContact OD2-N 3.07Å; L876-L1020 HydrophobicContact CD1-CB 4.33Å; I962-L1020 HydrophobicContact CD1-CD1 3.45Å; I962-L1020 VanDerWaalsContact CD1-CD1 3.45Å; F977-L1020 HydrophobicContact CB-CD2 4.17Å; F977-L1020 HydrophobicContact CD1-CD2 3.87Å; F977-L1020 HydrophobicContact CD2-CD2 3.99Å; F977-L1020 HydrophobicContact CE1-CD2 4.21Å; F977-L1020 HydrophobicContact CE2-CD2 4.31Å; F977-L1020 HydrophobicContact CG-CD2 3.74Å; F977-L1020 HydrophobicContact CZ-CD2 4.41Å; P1015-L1020 HydrophobicContact CB-CD2 3.96Å; L1020-S1022 VanDerWaalsContact C-N 3.34Å; L1020-S1022 PolarHBondContact O-N 3.07Å; L1020-I1023 PolarHBondContact O-N 3.37Å; L1020-I1024 WeakPolarHBondContact O-CG1 3.37Å; L1020-I1024 PolarHBondContact O-N 2.76Å; L1020-I1024 VanDerWaalsContact O-N 3.12Å
1021	Y	81.1	Confident	78.3	Confident	74 Å²	74	48.9 Å²	48.9	29%	0.29	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.8	177.4	-104.6	0	0	0	111.8	C875 L876 A879 N1019 I1023 I1024 S1025	C875-Y1021 HydrophobicContact CB-CD1 4.41Å; C875-Y1021 HydrophobicContact CB-CD2 3.66Å; C875-Y1021 HydrophobicContact CB-CE2 4.18Å; C875-Y1021 HydrophobicContact CB-CG 3.79Å; L876-Y1021 HydrophobicContact CD2-CD2 4.06Å; L876-Y1021 HydrophobicContact CG-CD2 4.27Å; A879-Y1021 HydrophobicContact CB-CE2 3.92Å; N1019-Y1021 VanDerWaalsContact C-N 3.34Å; N1019-Y1021 PolarHBondContact O-N 3.46Å; Y1021-I1023 PolarHBondContact O-N 2.96Å; Y1021-I1024 PolarHBondContact O-N 3.04Å; Y1021-S1025 VanDerWaalsContact O-CB 3.24Å; Y1021-S1025 WeakPolarHBondContact O-CB 3.27Å; Y1021-S1025 PolarHBondContact O-N 2.81Å
1022	S	79.9	Confident	77.8	Confident	55 Å²	55	44.5 Å²	44.5	39%	0.385	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-45.1	178	-176.7	0	0	0	0	111.3	N1019 L1020 I1024 S1025 N1026	N1019-S1022 WeakPolarHBondContact O-CB 3.43Å; N1019-S1022 PolarHBondContact O-N 3.35Å; N1019-S1022 VanDerWaalsContact O-N 3.17Å; L1020-S1022 VanDerWaalsContact C-N 3.34Å; L1020-S1022 PolarHBondContact O-N 3.07Å; S1022-I1024 VanDerWaalsContact C-N 3.35Å; S1022-I1024 PolarHBondContact O-N 2.75Å; S1022-S1025 PolarHBondContact O-N 3.16Å; S1022-N1026 VanDerWaalsContact O-CB 3.23Å; S1022-N1026 WeakPolarHBondContact O-CB 3.4Å; S1022-N1026 VanDerWaalsContact O-CG 3.22Å; S1022-N1026 PolarHBondContact O-N 2.77Å; S1022-N1026 PolarHBondContact O-ND2 3.48Å; S1022-N1026 PolarHBondContact OG-ND2 2.97Å
1023	I	81.7	Confident	77.2	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.062	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-44.2	178.1	-66.4	167.6	0	0	0	111.3	F977 Y1009 C1013 P1015 N1019 L1020 Y1021 L1027	F977-I1023 HydrophobicContact CE1-CD1 4.34Å; F977-I1023 HydrophobicContact CE1-CG2 4.01Å; F977-I1023 HydrophobicContact CZ-CB 4.44Å; F977-I1023 HydrophobicContact CZ-CG2 3.99Å; Y1009-I1023 HydrophobicContact CE1-CG2 4.4Å; Y1009-I1023 PolarHBondContact OH-O 3.46Å; C1013-I1023 HydrophobicContact CB-CD1 4.41Å; C1013-I1023 HydrophobicContact CB-CG2 4.26Å; P1015-I1023 HydrophobicContact CB-CD1 4.13Å; N1019-I1023 WeakPolarHBondContact O-CG1 3.49Å; N1019-I1023 PolarHBondContact O-N 3.44Å; N1019-I1023 WeakPolarHBondContact OD1-CD1 3.5Å; L1020-I1023 PolarHBondContact O-N 3.37Å; Y1021-I1023 PolarHBondContact O-N 2.96Å; I1023-L1027 WeakPolarHBondContact O-CB 3.39Å; I1023-L1027 PolarHBondContact O-N 3.4Å
1024	I	81.1	Confident	76	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-74.2	-40	-179	-64.9	-64.6	0	0	0	112	L876 Y881 V964 V966 V975 F977 L1020 Y1021 S1022 L1027 Q1028	L876-I1024 HydrophobicContact CD2-CB 3.69Å; L876-I1024 HydrophobicContact CD2-CG1 3.84Å; L876-I1024 HydrophobicContact CD2-CG2 3.85Å; Y881-I1024 HydrophobicContact CD1-CG2 4.37Å; Y881-I1024 HydrophobicContact CD2-CG2 3.98Å; Y881-I1024 HydrophobicContact CE1-CG2 4.06Å; Y881-I1024 HydrophobicContact CE2-CG2 3.62Å; Y881-I1024 HydrophobicContact CG-CG2 4.35Å; V964-I1024 HydrophobicContact CB-CD1 4.19Å; V964-I1024 HydrophobicContact CB-CG1 4.46Å; V964-I1024 HydrophobicContact CG1-CD1 4.11Å; V964-I1024 HydrophobicContact CG1-CG1 4.14Å; V964-I1024 HydrophobicContact CG1-CG2 4.23Å; V964-I1024 HydrophobicContact CG2-CG1 4.49Å; V966-I1024 HydrophobicContact CG2-CG2 3.9Å; V975-I1024 HydrophobicContact CB-CD1 4.05Å; V975-I1024 HydrophobicContact CG1-CD1 4.13Å; V975-I1024 HydrophobicContact CG2-CD1 4.09Å; F977-I1024 HydrophobicContact CE2-CD1 3.79Å; F977-I1024 HydrophobicContact CE2-CG1 3.91Å; F977-I1024 HydrophobicContact CZ-CD1 3.69Å; F977-I1024 HydrophobicContact CZ-CG1 3.92Å; L1020-I1024 WeakPolarHBondContact O-CG1 3.37Å; L1020-I1024 PolarHBondContact O-N 2.76Å; L1020-I1024 VanDerWaalsContact O-N 3.12Å; Y1021-I1024 PolarHBondContact O-N 3.04Å; S1022-I1024 VanDerWaalsContact C-N 3.35Å; S1022-I1024 PolarHBondContact O-N 2.75Å; I1024-L1027 HydrophobicContact CD1-CD2 4.38Å; I1024-L1027 WeakPolarHBondContact O-CB 3.34Å; I1024-L1027 PolarHBondContact O-N 2.82Å; I1024-Q1028 PolarHBondContact O-N 2.83Å
1025	S	77.6	Confident	74.6	Confident	35 Å²	35	45.2 Å²	45.2	25%	0.245	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-45.4	176.1	-174	0	0	0	0	111	Y1021 S1022 L1027 Q1028 L1029	Y1021-S1025 VanDerWaalsContact O-CB 3.24Å; Y1021-S1025 WeakPolarHBondContact O-CB 3.27Å; Y1021-S1025 PolarHBondContact O-N 2.81Å; S1022-S1025 PolarHBondContact O-N 3.16Å; S1025-L1027 VanDerWaalsContact C-N 3.33Å; S1025-L1027 PolarHBondContact O-N 3.35Å; S1025-Q1028 WeakPolarHBondContact O-CB 3.39Å; S1025-Q1028 PolarHBondContact O-N 3.34Å; S1025-Q1028 VanDerWaalsContact O-N 3.17Å; S1025-L1029 PolarHBondContact O-N 3.11Å
1026	N	79.6	Confident	74.3	Confident	74 Å²	74	47.5 Å²	47.5	40%	0.396	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-34.2	175.2	-72.3	-22.2	0	0	0	112.3	Y1009 S1022 Q1028 L1029 F1030	Y1009-N1026 WeakPolarHBondContact OH-CB 3.47Å; S1022-N1026 VanDerWaalsContact O-CB 3.23Å; S1022-N1026 WeakPolarHBondContact O-CB 3.4Å; S1022-N1026 VanDerWaalsContact O-CG 3.22Å; S1022-N1026 PolarHBondContact O-N 2.77Å; S1022-N1026 PolarHBondContact O-ND2 3.48Å; S1022-N1026 PolarHBondContact OG-ND2 2.97Å; N1026-Q1028 VanDerWaalsContact C-N 3.32Å; N1026-Q1028 PolarHBondContact O-N 2.94Å; N1026-L1029 PolarHBondContact O-N 3.48Å; N1026-F1030 VanDerWaalsContact O-CB 3.26Å; N1026-F1030 WeakPolarHBondContact O-CB 3.44Å; N1026-F1030 PolarHBondContact O-N 3.11Å
1027	L	80.7	Confident	74.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-42.2	172.6	177.7	69.8	0	0	0	110.8	V975 L1006 Y1009 F1010 I1023 I1024 S1025 F1030 L1031	V975-L1027 HydrophobicContact CG2-CD2 3.94Å; L1006-L1027 HydrophobicContact CD2-CD1 3.75Å; Y1009-L1027 HydrophobicContact CD1-CD1 3.75Å; Y1009-L1027 HydrophobicContact CE1-CB 3.81Å; Y1009-L1027 HydrophobicContact CE1-CD1 3.79Å; Y1009-L1027 HydrophobicContact CE1-CG 4.38Å; Y1009-L1027 PolarHBondContact OH-N 3.11Å; Y1009-L1027 VanDerWaalsContact OH-N 3.12Å; F1010-L1027 HydrophobicContact CE1-CD2 4.35Å; F1010-L1027 HydrophobicContact CE2-CD1 4.27Å; F1010-L1027 HydrophobicContact CZ-CD1 3.89Å; F1010-L1027 HydrophobicContact CZ-CD2 3.7Å; F1010-L1027 HydrophobicContact CZ-CG 4.4Å; I1023-L1027 WeakPolarHBondContact O-CB 3.39Å; I1023-L1027 PolarHBondContact O-N 3.4Å; I1024-L1027 HydrophobicContact CD1-CD2 4.38Å; I1024-L1027 WeakPolarHBondContact O-CB 3.34Å; I1024-L1027 PolarHBondContact O-N 2.82Å; S1025-L1027 VanDerWaalsContact C-N 3.33Å; S1025-L1027 PolarHBondContact O-N 3.35Å; L1027-F1030 PolarHBondContact O-N 2.74Å; L1027-L1031 HydrophobicContact CD1-CD1 3.98Å; L1027-L1031 HydrophobicContact CD1-CG 4.24Å; L1027-L1031 HydrophobicContact CD2-CD1 4.47Å; L1027-L1031 HydrophobicContact CG-CD1 3.82Å; L1027-L1031 HydrophobicContact CG-CG 4.43Å; L1027-L1031 WeakPolarHBondContact O-CB 3.23Å; L1027-L1031 WeakPolarHBondContact O-CG 3.4Å; L1027-L1031 PolarHBondContact O-N 3.35Å
1028	Q	74.4	Confident	74.1	Confident	80 Å²	80	50.3 Å²	50.3	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-42.1	176.3	-178.3	172.1	-27.8	0	0	111.8	Y881 I1024 S1025 N1026 L1031 S1032	Y881-Q1028 PolarHBondContact OH-OE1 3.07Å; I1024-Q1028 PolarHBondContact O-N 2.83Å; S1025-Q1028 WeakPolarHBondContact O-CB 3.39Å; S1025-Q1028 PolarHBondContact O-N 3.34Å; S1025-Q1028 VanDerWaalsContact O-N 3.17Å; N1026-Q1028 VanDerWaalsContact C-N 3.32Å; N1026-Q1028 PolarHBondContact O-N 2.94Å; Q1028-L1031 PolarHBondContact O-N 3.24Å; Q1028-S1032 WeakPolarHBondContact O-CB 3.23Å; Q1028-S1032 PolarHBondContact O-N 2.77Å; Q1028-S1032 PolarHBondContact O-OG 3.01Å
1029	L	75.3	Confident	73.9	Confident	105 Å²	105	51.8 Å²	51.8	55%	0.55	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-48	173.5	-71.1	172.8	0	0	0	111.5	S1025 N1026 L1031 S1032 S1033	S1025-L1029 PolarHBondContact O-N 3.11Å; N1026-L1029 PolarHBondContact O-N 3.48Å; L1029-L1031 PolarHBondContact O-N 3.3Å; L1029-S1032 WeakPolarHBondContact CA-OG 3.37Å; L1029-S1032 PolarHBondContact O-N 3.07Å; L1029-S1032 PolarHBondContact O-OG 2.97Å; L1029-S1033 PolarHBondContact O-N 3.45Å
1030	F	77.5	Confident	73.6	Confident	59 Å²	59	52.3 Å²	52.3	26%	0.259	29%	0.292	S	S	.	.	H	α-helix	trans	-57.2	-46.8	177.8	-179.9	-103.4	0	0	0	111.9	K1005 Y1009 N1026 L1027 S1033 T1034	K1005-F1030 HydrophobicContact CB-CE1 4.2Å; K1005-F1030 HydrophobicContact CB-CZ 4.06Å; Y1009-F1030 HydrophobicContact CD2-CD1 4.47Å; Y1009-F1030 HydrophobicContact CD2-CD2 4.44Å; Y1009-F1030 HydrophobicContact CD2-CG 4.24Å; Y1009-F1030 HydrophobicContact CG-CD1 4.5Å; N1026-F1030 VanDerWaalsContact O-CB 3.26Å; N1026-F1030 WeakPolarHBondContact O-CB 3.44Å; N1026-F1030 PolarHBondContact O-N 3.11Å; L1027-F1030 PolarHBondContact O-N 2.74Å; F1030-S1033 PolarHBondContact O-N 3.17Å; F1030-S1033 PolarHBondContact O-OG 3.41Å; F1030-T1034 HydrophobicContact CZ-CG2 4.5Å; F1030-T1034 PolarHBondContact O-N 2.77Å; F1030-T1034 PolarHBondContact O-OG1 3.01Å
1031	L	72.7	Confident	73	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-67.6	-36.1	177.5	-70.1	169.8	0	0	0	112.9	Y971 I973 L1001 L1006 L1027 Q1028 L1029 S1033 T1034 I1035	Y971-L1031 HydrophobicContact CD2-CD1 4.29Å; Y971-L1031 HydrophobicContact CE1-CB 4.16Å; Y971-L1031 HydrophobicContact CE2-CD1 3.55Å; I973-L1031 HydrophobicContact CD1-CD1 3.43Å; I973-L1031 VanDerWaalsContact CD1-CD1 3.43Å; I973-L1031 HydrophobicContact CD1-CD2 4.42Å; L1001-L1031 HydrophobicContact CD1-CD2 4.04Å; L1001-L1031 HydrophobicContact CD2-CD2 3.65Å; L1001-L1031 HydrophobicContact CG-CD2 4.41Å; L1006-L1031 HydrophobicContact CD2-CD2 4.06Å; L1027-L1031 HydrophobicContact CD1-CD1 3.98Å; L1027-L1031 HydrophobicContact CD1-CG 4.24Å; L1027-L1031 HydrophobicContact CD2-CD1 4.47Å; L1027-L1031 HydrophobicContact CG-CD1 3.82Å; L1027-L1031 HydrophobicContact CG-CG 4.43Å; L1027-L1031 WeakPolarHBondContact O-CB 3.23Å; L1027-L1031 WeakPolarHBondContact O-CG 3.4Å; L1027-L1031 PolarHBondContact O-N 3.35Å; Q1028-L1031 PolarHBondContact O-N 3.24Å; L1029-L1031 PolarHBondContact O-N 3.3Å; L1031-S1033 PolarHBondContact O-N 2.74Å; L1031-T1034 WeakPolarHBondContact CA-OG1 3.45Å; L1031-T1034 PolarHBondContact O-N 3.18Å; L1031-T1034 PolarHBondContact O-OG1 3.42Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.39Å; L1031-I1035 PolarHBondContact O-N 2.86Å
1032	S	68.7	Low	72.5	Confident	73 Å²	73	54.4 Å²	54.4	51%	0.51	31%	0.313	S	S	.	.	H	α-helix	trans	-67.7	-23.6	174.3	71.6	0	0	0	0	113.6	Q1028 L1029	Q1028-S1032 WeakPolarHBondContact O-CB 3.23Å; Q1028-S1032 PolarHBondContact O-N 2.77Å; Q1028-S1032 PolarHBondContact O-OG 3.01Å; L1029-S1032 WeakPolarHBondContact CA-OG 3.37Å; L1029-S1032 PolarHBondContact O-N 3.07Å; L1029-S1032 PolarHBondContact O-OG 2.97Å
1033	S	63.2	Low	71.9	Confident	90 Å²	90	54.4 Å²	54.4	63%	0.629	31%	0.307	S	S	*	.	H	α-helix	trans	-86.5	-17.7	175.4	74.8	0	0	0	0	114	L1029 F1030 L1031	L1029-S1033 PolarHBondContact O-N 3.45Å; F1030-S1033 PolarHBondContact O-N 3.17Å; F1030-S1033 PolarHBondContact O-OG 3.41Å; L1031-S1033 PolarHBondContact O-N 2.74Å
1034	T	54.9	Low	71.1	Confident	54 Å²	54	57.9 Å²	57.9	33%	0.331	33%	0.328	S	S	.	.	H	α-helix	trans	-103	-15.3	-175.2	34.6	0	0	0	0	114.4	K1005 F1030 L1031	K1005-T1034 HydrophobicContact CD-CG2 4.03Å; F1030-T1034 HydrophobicContact CZ-CG2 4.5Å; F1030-T1034 PolarHBondContact O-N 2.77Å; F1030-T1034 PolarHBondContact O-OG1 3.01Å; L1031-T1034 WeakPolarHBondContact CA-OG1 3.45Å; L1031-T1034 PolarHBondContact O-N 3.18Å; L1031-T1034 PolarHBondContact O-OG1 3.42Å
1035	I	47.4	Very low	70.2	Confident	122 Å²	122	63.2 Å²	63.2	63%	0.626	36%	0.358	S	S	*	.			trans	-93.4	0	168.4	-60.2	168.1	0	0	0	108.3	N970 Y971 L1001 L1031	N970-I1035 HydrophobicContact CB-CD1 4.5Å; Y971-I1035 HydrophobicContact CD1-CD1 3.37Å; Y971-I1035 HydrophobicContact CE1-CD1 3.45Å; Y971-I1035 VanDerWaalsContact CE1-CD1 3.45Å; L1001-I1035 HydrophobicContact CD2-CD1 4.25Å; L1001-I1035 HydrophobicContact CD2-CG1 4.39Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.39Å; L1031-I1035 PolarHBondContact O-N 2.86Å

Retrieved 1,035 of 1,035 residues in 144.4 ms (Link to these results)

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