A0A3Q0KRT0_SCHMA Loading...

CST complex subunit CTC1

AlphaFold DB , UniProt , Accession A0A3Q0KRT0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,477 aa.

						>A0A3Q0KRT0_SCHMA|A0A3Q0KRT0
MSCAVDIYDSGPHFKWITRNSIDMNGERSRINNDGIGYNQFLDSIRFTIQDLVQQESCIGSSNYPVDKPSRLVQIECRKPGCRCVLKNERALAMKIVPGITLVQAEWLLPNSVVSNGEKSRSHHSSQHAVNNTSNNKVAYNQSVPIVNQMKSSYSHSVVLTSCCPSWFELVRRNVIGPSDNGPQICPEVPVWSSCKAVWLAKPKFILLRKDTQCLFATNTQSLTMSSTELLKKDDRSTITLDADNIGILRPGTVLQLIDCRSCRLVHKEDQISYRLSARHRSKPVSMLQCAIVGGKALAALASSITNLSSQDALNWFNNGPRLVYLSLASKSIMCSPVKTTSTININTNYRNHNKNSSHIKLPGNETDYNIFDNGVHSILSLLSTYRLPLITRPVVGLHSSEWFLMGKYTNHSSISNSDSINMHSLLQIFSCHHGDLIFLEPLSDCTKSIYQNESSNEGIKSRFFVVTTDMLLHHNFLVADSQTCQAYQQQLEIHAFRVSHFLAACHPVQGLTYIIKHLEDITHSSNTGPSYIPLTRTLGPITSRFNTIAIQSAISSIAAIASLTMHEELNDIPNDSYQLNEIQSKILNHLTLYNHNNPISTTTTTTTNTTTTTTYYHNSSIHNPMHRSSIDNHHFYHSANCLTNTNLHTQSSLSSSLFTSEMDEMNALCDEIEDIYYYVRNGHFPMQSHSLSSLLHHSQKQQKQPHPHHHHHEGKNTYLNHLSAPISPYLNKFVTNTTDTTNNTADITTNNRCLSTKTTNNKLLNNECPIKTNHLIDNKIINIPMKITSKAPVLLIRPKPYHDYGCYGINENERKEITQLTSTVISTNQQTTTITTSTTTTHNNNSNVYGMNYGNYVFPETSVATKSCHQSIQPLSSIRNDHDKLQVSSHTFTPITTINNNNHNNNSTSRIDSSMAFTPFVYSSTTCHESFPHFTTTTATTTTYECERVNFTVPSLVRTNGTGYYSTQNITKLDTNNHNSNAISCTYSVNHSVQQPIHSMDKQSSYSGMLSSYCSYLPGLATKTTTTCCSHGINHSLKPLFTTSALNISSSKQNCIYHRNENKTEECIYDEPKEEYDSISTPLRQRQPQQQPQQQHKTICNVSNYSTYDYGYSLSSPKHHDRHHLSLSSSHIHPSISSRPMYERDHSVGNVWNSSFSVNNHNNNKTTNVSNTTNINKSSTAFHSISNMFNDKVTSAVNCIQIIPSNVIPFSTITNVTTSTTTTTTISKNNNNVGHYFTSQDQPSCMTTSFRHQSAQNSSSSIQQPPSMPLLYPLPVSTNHTSRLYQSTIISPSIDRKQIIPRPSYKQVTPTTNFDFSMHHYHNHSTIPSPLSTMLLLQSPKLKRTELTNSSPDTGIGIESTYDQQTTTCTGGSFTPLNTYHHSLSSSNMAVWSPSQHHCQQFNRQDSMTTPSTMNNHSISYDSSPDKHFNSCKLTTFPVQNNHLDLITTTTIITTTTTTTTHNHISSRNQQYAYQF
					

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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	28.6	Very low	31.1	Very low	240 Å²	240	135.3 Å²	135.3	100%	1.182	78%	0.776	S	S	*	*				0	127.8	0	-70.5	165.2	116.4	0	0	107.5	C3	M1-C3 PolarHBondContact O-N 2.99Å
2	S	26	Very low	33.2	Very low	122 Å²	122	130.1 Å²	130.1	85%	0.853	75%	0.751	S	S	*	*			trans	-84.9	99.5	175	47.9	0	0	0	0	109.4	A4	S2-A4 PolarHBondContact O-N 2.97Å; S2-A4 VanDerWaalsContact O-N 3.07Å
3	C	26.7	Very low	35.9	Very low	118 Å²	118	133.8 Å²	133.8	80%	0.797	76%	0.757	S	S	*	*			trans	-67.9	102.1	160.9	-64.1	0	0	0	0	106.9	M1 V5	M1-C3 PolarHBondContact O-N 2.99Å; C3-V5 PolarHBondContact O-N 2.96Å
4	A	28.8	Very low	39.1	Very low	88 Å²	88	127.1 Å²	127.1	73%	0.727	72%	0.715	S	S	*	*			trans	-60.3	122.4	168.6	0	0	0	0	0	107.4	S2	S2-A4 PolarHBondContact O-N 2.97Å; S2-A4 VanDerWaalsContact O-N 3.07Å
5	V	32	Very low	42	Very low	131 Å²	131	125.9 Å²	125.9	79%	0.794	70%	0.699	S	S	*	*			trans	-73.9	126.8	172.2	176.8	0	0	0	0	106.9	C3 I7	C3-V5 PolarHBondContact O-N 2.96Å; V5-I7 PolarHBondContact O-N 3.32Å
6	D	28.4	Very low	44.9	Very low	155 Å²	155	120.1 Å²	120.1	83%	0.829	66%	0.663	S	S	*	*			trans	-60.8	106.1	-174.9	-66.5	-68.7	0	0	0	111.9	Y8	D6-Y8 PolarHBondContact O-N 3.22Å
7	I	30.8	Very low	47.2	Very low	154 Å²	154	116.8 Å²	116.8	79%	0.79	64%	0.643	S	S	*	*			trans	-81.5	87.6	165.8	-57.9	164.8	0	0	0	106.9	V5	V5-I7 PolarHBondContact O-N 3.32Å
8	Y	27.5	Very low	49.1	Very low	233 Å²	233	112.2 Å²	112.2	91%	0.914	62%	0.619	S	S	*	*			trans	-166.7	63.1	153.5	-82.4	-52.7	0	0	0	110.9	D6	D6-Y8 PolarHBondContact O-N 3.22Å
9	D	35.2	Very low	50.2	Low	97 Å²	97	114.9 Å²	114.9	52%	0.519	62%	0.619	S	S	.	*			trans	-123.6	99.2	165.7	-175	8.4	0	0	0	108	G11 R90	D9-G11 PolarHBondContact O-N 3.05Å; D9-R90 IonicContact OD2-CZ 3.26Å; D9-R90 IonicContact OD2-NH1 3.66Å; D9-R90 PolarHBondContact OD2-NH1 3.49Å; D9-R90 IonicContact OD2-NH2 3.81Å; D9-R90 PolarHBondContact OD2-NH2 3.39Å
10	S	34.5	Very low	50.5	Low	126 Å²	126	114.4 Å²	114.4	88%	0.881	62%	0.616	S	S	*	*			trans	-78	44.2	-172.8	62.8	0	0	0	0	112.7
11	G	44.2	Very low	50.1	Low	24 Å²	24	114.5 Å²	114.5	25%	0.247	63%	0.625	C	S	.	*			trans	-77.3	175.4	174	0	0	0	0	0	112.8	D9 H13	D9-G11 PolarHBondContact O-N 3.05Å; G11-H13 PolarHBondContact O-N 3.02Å
12	P	55.8	Low	50.5	Low	73 Å²	73	109.7 Å²	109.7	47%	0.474	60%	0.603	S	S	.	*			trans	-61.7	116.5	177.5	25	-34.6	0	0	0	112.2	F14 Y488	P12-F14 HydrophobicContact CB-CE1 4.06Å; P12-F14 HydrophobicContact CB-CE2 4.15Å; P12-F14 HydrophobicContact CB-CZ 3.8Å; P12-F14 HydrophobicContact CG-CE1 4.23Å; P12-F14 HydrophobicContact CG-CE2 3.68Å; P12-F14 HydrophobicContact CG-CZ 3.48Å; P12-F14 VanDerWaalsContact CG-CZ 3.48Å; P12-F14 WeakPolarHBondContact O-CD2 3.48Å; P12-F14 PolarHBondContact O-N 3.36Å; P12-Y488 WeakPolarHBondContact CB-OH 3.39Å
13	H	67.8	Low	50.9	Low	179 Å²	179	110.6 Å²	110.6	83%	0.829	60%	0.598	S	S	*	*			trans	-73.7	87.3	172.3	-75.7	-72.3	0	0	0	111	G11	G11-H13 PolarHBondContact O-N 3.02Å
14	F	80.9	Confident	51.2	Low	40 Å²	40	113 Å²	113	18%	0.175	60%	0.6	C	S	.	*			trans	-67.9	130.7	171.8	-55	-68.2	0	0	0	111.2	P12 W16 L72 A91 L443 T484 Y488	P12-F14 HydrophobicContact CB-CE1 4.06Å; P12-F14 HydrophobicContact CB-CE2 4.15Å; P12-F14 HydrophobicContact CB-CZ 3.8Å; P12-F14 HydrophobicContact CG-CE1 4.23Å; P12-F14 HydrophobicContact CG-CE2 3.68Å; P12-F14 HydrophobicContact CG-CZ 3.48Å; P12-F14 VanDerWaalsContact CG-CZ 3.48Å; P12-F14 WeakPolarHBondContact O-CD2 3.48Å; P12-F14 PolarHBondContact O-N 3.36Å; F14-W16 HydrophobicContact CB-CH2 4.07Å; F14-W16 HydrophobicContact CB-CZ2 3.54Å; F14-W16 HydrophobicContact CD2-CZ2 4.33Å; F14-W16 HydrophobicContact CG-CH2 4.43Å; F14-W16 HydrophobicContact CG-CZ2 4.11Å; F14-L72 HydrophobicContact CD1-CD2 3.88Å; F14-L72 HydrophobicContact CE1-CD2 4.17Å; F14-A91 HydrophobicContact CD1-CB 4.49Å; F14-A91 HydrophobicContact CD2-CB 4.02Å; F14-A91 HydrophobicContact CE1-CB 4Å; F14-A91 HydrophobicContact CE2-CB 3.47Å; F14-A91 VanDerWaalsContact CE2-CB 3.47Å; F14-A91 HydrophobicContact CG-CB 4.5Å; F14-A91 HydrophobicContact CZ-CB 3.45Å; F14-A91 VanDerWaalsContact CZ-CB 3.45Å; F14-L443 HydrophobicContact CE1-CD2 3.78Å; F14-L443 HydrophobicContact CZ-CD2 3.92Å; F14-T484 HydrophobicContact CB-CG2 4.36Å; F14-T484 HydrophobicContact CD1-CG2 4.02Å; F14-Y488 HydrophobicContact CD1-CD2 4.27Å; F14-Y488 AromaticContact CD1-CE2 3.77Å; F14-Y488 HydrophobicContact CD1-CE2 3.77Å; F14-Y488 HydrophobicContact CE1-CD2 4.02Å; F14-Y488 HydrophobicContact CE1-CE1 4.43Å; F14-Y488 AromaticContact CE1-CE2 3.55Å; F14-Y488 HydrophobicContact CE1-CE2 3.55Å; F14-Y488 AromaticContact CE1-CZ 3.81Å
15	K	83.5	Confident	51.5	Low	108 Å²	108	116.1 Å²	116.1	47%	0.47	60%	0.604	S	S	.	*			trans	-106	115.3	176.8	-179.7	170.2	165.3	-112.1	0	109.9	D481 Q483 T484	K15-D481 WeakPolarHBondContact CD-OD2 3.43Å; K15-D481 WeakPolarHBondContact CE-OD2 3.38Å; K15-D481 IonicContact NZ-OD2 3.37Å; K15-D481 PolarHBondContact NZ-OD2 2.78Å; K15-D481 PolarHBondContact O-N 2.96Å; K15-Q483 VanDerWaalsContact NZ-OE1 3.1Å; K15-T484 WeakPolarHBondContact CB-OG1 3.43Å; K15-T484 PolarHBondContact N-OG1 2.94Å; K15-T484 PolarHBondContact O-OG1 3.13Å
16	W	87.5	Confident	51.5	Low	34 Å²	34	112.4 Å²	112.4	13%	0.129	59%	0.592	C	S	.	*	B	Isolated β-bridge	trans	-87.1	155.7	-178.2	-52.3	110.4	0	0	0	111.4	F14 Q74 L478 A480	F14-W16 HydrophobicContact CB-CH2 4.07Å; F14-W16 HydrophobicContact CB-CZ2 3.54Å; F14-W16 HydrophobicContact CD2-CZ2 4.33Å; F14-W16 HydrophobicContact CG-CH2 4.43Å; F14-W16 HydrophobicContact CG-CZ2 4.11Å; W16-Q74 HydrophobicContact CH2-CB 3.61Å; W16-Q74 HydrophobicContact CZ2-CB 3.54Å; W16-Q74 HydrophobicContact CZ2-CG 4.45Å; W16-Q74 HydrophobicContact CZ3-CB 4.17Å; W16-L478 HydrophobicContact CB-CB 4.43Å; W16-L478 HydrophobicContact CD2-CB 4.01Å; W16-L478 HydrophobicContact CE3-CB 3.99Å; W16-L478 HydrophobicContact CG-CB 4.17Å; W16-L478 HydrophobicContact CG-CD1 4.37Å; W16-A480 HydrophobicContact CE3-CB 3.95Å; W16-A480 HydrophobicContact CZ3-CB 3.77Å
17	I	84.7	Confident	51.5	Low	64 Å²	64	113.5 Å²	113.5	33%	0.328	59%	0.593	S	S	.	*			trans	-68.6	131.3	173.5	-61.3	171	0	0	0	108.9	S44 I45 V479 D481	I17-S44 CarbonylContact O-C 3.51Å; I17-S44 WeakPolarHBondContact O-CA 3.34Å; I17-I45 HydrophobicContact CG2-CD1 3.83Å; I17-I45 HydrophobicContact CG2-CG1 4.25Å; I17-I45 PolarHBondContact O-N 2.79Å; I17-V479 HydrophobicContact CD1-CB 4.22Å; I17-V479 HydrophobicContact CD1-CG1 4.08Å; I17-V479 WeakPolarHBondContact CG1-O 3.35Å; I17-V479 PolarHBondContact N-O 3.46Å; I17-D481 HydrophobicContact CG1-CB 4.23Å
18	T	81.4	Confident	51.6	Low	33 Å²	33	118.8 Å²	118.8	20%	0.202	60%	0.603	C	S	.	*	B	Isolated β-bridge	trans	-122.7	158.5	-177.5	61.2	0	0	0	0	110.8	N20 L42 D43	T18-N20 VanDerWaalsContact C-N 3.28Å; T18-N20 PolarHBondContact O-N 2.93Å; T18-L42 HydrophobicContact CG2-CB 3.68Å; T18-L42 WeakPolarHBondContact CG2-O 3.42Å; T18-D43 WeakPolarHBondContact CA-O 3.48Å
19	R	70.5	Confident	51.8	Low	165 Å²	165	111.3 Å²	111.3	62%	0.623	58%	0.584	S	S	*	*	S	Bend	trans	-65	-24	-173	-72.7	-178.2	168.4	147.9	-7.6	115.4	D43 I45	R19-D43 PolarHBondContact N-O 2.79Å; R19-D43 VanDerWaalsContact N-O 3.1Å; R19-D43 IonicContact NH1-OD2 3.16Å; R19-D43 PolarHBondContact NH1-OD2 3.2Å; R19-I45 HydrophobicContact CG-CD1 4.36Å; R19-I45 HydrophobicContact CG-CG1 3.89Å
20	N	55.6	Low	51.7	Low	104 Å²	104	118.1 Å²	118.1	56%	0.556	60%	0.603	S	S	*	*			trans	-109.7	49.2	-162.6	-65	5.2	0	0	0	113.2	T18 I22 L42	T18-N20 VanDerWaalsContact C-N 3.28Å; T18-N20 PolarHBondContact O-N 2.93Å; N20-I22 PolarHBondContact O-N 3.17Å; N20-L42 HydrophobicContact CB-CD2 4.47Å
21	S	41.8	Very low	51.6	Low	116 Å²	116	119.9 Å²	119.9	81%	0.811	60%	0.601	S	S	*	*			trans	-78.4	61.4	171.2	66.6	0	0	0	0	111.9
22	I	37.6	Very low	51	Low	139 Å²	139	125.8 Å²	125.8	71%	0.713	63%	0.627	S	S	*	*			trans	-107.1	125.5	167.2	-61.4	176.7	0	0	0	106.7	N20 M24	N20-I22 PolarHBondContact O-N 3.17Å; I22-M24 PolarHBondContact O-N 3.05Å
23	D	33.4	Very low	49.9	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	65%	0.646	S	S	*	*			trans	-64.3	103.7	179.3	-81.8	-55	0	0	0	111.1	N25	D23-N25 PolarHBondContact O-N 3.25Å
24	M	33.7	Very low	48.1	Very low	169 Å²	169	128.9 Å²	128.9	83%	0.833	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	46.9	173.4	-73.6	-71.4	-168	0	0	112.6	I22	I22-M24 PolarHBondContact O-N 3.05Å
25	N	34.5	Very low	45.7	Very low	153 Å²	153	131 Å²	131	82%	0.818	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-0.3	171	-80.1	-43.4	0	0	0	112.6	D23	D23-N25 PolarHBondContact O-N 3.25Å
26	G	31.2	Very low	43.2	Very low	53 Å²	53	132.1 Å²	132.1	55%	0.546	69%	0.688	S	S	.	*	S	Bend	trans	-83.4	151.4	163.4	0	0	0	0	0	112.2
27	E	30	Very low	40.5	Very low	178 Å²	178	133.1 Å²	133.1	83%	0.832	71%	0.709	S	S	*	*			trans	59.7	57.3	162.3	-54.5	-161.3	154.6	0	0	117.8	S29	E27-S29 PolarHBondContact O-N 3.48Å
28	R	31.7	Very low	38	Very low	265 Å²	265	141.4 Å²	141.4	100%	1	74%	0.738	S	S	*	*			trans	-66.1	70.3	149	-92	-170.2	170.3	-172.7	-0.6	110.8
29	S	32.8	Very low	35.7	Very low	76 Å²	76	146 Å²	146	53%	0.531	76%	0.761	S	S	.	*			trans	-145.2	87.8	-178.2	42.5	0	0	0	0	113.8	E27	E27-S29 PolarHBondContact O-N 3.48Å
30	R	31.9	Very low	34.1	Very low	240 Å²	240	145 Å²	145	91%	0.906	76%	0.763	S	S	*	*			trans	53.6	78	153.9	-57.5	179.8	179.9	179.5	-0.6	116.9
31	I	34	Very low	33.4	Very low	164 Å²	164	148 Å²	148	84%	0.841	77%	0.772	S	S	*	*			trans	-111.8	132.9	143.4	-60.9	-178.9	0	0	0	106.8
32	N	30	Very low	33.8	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	76%	0.758	S	S	*	*			trans	-77.6	168.6	-173.1	-74.4	-30.5	0	0	0	112.2	D34	N32-D34 PolarHBondContact O-N 2.81Å
33	N	33.1	Very low	35.2	Very low	166 Å²	166	144.4 Å²	144.4	89%	0.888	75%	0.745	S	S	*	*			trans	-58.1	102.9	175.8	-63.8	-27.8	0	0	0	111.9
34	D	30.8	Very low	37.3	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	72%	0.719	S	S	*	*			trans	-141.9	148.1	152.3	-97.7	-48.8	0	0	0	109.1	N32 I36	N32-D34 PolarHBondContact O-N 2.81Å; D34-I36 VanDerWaalsContact C-N 3.32Å; D34-I36 PolarHBondContact O-N 3.04Å
35	G	30.1	Very low	39.8	Very low	85 Å²	85	133.3 Å²	133.3	88%	0.876	69%	0.69	S	S	*	*			trans	-75.2	61.9	-158.2	0	0	0	0	0	116.8	G37	G35-G37 PolarHBondContact O-N 2.84Å
36	I	31.3	Very low	42.3	Very low	132 Å²	132	131.9 Å²	131.9	68%	0.677	67%	0.673	S	S	*	*			trans	-68.5	102.5	170.9	-57.3	177.8	0	0	0	108.9	D34	D34-I36 VanDerWaalsContact C-N 3.32Å; D34-I36 PolarHBondContact O-N 3.04Å
37	G	30.6	Very low	45.1	Very low	54 Å²	54	130.8 Å²	130.8	56%	0.557	65%	0.654	S	S	*	*			trans	-62.7	138.5	179.5	0	0	0	0	0	112.4	G35 N39	G35-G37 PolarHBondContact O-N 2.84Å; G37-N39 PolarHBondContact O-N 3.02Å
38	Y	31.1	Very low	48	Very low	238 Å²	238	124 Å²	124	93%	0.933	62%	0.624	S	S	*	*	S	Bend	trans	-68.8	26.6	-178.9	-89.7	-91.6	0	0	0	115.2	Q40	Y38-Q40 VanDerWaalsContact C-N 3.35Å
39	N	33	Very low	50.7	Low	129 Å²	129	111.5 Å²	111.5	69%	0.69	58%	0.577	S	S	*	*			trans	-99.3	44.2	169.8	-74.6	-14.7	0	0	0	111.1	G37 F41	G37-N39 PolarHBondContact O-N 3.02Å; N39-F41 HydrophobicContact CB-CD2 4.09Å; N39-F41 HydrophobicContact CB-CE2 3.85Å; N39-F41 WeakPolarHBondContact O-CD2 3.33Å; N39-F41 PolarHBondContact O-N 3.4Å
40	Q	37.4	Very low	53.3	Low	144 Å²	144	113.8 Å²	113.8	67%	0.673	58%	0.58	S	S	*	*			trans	-66.6	82.1	148.7	-74.6	-169.2	3.8	0	0	107.1	Y38 L42	Y38-Q40 VanDerWaalsContact C-N 3.35Å; Q40-L42 PolarHBondContact O-N 3.08Å
41	F	41.5	Very low	56	Low	169 Å²	169	105.4 Å²	105.4	74%	0.741	55%	0.553	S	S	*	*			trans	-54.8	109.6	169	-77.9	-87.7	0	0	0	107.3	N39 D43	N39-F41 HydrophobicContact CB-CD2 4.09Å; N39-F41 HydrophobicContact CB-CE2 3.85Å; N39-F41 WeakPolarHBondContact O-CD2 3.33Å; N39-F41 PolarHBondContact O-N 3.4Å; F41-D43 VanDerWaalsContact C-N 3.35Å; F41-D43 PolarHBondContact O-N 3Å
42	L	49.4	Very low	58.6	Low	100 Å²	100	97.6 Å²	97.6	52%	0.524	51%	0.513	S	S	.	.			trans	-67.3	98.8	176.8	-68.9	171.9	0	0	0	107.5	T18 N20 Q40 S44	T18-L42 HydrophobicContact CG2-CB 3.68Å; T18-L42 WeakPolarHBondContact CG2-O 3.42Å; N20-L42 HydrophobicContact CB-CD2 4.47Å; Q40-L42 PolarHBondContact O-N 3.08Å; L42-S44 PolarHBondContact O-N 2.88Å
43	D	67.7	Low	61.2	Low	79 Å²	79	91.5 Å²	91.5	42%	0.422	48%	0.481	S	S	.	.			trans	-60	103.7	-172.8	-129.3	9.2	0	0	0	109.6	T18 R19 F41	T18-D43 WeakPolarHBondContact CA-O 3.48Å; R19-D43 PolarHBondContact N-O 2.79Å; R19-D43 VanDerWaalsContact N-O 3.1Å; R19-D43 IonicContact NH1-OD2 3.16Å; R19-D43 PolarHBondContact NH1-OD2 3.2Å; F41-D43 VanDerWaalsContact C-N 3.35Å; F41-D43 PolarHBondContact O-N 3Å
44	S	77.9	Confident	63.6	Low	30 Å²	30	89.5 Å²	89.5	21%	0.21	47%	0.466	C	S	.	.	B	Isolated β-bridge	trans	-63.6	133.8	179.6	-60.4	0	0	0	0	110.1	I17 L42 R46	I17-S44 CarbonylContact O-C 3.51Å; I17-S44 WeakPolarHBondContact O-CA 3.34Å; L42-S44 PolarHBondContact O-N 2.88Å; S44-R46 PolarHBondContact O-N 2.99Å; S44-R46 VanDerWaalsContact O-N 3.09Å
45	I	85.6	Confident	66	Low	46 Å²	46	85.2 Å²	85.2	24%	0.236	44%	0.441	C	S	.	.			trans	-71	112	-176.8	-52.2	-173.3	0	0	0	108.8	I17 R19 F47	I17-I45 HydrophobicContact CG2-CD1 3.83Å; I17-I45 HydrophobicContact CG2-CG1 4.25Å; I17-I45 PolarHBondContact O-N 2.79Å; R19-I45 HydrophobicContact CG-CD1 4.36Å; R19-I45 HydrophobicContact CG-CG1 3.89Å; I45-F47 HydrophobicContact CB-CE2 3.8Å; I45-F47 HydrophobicContact CB-CZ 3.91Å; I45-F47 HydrophobicContact CG2-CD1 4.29Å; I45-F47 HydrophobicContact CG2-CD2 4.18Å; I45-F47 HydrophobicContact CG2-CE1 3.77Å; I45-F47 HydrophobicContact CG2-CE2 3.65Å; I45-F47 HydrophobicContact CG2-CG 4.49Å; I45-F47 HydrophobicContact CG2-CZ 3.43Å; I45-F47 VanDerWaalsContact CG2-CZ 3.43Å; I45-F47 WeakPolarHBondContact O-CD2 3.37Å; I45-F47 WeakPolarHBondContact O-CE2 3.43Å
46	R	87.4	Confident	68.3	Low	123 Å²	123	81.9 Å²	81.9	46%	0.464	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	109	172.6	-72	171.4	172.5	101.3	9.4	109.2	S44 E76 N476 L478	S44-R46 PolarHBondContact O-N 2.99Å; S44-R46 VanDerWaalsContact O-N 3.09Å; R46-E76 WeakPolarHBondContact CD-OE2 3.24Å; R46-E76 IonicContact CZ-OE1 2.82Å; R46-E76 IonicContact CZ-OE2 3.71Å; R46-E76 IonicContact NE-OE1 3.59Å; R46-E76 PolarHBondContact NE-OE1 3.38Å; R46-E76 IonicContact NE-OE2 3.48Å; R46-E76 PolarHBondContact NE-OE2 2.79Å; R46-E76 IonicContact NH2-OE1 3.33Å; R46-E76 PolarHBondContact NH2-OE1 2.8Å; R46-E76 IonicContact NH2-OE2 2.68Å; R46-N476 HydrophobicContact CB-CB 4.08Å; R46-N476 HydrophobicContact CG-CB 4.17Å; R46-L478 HydrophobicContact CG-CD2 3.67Å
47	F	89.7	Confident	70.1	Confident	31 Å²	31	79.2 Å²	79.2	14%	0.136	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	147.7	171.4	-58.5	-85.6	0	0	0	110.3	I45 D51 L52 N476 F477 V479	I45-F47 HydrophobicContact CB-CE2 3.8Å; I45-F47 HydrophobicContact CB-CZ 3.91Å; I45-F47 HydrophobicContact CG2-CD1 4.29Å; I45-F47 HydrophobicContact CG2-CD2 4.18Å; I45-F47 HydrophobicContact CG2-CE1 3.77Å; I45-F47 HydrophobicContact CG2-CE2 3.65Å; I45-F47 HydrophobicContact CG2-CG 4.49Å; I45-F47 HydrophobicContact CG2-CZ 3.43Å; I45-F47 VanDerWaalsContact CG2-CZ 3.43Å; I45-F47 WeakPolarHBondContact O-CD2 3.37Å; I45-F47 WeakPolarHBondContact O-CE2 3.43Å; F47-D51 HydrophobicContact CB-CB 4.41Å; F47-D51 HydrophobicContact CD1-CB 4.33Å; F47-L52 HydrophobicContact CB-CD1 4.28Å; F47-L52 HydrophobicContact CB-CD2 4.03Å; F47-L52 HydrophobicContact CB-CG 3.9Å; F47-L52 HydrophobicContact CG-CD2 4.21Å; F47-N476 WeakPolarHBondContact O-CA 3.39Å; F47-F477 PolarHBondContact N-O 3.43Å; F47-F477 PolarHBondContact O-N 2.98Å; F47-V479 HydrophobicContact CD2-CB 4.32Å; F47-V479 HydrophobicContact CD2-CG2 3.67Å; F47-V479 HydrophobicContact CE2-CB 4.12Å; F47-V479 HydrophobicContact CE2-CG2 3.93Å
48	T	90.5	Very high	71.5	Confident	35 Å²	35	81.2 Å²	81.2	22%	0.215	40%	0.4	C	S	.	.			trans	-82.5	165.8	161.5	74.9	0	0	0	0	110.1	Q50 D51 L52	T48-Q50 PolarHBondContact O-N 3.24Å; T48-Q50 PolarHBondContact OG1-N 2.81Å; T48-D51 WeakPolarHBondContact CA-OD2 3.43Å; T48-D51 VanDerWaalsContact CB-OD2 3.23Å; T48-D51 WeakPolarHBondContact CB-OD2 3.37Å; T48-D51 WeakPolarHBondContact CG2-OD2 3.39Å; T48-D51 PolarHBondContact N-OD2 3.41Å; T48-D51 PolarHBondContact O-N 2.89Å; T48-D51 PolarHBondContact OG1-N 2.96Å; T48-D51 VanDerWaalsContact OG1-N 3.15Å; T48-D51 PolarHBondContact OG1-OD2 2.94Å; T48-L52 WeakPolarHBondContact O-CG 3.33Å; T48-L52 PolarHBondContact O-N 2.95Å
49	I	89.3	Confident	72.7	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-65.6	-29.8	174.2	-165.8	57.1	0	0	0	112.5	L52 V53 I96 I438 L472 F477	I49-L52 HydrophobicContact CD1-CD1 4.31Å; I49-L52 PolarHBondContact O-N 2.88Å; I49-V53 WeakPolarHBondContact O-CG2 3.48Å; I49-V53 PolarHBondContact O-N 3.13Å; I49-I96 HydrophobicContact CD1-CD1 4.04Å; I49-I438 HydrophobicContact CD1-CD1 3.71Å; I49-I438 HydrophobicContact CD1-CG1 4.26Å; I49-I438 HydrophobicContact CD1-CG2 4.47Å; I49-I438 HydrophobicContact CG1-CD1 3.55Å; I49-L472 HydrophobicContact CB-CB 4.17Å; I49-L472 HydrophobicContact CD1-CD1 4.18Å; I49-L472 HydrophobicContact CG1-CB 4.16Å; I49-L472 HydrophobicContact CG1-CD1 4.22Å; I49-L472 HydrophobicContact CG2-CB 4.17Å; I49-F477 HydrophobicContact CB-CE2 3.87Å; I49-F477 HydrophobicContact CB-CZ 4.39Å; I49-F477 HydrophobicContact CD1-CE1 4.46Å; I49-F477 HydrophobicContact CD1-CE2 4.2Å; I49-F477 HydrophobicContact CD1-CZ 4.03Å
50	Q	88	Confident	73.4	Confident	124 Å²	124	69.8 Å²	69.8	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-67.9	-42	176.2	-71	177	-23.1	0	0	111.5	T48 L52 V53 Q54	T48-Q50 PolarHBondContact O-N 3.24Å; T48-Q50 PolarHBondContact OG1-N 2.81Å; Q50-L52 VanDerWaalsContact C-N 3.26Å; Q50-L52 PolarHBondContact O-N 3.09Å; Q50-V53 PolarHBondContact O-N 3.45Å; Q50-Q54 WeakPolarHBondContact O-CB 3.43Å; Q50-Q54 PolarHBondContact O-N 2.96Å
51	D	88.1	Confident	73.8	Confident	64 Å²	64	69.4 Å²	69.4	34%	0.342	38%	0.377	S	S	.	.	H	α-helix	trans	-59.8	-39.5	174.3	-54.1	-55.8	0	0	0	111.4	F47 T48 Q55	F47-D51 HydrophobicContact CB-CB 4.41Å; F47-D51 HydrophobicContact CD1-CB 4.33Å; T48-D51 WeakPolarHBondContact CA-OD2 3.43Å; T48-D51 VanDerWaalsContact CB-OD2 3.23Å; T48-D51 WeakPolarHBondContact CB-OD2 3.37Å; T48-D51 WeakPolarHBondContact CG2-OD2 3.39Å; T48-D51 PolarHBondContact N-OD2 3.41Å; T48-D51 PolarHBondContact O-N 2.89Å; T48-D51 PolarHBondContact OG1-N 2.96Å; T48-D51 VanDerWaalsContact OG1-N 3.15Å; T48-D51 PolarHBondContact OG1-OD2 2.94Å; D51-Q55 WeakPolarHBondContact O-CB 3.41Å; D51-Q55 WeakPolarHBondContact O-CG 3.27Å; D51-Q55 PolarHBondContact O-N 3.33Å
52	L	88.5	Confident	73.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-71.5	-40.7	-179.5	-68	168	0	0	0	112.4	F47 T48 I49 Q50 E56 M94 I96 F477 V479	F47-L52 HydrophobicContact CB-CD1 4.28Å; F47-L52 HydrophobicContact CB-CD2 4.03Å; F47-L52 HydrophobicContact CB-CG 3.9Å; F47-L52 HydrophobicContact CG-CD2 4.21Å; T48-L52 WeakPolarHBondContact O-CG 3.33Å; T48-L52 PolarHBondContact O-N 2.95Å; I49-L52 HydrophobicContact CD1-CD1 4.31Å; I49-L52 PolarHBondContact O-N 2.88Å; Q50-L52 VanDerWaalsContact C-N 3.26Å; Q50-L52 PolarHBondContact O-N 3.09Å; L52-E56 WeakPolarHBondContact O-CB 3.23Å; L52-E56 PolarHBondContact O-N 3.19Å; L52-M94 HydrophobicContact CD1-CE 3.88Å; L52-M94 HydrophobicContact CD1-SD 4.23Å; L52-M94 HydrophobicContact CD2-CE 4.4Å; L52-I96 HydrophobicContact CB-CD1 3.61Å; L52-F477 HydrophobicContact CD1-CB 3.54Å; L52-F477 HydrophobicContact CD1-CD1 4.02Å; L52-F477 HydrophobicContact CD1-CD2 3.87Å; L52-F477 HydrophobicContact CD1-CG 3.52Å; L52-V479 HydrophobicContact CD2-CG2 3.74Å
53	V	84.5	Confident	73.6	Confident	19 Å²	19	64.1 Å²	64.1	12%	0.115	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-46.5	171.6	168.1	0	0	0	0	110.5	I49 Q50 E56 S57 I96 D436 T469	I49-V53 WeakPolarHBondContact O-CG2 3.48Å; I49-V53 PolarHBondContact O-N 3.13Å; Q50-V53 PolarHBondContact O-N 3.45Å; V53-E56 PolarHBondContact O-N 3.39Å; V53-E56 VanDerWaalsContact O-N 3.14Å; V53-S57 PolarHBondContact O-N 3.07Å; V53-S57 PolarHBondContact O-OG 3.26Å; V53-I96 HydrophobicContact CG2-CD1 4.39Å; V53-I96 HydrophobicContact CG2-CG2 3.85Å; V53-D436 WeakPolarHBondContact CG1-OD2 3.5Å; V53-T469 HydrophobicContact CG2-CG2 4.1Å
54	Q	83.2	Confident	72.8	Confident	124 Å²	124	61.5 Å²	61.5	58%	0.579	35%	0.347	S	S	*	.	H	α-helix	trans	-63.6	-43.2	178.4	-169.9	178.4	18	0	0	111.7	Q50 E56 S57 C58	Q50-Q54 WeakPolarHBondContact O-CB 3.43Å; Q50-Q54 PolarHBondContact O-N 2.96Å; Q54-E56 VanDerWaalsContact C-N 3.32Å; Q54-E56 PolarHBondContact O-N 3.26Å; Q54-S57 PolarHBondContact O-N 3.04Å; Q54-S57 PolarHBondContact O-OG 2.84Å; Q54-C58 WeakPolarHBondContact O-CB 3.48Å; Q54-C58 PolarHBondContact O-N 2.82Å; Q54-C58 PolarHBondContact O-SG 2.92Å
55	Q	81	Confident	71.4	Confident	62 Å²	62	61 Å²	61	29%	0.29	34%	0.343	S	S	.	.	H	α-helix	trans	-57.2	-46.3	171	-76.3	171.3	21.3	0	0	111.4	D51 S57 C58 I59	D51-Q55 WeakPolarHBondContact O-CB 3.41Å; D51-Q55 WeakPolarHBondContact O-CG 3.27Å; D51-Q55 PolarHBondContact O-N 3.33Å; Q55-S57 VanDerWaalsContact C-N 3.3Å; Q55-S57 PolarHBondContact O-N 3.36Å; Q55-C58 PolarHBondContact O-N 3.27Å; Q55-I59 HydrophobicContact CB-CD1 4.3Å; Q55-I59 VanDerWaalsContact O-CD1 3.26Å; Q55-I59 WeakPolarHBondContact O-CD1 3.18Å; Q55-I59 WeakPolarHBondContact O-CG1 3.24Å; Q55-I59 PolarHBondContact O-N 3.09Å
56	E	77.9	Confident	70.1	Confident	15 Å²	15	58.8 Å²	58.8	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-32.1	-176.2	-157.2	56.6	-111.3	0	0	113	L52 V53 Q54 P65 K68 R71 I96	L52-E56 WeakPolarHBondContact O-CB 3.23Å; L52-E56 PolarHBondContact O-N 3.19Å; V53-E56 PolarHBondContact O-N 3.39Å; V53-E56 VanDerWaalsContact O-N 3.14Å; Q54-E56 VanDerWaalsContact C-N 3.32Å; Q54-E56 PolarHBondContact O-N 3.26Å; E56-P65 HydrophobicContact CG-CB 4.12Å; E56-P65 HydrophobicContact CG-CG 4.46Å; E56-K68 PolarHBondContact O-NZ 2.87Å; E56-K68 WeakPolarHBondContact OE1-CD 3.22Å; E56-K68 WeakPolarHBondContact OE1-CE 3.39Å; E56-K68 IonicContact OE1-NZ 2.74Å; E56-K68 PolarHBondContact OE1-NZ 3.07Å; E56-R71 IonicContact OE2-CZ 3.7Å; E56-R71 IonicContact OE2-NE 3.43Å; E56-R71 PolarHBondContact OE2-NE 2.83Å; E56-R71 VanDerWaalsContact OE2-NE 3.1Å; E56-R71 IonicContact OE2-NH2 2.74Å; E56-R71 PolarHBondContact OE2-NH2 3.14Å; E56-I96 HydrophobicContact CG-CB 4.33Å
57	S	69.3	Low	68.6	Low	76 Å²	76	54.2 Å²	54.2	53%	0.531	32%	0.316	S	S	.	.	H	α-helix	trans	-76.5	-34.7	172.3	70.8	0	0	0	0	113.2	V53 Q54 Q55	V53-S57 PolarHBondContact O-N 3.07Å; V53-S57 PolarHBondContact O-OG 3.26Å; Q54-S57 PolarHBondContact O-N 3.04Å; Q54-S57 PolarHBondContact O-OG 2.84Å; Q55-S57 VanDerWaalsContact C-N 3.3Å; Q55-S57 PolarHBondContact O-N 3.36Å
58	C	61	Low	67.5	Low	95 Å²	95	54.4 Å²	54.4	64%	0.642	32%	0.317	S	S	*	.	H	α-helix	trans	-75.5	-24.6	176.8	-69.7	0	0	0	0	114.2	Q54 Q55 G60	Q54-C58 WeakPolarHBondContact O-CB 3.48Å; Q54-C58 PolarHBondContact O-N 2.82Å; Q54-C58 PolarHBondContact O-SG 2.92Å; Q55-C58 PolarHBondContact O-N 3.27Å; C58-G60 VanDerWaalsContact C-N 3.28Å; C58-G60 PolarHBondContact O-N 3.1Å
59	I	55.7	Low	66.6	Low	89 Å²	89	56.3 Å²	56.3	46%	0.456	33%	0.33	S	S	.	.	S	Bend	trans	-77.2	78.3	-179.5	-64.1	157.9	0	0	0	110.6	Q55 K68	Q55-I59 HydrophobicContact CB-CD1 4.3Å; Q55-I59 VanDerWaalsContact O-CD1 3.26Å; Q55-I59 WeakPolarHBondContact O-CD1 3.18Å; Q55-I59 WeakPolarHBondContact O-CG1 3.24Å; Q55-I59 PolarHBondContact O-N 3.09Å; I59-K68 PolarHBondContact O-NZ 3.09Å
60	G	48.6	Very low	66.5	Low	38 Å²	38	56.5 Å²	56.5	39%	0.392	33%	0.331	S	S	.	.			trans	70.6	103.9	157.3	0	0	0	0	0	116.7	C58 S62 N63	C58-G60 VanDerWaalsContact C-N 3.28Å; C58-G60 PolarHBondContact O-N 3.1Å; G60-S62 PolarHBondContact O-N 2.8Å; G60-N63 PolarHBondContact O-N 3.25Å
61	S	45.4	Very low	66.5	Low	137 Å²	137	52.6 Å²	52.6	96%	0.958	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-9.1	175.8	55	0	0	0	0	116
62	S	42.7	Very low	66.7	Low	73 Å²	73	49.5 Å²	49.5	51%	0.51	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.6	-179.2	58.6	0	0	0	0	115.1	G60 R537	G60-S62 PolarHBondContact O-N 2.8Å; S62-R537 PolarHBondContact O-NH1 2.98Å; S62-R537 VanDerWaalsContact O-NH1 3.07Å
63	N	44.8	Very low	66.9	Low	84 Å²	84	49.5 Å²	49.5	45%	0.449	30%	0.295	S	S	.	.	S	Bend	trans	-133.6	115.8	-178.7	-68.7	-30.8	0	0	0	109.7	G60	G60-N63 PolarHBondContact O-N 3.25Å
64	Y	49.1	Very low	67.2	Low	25 Å²	25	51.6 Å²	51.6	10%	0.098	30%	0.303	C	S	.	.			trans	-64.8	145.2	-175.7	-147.1	-88.6	0	0	0	110.8	V66 D67 I533 L535 T538	Y64-V66 HydrophobicContact CD1-CB 4.32Å; Y64-V66 HydrophobicContact CD1-CG2 3.97Å; Y64-V66 HydrophobicContact CE1-CG2 4.38Å; Y64-V66 PolarHBondContact O-N 2.99Å; Y64-D67 PolarHBondContact O-N 3.16Å; Y64-I533 HydrophobicContact CE2-CG2 4.09Å; Y64-L535 HydrophobicContact CD1-CD2 3.72Å; Y64-L535 HydrophobicContact CD2-CD2 4.09Å; Y64-L535 HydrophobicContact CE1-CD2 3.34Å; Y64-L535 HydrophobicContact CE1-CG 4.49Å; Y64-L535 HydrophobicContact CE2-CD2 3.71Å; Y64-L535 HydrophobicContact CE2-CG 4.14Å; Y64-L535 HydrophobicContact CG-CD2 4.1Å; Y64-T538 VanDerWaalsContact CB-CG2 3.41Å; Y64-T538 HydrophobicContact CD1-CG2 3.74Å; Y64-T538 HydrophobicContact CD2-CG2 4.29Å; Y64-T538 HydrophobicContact CG-CG2 3.55Å
65	P	49.9	Very low	67.5	Low	19 Å²	19	45.9 Å²	45.9	12%	0.123	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-48.1	-33.4	177.6	-35.3	37.9	0	0	0	115.5	E56 D67 K95 P98	E56-P65 HydrophobicContact CG-CB 4.12Å; E56-P65 HydrophobicContact CG-CG 4.46Å; P65-D67 VanDerWaalsContact C-N 3.31Å; P65-D67 PolarHBondContact O-N 3.16Å; P65-K95 WeakPolarHBondContact O-CE 3.28Å; P65-K95 PolarHBondContact O-NZ 3.02Å; P65-P98 HydrophobicContact CB-CG 4.36Å; P65-P98 HydrophobicContact CG-CG 3.89Å
66	V	57.8	Low	67.7	Low	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-61.4	-33.2	176.4	179.7	0	0	0	0	112.7	Y64 K95 V97 L503 T538 G540	Y64-V66 HydrophobicContact CD1-CB 4.32Å; Y64-V66 HydrophobicContact CD1-CG2 3.97Å; Y64-V66 HydrophobicContact CE1-CG2 4.38Å; Y64-V66 PolarHBondContact O-N 2.99Å; V66-K95 VanDerWaalsContact C-NZ 3.26Å; V66-K95 VanDerWaalsContact O-CE 3.26Å; V66-K95 WeakPolarHBondContact O-CE 3.22Å; V66-K95 PolarHBondContact O-NZ 2.98Å; V66-V97 HydrophobicContact CG2-CG1 3.74Å; V66-V97 HydrophobicContact CG2-CG2 4.07Å; V66-L503 HydrophobicContact CG2-CD1 3.97Å; V66-T538 HydrophobicContact CB-CG2 4.13Å; V66-G540 WeakPolarHBondContact O-CA 3.48Å
67	D	56.1	Low	68.2	Low	26 Å²	26	45.5 Å²	45.5	14%	0.139	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-82.6	-20.9	-167.1	-59.7	-23.8	0	0	0	114.7	Y64 P65 T538 G540	Y64-D67 PolarHBondContact O-N 3.16Å; P65-D67 VanDerWaalsContact C-N 3.31Å; P65-D67 PolarHBondContact O-N 3.16Å; D67-T538 WeakPolarHBondContact OD1-CA 3.11Å; D67-T538 WeakPolarHBondContact OD1-CB 3.27Å; D67-G540 PolarHBondContact OD1-N 3.36Å
68	K	65.5	Low	68.9	Low	36 Å²	36	47.9 Å²	47.9	16%	0.157	27%	0.274	C	S	.	.	S	Bend	trans	-65.8	157.3	176.1	-61.9	161.3	-176.6	171.5	0	110.1	E56 I59 K95	E56-K68 PolarHBondContact O-NZ 2.87Å; E56-K68 WeakPolarHBondContact OE1-CD 3.22Å; E56-K68 WeakPolarHBondContact OE1-CE 3.39Å; E56-K68 IonicContact OE1-NZ 2.74Å; E56-K68 PolarHBondContact OE1-NZ 3.07Å; I59-K68 PolarHBondContact O-NZ 3.09Å; K68-K95 PolarHBondContact O-NZ 2.91Å
69	P	72.5	Confident	69.9	Low	75 Å²	75	48.2 Å²	48.2	49%	0.487	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-59.8	167.1	164.5	28.3	-35.3	0	0	0	110.8
70	S	86.4	Confident	70.9	Confident	5 Å²	5	50.2 Å²	50.2	4%	0.035	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-68.8	153.9	167.1	-53.6	0	0	0	0	110.5	M94 L492 H495 A496	S70-M94 WeakPolarHBondContact CB-O 3.47Å; S70-L492 VanDerWaalsContact CB-O 3.32Å; S70-L492 WeakPolarHBondContact CB-O 3.16Å; S70-L492 PolarHBondContact N-O 2.74Å; S70-L492 VanDerWaalsContact N-O 3.14Å; S70-L492 PolarHBondContact OG-O 2.74Å; S70-H495 PolarHBondContact OG-ND1 3.26Å; S70-A496 PolarHBondContact OG-N 2.91Å
71	R	89.4	Confident	72.3	Confident	42 Å²	42	51.9 Å²	51.9	16%	0.158	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	144.1	167.5	-58.3	-170.9	-170.7	-158.6	7.8	109.1	E56 V73 M94	E56-R71 IonicContact OE2-CZ 3.7Å; E56-R71 IonicContact OE2-NE 3.43Å; E56-R71 PolarHBondContact OE2-NE 2.83Å; E56-R71 VanDerWaalsContact OE2-NE 3.1Å; E56-R71 IonicContact OE2-NH2 2.74Å; E56-R71 PolarHBondContact OE2-NH2 3.14Å; R71-V73 HydrophobicContact CB-CG1 4.31Å; R71-M94 HydrophobicContact CB-CE 4.18Å; R71-M94 PolarHBondContact N-O 3.22Å; R71-M94 PolarHBondContact O-N 2.86Å
72	L	92.4	Very high	73.9	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.6	169.6	-179.5	63.5	0	0	0	108.6	F14 A91 L443 A480 T484 Y488 L492	F14-L72 HydrophobicContact CD1-CD2 3.88Å; F14-L72 HydrophobicContact CE1-CD2 4.17Å; L72-A91 HydrophobicContact CD1-CB 4.05Å; L72-L443 HydrophobicContact CD1-CD1 3.99Å; L72-L443 HydrophobicContact CD1-CD2 3.9Å; L72-L443 HydrophobicContact CD1-CG 4.45Å; L72-A480 HydrophobicContact CB-CB 3.8Å; L72-A480 HydrophobicContact CD2-CB 3.8Å; L72-A480 HydrophobicContact CG-CB 3.88Å; L72-A480 PolarHBondContact O-N 2.92Å; L72-T484 HydrophobicContact CD2-CG2 3.75Å; L72-Y488 HydrophobicContact CD2-CD2 3.78Å; L72-Y488 HydrophobicContact CD2-CG 4.41Å; L72-L492 HydrophobicContact CB-CD1 4.12Å; L72-L492 HydrophobicContact CB-CD2 4.06Å
73	V	92.6	Very high	75.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.9	-176.6	-57.6	0	0	0	0	113.3	R71 L92 M94 F477 L478 V479	R71-V73 HydrophobicContact CB-CG1 4.31Å; V73-L92 HydrophobicContact CG2-CB 4.05Å; V73-L92 PolarHBondContact N-O 2.91Å; V73-L92 PolarHBondContact O-N 2.89Å; V73-M94 HydrophobicContact CG1-CB 4.18Å; V73-M94 HydrophobicContact CG1-CE 3.66Å; V73-M94 HydrophobicContact CG1-SD 4.12Å; V73-M94 HydrophobicContact CG2-CB 3.63Å; V73-M94 HydrophobicContact CG2-CG 4.45Å; V73-M94 HydrophobicContact CG2-SD 4.17Å; V73-F477 HydrophobicContact CG2-CD1 4.36Å; V73-L478 CarbonylContact C-O 3.56Å; V73-L478 WeakPolarHBondContact CA-O 3.38Å; V73-L478 WeakPolarHBondContact CB-O 3.42Å; V73-V479 HydrophobicContact CG1-CG2 4.19Å
74	Q	90.3	Very high	76.9	Confident	62 Å²	62	49.8 Å²	49.8	29%	0.29	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	140.4	162.4	-178.8	178.2	12.9	0	0	109.1	W16 F477 L478	W16-Q74 HydrophobicContact CH2-CB 3.61Å; W16-Q74 HydrophobicContact CZ2-CB 3.54Å; W16-Q74 HydrophobicContact CZ2-CG 4.45Å; W16-Q74 HydrophobicContact CZ3-CB 4.17Å; Q74-F477 WeakPolarHBondContact O-CA 3.42Å; Q74-L478 HydrophobicContact CB-CB 4.35Å; Q74-L478 PolarHBondContact N-O 2.9Å; Q74-L478 PolarHBondContact O-N 2.89Å
75	I	88.9	Confident	78.2	Confident	5 Å²	5	53 Å²	53	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121	-176.9	-69.5	-175.8	0	0	0	110.7	L86 L92 L440 H475 F477	I75-L86 HydrophobicContact CD1-CB 4.29Å; I75-L86 HydrophobicContact CD1-CD1 4.12Å; I75-L86 HydrophobicContact CG2-CB 4.23Å; I75-L92 HydrophobicContact CB-CD1 4.27Å; I75-L92 HydrophobicContact CD1-CD1 3.43Å; I75-L92 VanDerWaalsContact CD1-CD1 3.43Å; I75-L92 HydrophobicContact CG1-CD1 3.77Å; I75-L440 HydrophobicContact CD1-CD1 3.96Å; I75-L440 HydrophobicContact CD1-CD2 4.24Å; I75-H475 HydrophobicContact CG2-CB 4Å; I75-H475 VanDerWaalsContact CG2-CD2 3.47Å; I75-H475 WeakPolarHBondContact CG2-CD2 3.2Å; I75-F477 HydrophobicContact CD1-CD1 4.19Å; I75-F477 HydrophobicContact CD1-CE1 3.54Å; I75-F477 HydrophobicContact CD1-CZ 4.22Å; I75-F477 HydrophobicContact CG1-CD1 3.8Å; I75-F477 HydrophobicContact CG1-CE1 3.65Å; I75-F477 HydrophobicContact CG1-CZ 4.43Å
76	E	86.6	Confident	79.6	Confident	49 Å²	49	53.3 Å²	53.3	23%	0.229	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.6	168.5	-59.1	178.3	148	0	0	109.6	R46 H475 N476	R46-E76 WeakPolarHBondContact CD-OE2 3.24Å; R46-E76 IonicContact CZ-OE1 2.82Å; R46-E76 IonicContact CZ-OE2 3.71Å; R46-E76 IonicContact NE-OE1 3.59Å; R46-E76 PolarHBondContact NE-OE1 3.38Å; R46-E76 IonicContact NE-OE2 3.48Å; R46-E76 PolarHBondContact NE-OE2 2.79Å; R46-E76 IonicContact NH2-OE1 3.33Å; R46-E76 PolarHBondContact NH2-OE1 2.8Å; R46-E76 IonicContact NH2-OE2 2.68Å; E76-H475 CarbonylContact O-C 3.51Å; E76-H475 VanDerWaalsContact O-CA 3.28Å; E76-H475 WeakPolarHBondContact O-CA 3.35Å; E76-N476 HydrophobicContact CB-CB 4.22Å; E76-N476 PolarHBondContact N-O 3.39Å; E76-N476 PolarHBondContact O-N 3.03Å; E76-N476 PolarHBondContact OE2-ND2 2.98Å
77	C	88.1	Confident	80.2	Confident	20 Å²	20	57.9 Å²	57.9	14%	0.135	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.4	171.9	-165.6	0	0	0	0	111.3	K79 C82 K87 H475	C77-K79 VanDerWaalsContact C-N 3.28Å; C77-K79 PolarHBondContact O-N 3.23Å; C77-C82 HydrophobicContact CB-CB 4.37Å; C77-K87 HydrophobicContact CB-CD 4.38Å; C77-H475 PolarHBondContact SG-NE2 3.42Å; C77-H475 VanDerWaalsContact SG-NE2 3.42Å
78	R	83.5	Confident	81	Confident	125 Å²	125	62.7 Å²	62.7	47%	0.472	33%	0.332	S	S	.	.			trans	-70.1	-21.6	178.1	-61.5	172.6	169.2	-174.1	-15.7	113.2	P80 L473 H474 N476	R78-P80 WeakPolarHBondContact O-CD 3.37Å; R78-L473 PolarHBondContact NH1-O 2.66Å; R78-H474 VanDerWaalsContact CB-O 3.24Å; R78-H474 WeakPolarHBondContact CB-O 3.31Å; R78-H474 WeakPolarHBondContact CG-O 3.33Å; R78-H474 PolarHBondContact N-O 2.93Å; R78-N476 VanDerWaalsContact CZ-OD1 3.28Å; R78-N476 PolarHBondContact NE-OD1 3.18Å; R78-N476 PolarHBondContact NH2-OD1 3.21Å
79	K	82	Confident	81.7	Confident	102 Å²	102	63.8 Å²	63.8	44%	0.443	34%	0.337	S	S	.	.	S	Bend	trans	-76.8	115.6	-179.5	-77.1	-177.6	173.7	170.7	0	110.2	C77 C82 H474	C77-K79 VanDerWaalsContact C-N 3.28Å; C77-K79 PolarHBondContact O-N 3.23Å; K79-C82 HydrophobicContact CB-CB 3.84Å; K79-C82 WeakPolarHBondContact O-CB 3.43Å; K79-C82 PolarHBondContact O-N 2.74Å; K79-C82 VanDerWaalsContact O-N 3.16Å; K79-H474 HydrophobicContact CD-CB 4.47Å; K79-H474 WeakPolarHBondContact CE-CD2 3.46Å; K79-H474 WeakPolarHBondContact CE-NE2 3.24Å; K79-H474 HydrophobicContact CG-CB 4.42Å
80	P	77.3	Confident	82.1	Confident	131 Å²	131	67.5 Å²	67.5	85%	0.851	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	142.3	177.7	26.6	-34.3	0	0	0	110.3	R78 C82	R78-P80 WeakPolarHBondContact O-CD 3.37Å; P80-C82 PolarHBondContact O-N 2.95Å; P80-C82 VanDerWaalsContact O-N 3.15Å
81	G	78.1	Confident	82.1	Confident	73 Å²	73	67.6 Å²	67.6	75%	0.753	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	-1.3	-176.5	0	0	0	0	0	116	R83	G81-R83 PolarHBondContact O-N 3.32Å
82	C	78.4	Confident	82.2	Confident	36 Å²	36	65.7 Å²	65.7	24%	0.243	34%	0.336	C	S	.	.			trans	-63.4	137.8	-177.8	-165.8	0	0	0	0	112.5	C77 K79 P80 K87	C77-C82 HydrophobicContact CB-CB 4.37Å; K79-C82 HydrophobicContact CB-CB 3.84Å; K79-C82 WeakPolarHBondContact O-CB 3.43Å; K79-C82 PolarHBondContact O-N 2.74Å; K79-C82 VanDerWaalsContact O-N 3.16Å; P80-C82 PolarHBondContact O-N 2.95Å; P80-C82 VanDerWaalsContact O-N 3.15Å; C82-K87 VanDerWaalsContact O-CD 3.22Å; C82-K87 WeakPolarHBondContact O-CD 3.28Å; C82-K87 PolarHBondContact O-NZ 2.96Å
83	R	72	Confident	82.2	Confident	184 Å²	184	65.7 Å²	65.7	69%	0.694	34%	0.336	S	S	*	.			trans	-112	33.8	175.6	-62	-174.7	177.7	-177.7	1	112	G81	G81-R83 PolarHBondContact O-N 3.32Å
84	C	79	Confident	82.2	Confident	31 Å²	31	65.7 Å²	65.7	21%	0.209	34%	0.336	C	S	.	.			trans	-63.7	139.1	175.2	57.3	0	0	0	0	110.5	L86 K87	C84-L86 PolarHBondContact O-N 3Å; C84-L86 VanDerWaalsContact O-N 3.16Å; C84-K87 VanDerWaalsContact O-CB 3.29Å; C84-K87 WeakPolarHBondContact O-CB 3.39Å; C84-K87 PolarHBondContact O-N 3.05Å
85	V	75.4	Confident	82.2	Confident	93 Å²	93	63 Å²	63	56%	0.564	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-50.8	-45	-175.5	-178.2	0	0	0	0	111.7	K87 N88	V85-K87 PolarHBondContact O-N 2.89Å; V85-N88 PolarHBondContact O-N 3.33Å; V85-N88 VanDerWaalsContact O-N 3.08Å
86	L	78.6	Confident	82.1	Confident	24 Å²	24	63 Å²	63	13%	0.126	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-55.7	-17.6	179	-58.2	178.8	0	0	0	115.6	I75 C84 L92 L440 F465 L472	I75-L86 HydrophobicContact CD1-CB 4.29Å; I75-L86 HydrophobicContact CD1-CD1 4.12Å; I75-L86 HydrophobicContact CG2-CB 4.23Å; C84-L86 PolarHBondContact O-N 3Å; C84-L86 VanDerWaalsContact O-N 3.16Å; L86-L92 HydrophobicContact CD2-CD1 4.23Å; L86-L440 HydrophobicContact CD1-CD1 3.86Å; L86-L440 HydrophobicContact CD2-CD1 4Å; L86-F465 HydrophobicContact CD2-CD2 4.48Å; L86-L472 HydrophobicContact CD1-CD2 3.89Å
87	K	71.1	Confident	82	Confident	97 Å²	97	60.6 Å²	60.6	42%	0.422	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-83.2	-23.6	-179.4	-173.2	-170.1	177.2	-163.5	0	112.9	C77 C82 C84 V85 E89	C77-K87 HydrophobicContact CB-CD 4.38Å; C82-K87 VanDerWaalsContact O-CD 3.22Å; C82-K87 WeakPolarHBondContact O-CD 3.28Å; C82-K87 PolarHBondContact O-NZ 2.96Å; C84-K87 VanDerWaalsContact O-CB 3.29Å; C84-K87 WeakPolarHBondContact O-CB 3.39Å; C84-K87 PolarHBondContact O-N 3.05Å; V85-K87 PolarHBondContact O-N 2.89Å; K87-E89 VanDerWaalsContact C-N 3.32Å
88	N	73.1	Confident	81.6	Confident	127 Å²	127	60.5 Å²	60.5	68%	0.679	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-21	178.5	-65.9	-5.8	0	0	0	111.4	V85 R90	V85-N88 PolarHBondContact O-N 3.33Å; V85-N88 VanDerWaalsContact O-N 3.08Å; N88-R90 PolarHBondContact O-N 3.23Å
89	E	80.6	Confident	81.2	Confident	58 Å²	58	56.8 Å²	56.8	27%	0.271	31%	0.311	S	S	.	.			trans	-75.1	115.5	-179.6	-60.3	-53.5	145.2	0	0	111.6	K87 A91 L92	K87-E89 VanDerWaalsContact C-N 3.32Å; E89-A91 VanDerWaalsContact C-N 3.28Å; E89-A91 PolarHBondContact O-N 3.32Å; E89-L92 HydrophobicContact CB-CD1 4.26Å; E89-L92 HydrophobicContact CB-CD2 3.95Å; E89-L92 HydrophobicContact CB-CG 3.91Å; E89-L92 HydrophobicContact CG-CD2 4.01Å
90	R	79.3	Confident	81.1	Confident	154 Å²	154	52 Å²	52	58%	0.581	29%	0.29	S	S	*	.	S	Bend	trans	-66.7	-30.7	177.9	-66.7	-174.3	-178.5	-179.9	2.3	112.6	D9 N88	D9-R90 IonicContact OD2-CZ 3.26Å; D9-R90 IonicContact OD2-NH1 3.66Å; D9-R90 PolarHBondContact OD2-NH1 3.49Å; D9-R90 IonicContact OD2-NH2 3.81Å; D9-R90 PolarHBondContact OD2-NH2 3.39Å; N88-R90 PolarHBondContact O-N 3.23Å
91	A	87.2	Confident	81.4	Confident	7 Å²	7	45.8 Å²	45.8	6%	0.058	25%	0.25	C	S	.	.			trans	-154.8	131	-179.4	0	0	0	0	0	111.8	F14 L72 E89 L443	F14-A91 HydrophobicContact CD1-CB 4.49Å; F14-A91 HydrophobicContact CD2-CB 4.02Å; F14-A91 HydrophobicContact CE1-CB 4Å; F14-A91 HydrophobicContact CE2-CB 3.47Å; F14-A91 VanDerWaalsContact CE2-CB 3.47Å; F14-A91 HydrophobicContact CG-CB 4.5Å; F14-A91 HydrophobicContact CZ-CB 3.45Å; F14-A91 VanDerWaalsContact CZ-CB 3.45Å; L72-A91 HydrophobicContact CD1-CB 4.05Å; E89-A91 VanDerWaalsContact C-N 3.28Å; E89-A91 PolarHBondContact O-N 3.32Å; A91-L443 HydrophobicContact CB-CB 4.39Å; A91-L443 HydrophobicContact CB-CD2 4.35Å; A91-L443 PolarHBondContact O-N 2.92Å
92	L	91.5	Very high	81.8	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139	-179.4	-71.2	161.8	0	0	0	110.1	V73 I75 L86 E89 E441	V73-L92 HydrophobicContact CG2-CB 4.05Å; V73-L92 PolarHBondContact N-O 2.91Å; V73-L92 PolarHBondContact O-N 2.89Å; I75-L92 HydrophobicContact CB-CD1 4.27Å; I75-L92 HydrophobicContact CD1-CD1 3.43Å; I75-L92 VanDerWaalsContact CD1-CD1 3.43Å; I75-L92 HydrophobicContact CG1-CD1 3.77Å; L86-L92 HydrophobicContact CD2-CD1 4.23Å; E89-L92 HydrophobicContact CB-CD1 4.26Å; E89-L92 HydrophobicContact CB-CD2 3.95Å; E89-L92 HydrophobicContact CB-CG 3.91Å; E89-L92 HydrophobicContact CG-CD2 4.01Å; L92-E441 CarbonylContact C-O 3.54Å; L92-E441 WeakPolarHBondContact CA-O 3.43Å; L92-E441 WeakPolarHBondContact CD2-O 3.38Å
93	A	92.1	Very high	82.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	123.7	158.6	0	0	0	0	0	108.2	L440 E441 L492 H495	A93-L440 WeakPolarHBondContact O-CA 3.33Å; A93-E441 PolarHBondContact N-O 3.13Å; A93-E441 PolarHBondContact O-N 3.3Å; A93-L492 HydrophobicContact CB-CD2 4.04Å; A93-H495 HydrophobicContact CB-CB 3.75Å; A93-H495 PolarHBondContact O-CE1 3.17Å
94	M	92.7	Very high	83.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.1	179.3	-179.8	-174.1	75	0	0	110.7	L52 S70 R71 V73 I96 I438 F439 L440 F477	L52-M94 HydrophobicContact CD1-CE 3.88Å; L52-M94 HydrophobicContact CD1-SD 4.23Å; L52-M94 HydrophobicContact CD2-CE 4.4Å; S70-M94 WeakPolarHBondContact CB-O 3.47Å; R71-M94 HydrophobicContact CB-CE 4.18Å; R71-M94 PolarHBondContact N-O 3.22Å; R71-M94 PolarHBondContact O-N 2.86Å; V73-M94 HydrophobicContact CG1-CB 4.18Å; V73-M94 HydrophobicContact CG1-CE 3.66Å; V73-M94 HydrophobicContact CG1-SD 4.12Å; V73-M94 HydrophobicContact CG2-CB 3.63Å; V73-M94 HydrophobicContact CG2-CG 4.45Å; V73-M94 HydrophobicContact CG2-SD 4.17Å; M94-I96 HydrophobicContact CE-CD1 3.96Å; M94-I96 HydrophobicContact CE-CG1 4.21Å; M94-I96 HydrophobicContact CG-CG1 4.34Å; M94-I96 HydrophobicContact SD-CD1 4.3Å; M94-I96 HydrophobicContact SD-CG1 4.36Å; M94-I438 HydrophobicContact CG-CG2 4.3Å; M94-F439 WeakPolarHBondContact CA-O 3.44Å; M94-L440 HydrophobicContact CB-CD2 3.73Å; M94-L440 HydrophobicContact CG-CD2 3.67Å; M94-L440 HydrophobicContact SD-CD2 4.43Å; M94-F477 HydrophobicContact SD-CD1 3.9Å; M94-F477 HydrophobicContact SD-CE1 3.97Å
95	K	90.2	Very high	83.6	Confident	7 Å²	7	32.2 Å²	32.2	3%	0.03	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	117.8	177.6	-178.2	63.5	162.1	-178.7	0	109.3	P65 V66 K68 V97 F439 V499	P65-K95 WeakPolarHBondContact O-CE 3.28Å; P65-K95 PolarHBondContact O-NZ 3.02Å; V66-K95 VanDerWaalsContact C-NZ 3.26Å; V66-K95 VanDerWaalsContact O-CE 3.26Å; V66-K95 WeakPolarHBondContact O-CE 3.22Å; V66-K95 PolarHBondContact O-NZ 2.98Å; K68-K95 PolarHBondContact O-NZ 2.91Å; K95-V97 HydrophobicContact CG-CG2 4.29Å; K95-F439 HydrophobicContact CB-CB 4.23Å; K95-F439 PolarHBondContact N-O 3.15Å; K95-F439 PolarHBondContact O-N 3.43Å; K95-V499 HydrophobicContact CB-CG2 4.14Å; K95-V499 HydrophobicContact CG-CB 4.17Å; K95-V499 HydrophobicContact CG-CG1 3.87Å; K95-V499 HydrophobicContact CG-CG2 4.16Å
96	I	88	Confident	84.2	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.015	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.1	178.1	-53.6	-176	0	0	0	108	I49 L52 V53 E56 M94 I438	I49-I96 HydrophobicContact CD1-CD1 4.04Å; L52-I96 HydrophobicContact CB-CD1 3.61Å; V53-I96 HydrophobicContact CG2-CD1 4.39Å; V53-I96 HydrophobicContact CG2-CG2 3.85Å; E56-I96 HydrophobicContact CG-CB 4.33Å; M94-I96 HydrophobicContact CE-CD1 3.96Å; M94-I96 HydrophobicContact CE-CG1 4.21Å; M94-I96 HydrophobicContact CG-CG1 4.34Å; M94-I96 HydrophobicContact SD-CD1 4.3Å; M94-I96 HydrophobicContact SD-CG1 4.36Å; I96-I438 HydrophobicContact CG1-CG1 4.22Å; I96-I438 HydrophobicContact CG1-CG2 4.47Å; I96-I438 HydrophobicContact CG2-CG1 4.2Å
97	V	83.6	Confident	84.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	89.9	176.6	-174.8	0	0	0	0	108	V66 K95 I100 L437 F439 V499 L503	V66-V97 HydrophobicContact CG2-CG1 3.74Å; V66-V97 HydrophobicContact CG2-CG2 4.07Å; K95-V97 HydrophobicContact CG-CG2 4.29Å; V97-I100 HydrophobicContact CG1-CB 4.37Å; V97-L437 PolarHBondContact N-O 3.29Å; V97-L437 PolarHBondContact O-N 3.36Å; V97-L437 VanDerWaalsContact O-N 3.1Å; V97-F439 HydrophobicContact CB-CE2 4.29Å; V97-F439 HydrophobicContact CG2-CD2 4.29Å; V97-F439 HydrophobicContact CG2-CE2 4.06Å; V97-V499 HydrophobicContact CG2-CG1 4.2Å; V97-L503 HydrophobicContact CB-CD1 4.4Å; V97-L503 HydrophobicContact CG1-CD1 3.97Å; V97-L503 HydrophobicContact CG2-CD1 4.05Å
98	P	78.8	Confident	84.9	Confident	18 Å²	18	26.6 Å²	26.6	12%	0.117	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	155.3	-178.3	32.1	-34.7	0	0	0	112.3	P65 I100 D436	P65-P98 HydrophobicContact CB-CG 4.36Å; P65-P98 HydrophobicContact CG-CG 3.89Å; P98-I100 PolarHBondContact O-N 2.63Å; P98-D436 WeakPolarHBondContact CA-OD1 3.48Å; P98-D436 HydrophobicContact CB-CB 4.49Å; P98-D436 VanDerWaalsContact CB-OD1 3.27Å; P98-D436 WeakPolarHBondContact CB-OD1 3.28Å
99	G	76	Confident	84.5	Confident	46 Å²	46	24.1 Å²	24.1	47%	0.474	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62.5	24.1	174.8	0	0	0	0	0	115.2	G435 D436	G99-G435 CarbonylContact C-O 3.56Å; G99-G435 PolarHBondContact N-O 3.18Å; G99-D436 PolarHBondContact N-OD1 2.89Å
100	I	80.2	Confident	83.1	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139.8	176.4	-171.5	75.6	0	0	0	109.7	V97 P98 S162 C163 G435 L437 L503	V97-I100 HydrophobicContact CG1-CB 4.37Å; P98-I100 PolarHBondContact O-N 2.63Å; I100-S162 WeakPolarHBondContact CD1-OG 3.34Å; I100-C163 WeakPolarHBondContact CD1-SG 3.26Å; I100-G435 WeakPolarHBondContact CG2-O 3.42Å; I100-G435 PolarHBondContact N-O 2.89Å; I100-G435 PolarHBondContact O-N 2.73Å; I100-G435 VanDerWaalsContact O-N 3.13Å; I100-L437 HydrophobicContact CG2-CB 3.93Å; I100-L437 HydrophobicContact CG2-CD1 3.75Å; I100-L437 HydrophobicContact CG2-CG 3.52Å; I100-L503 HydrophobicContact CD1-CD2 3.97Å; I100-L503 HydrophobicContact CG1-CD2 4.02Å
101	T	82.8	Confident	81.3	Confident	2 Å²	2	21 Å²	21	1%	0.012	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.1	173	-61.2	0	0	0	0	109.6	V103 T161 S162 L383 C432 H433 H434	T101-V103 HydrophobicContact CG2-CG2 3.93Å; T101-T161 CarbonylContact O-C 3.56Å; T101-T161 VanDerWaalsContact O-CA 3.23Å; T101-T161 WeakPolarHBondContact O-CA 3.11Å; T101-S162 PolarHBondContact N-OG 2.76Å; T101-S162 VanDerWaalsContact N-OG 3.16Å; T101-S162 PolarHBondContact O-N 3.15Å; T101-L383 HydrophobicContact CG2-CD1 4.33Å; T101-C432 HydrophobicContact CG2-CB 3.71Å; T101-H433 CarbonylContact C-O 3.54Å; T101-H433 WeakPolarHBondContact CA-O 3.46Å; T101-H434 WeakPolarHBondContact CG2-ND1 3.5Å; T101-H434 PolarHBondContact OG1-ND1 3.15Å
102	L	88	Confident	78.7	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.1	164.2	-61.2	-172.6	0	0	0	108.9	V159 T161 C432 H433 L437 I515 L519	L102-V159 HydrophobicContact CB-CG1 4.02Å; L102-V159 HydrophobicContact CD2-CG1 4.17Å; L102-V159 HydrophobicContact CG-CG1 4.48Å; L102-T161 HydrophobicContact CD2-CG2 3.82Å; L102-C432 CarbonylContact O-C 3.59Å; L102-C432 VanDerWaalsContact O-CA 3.27Å; L102-C432 WeakPolarHBondContact O-CA 3.35Å; L102-H433 PolarHBondContact N-O 3.06Å; L102-H433 PolarHBondContact O-N 3.06Å; L102-L437 HydrophobicContact CD2-CD1 4.24Å; L102-I515 HydrophobicContact CD1-CG2 3.78Å; L102-L519 HydrophobicContact CD1-CD1 4.04Å; L102-L519 HydrophobicContact CG-CD1 4.31Å
103	V	88	Confident	75.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	114.2	-171.4	-174.2	0	0	0	0	108.2	T101 V159 L160 I379 L383 I429 C432	T101-V103 HydrophobicContact CG2-CG2 3.93Å; V103-V159 WeakPolarHBondContact O-CA 3.31Å; V103-L160 HydrophobicContact CB-CB 4.27Å; V103-L160 PolarHBondContact N-O 3.35Å; V103-L160 PolarHBondContact O-N 2.98Å; V103-I379 HydrophobicContact CG1-CD1 4.25Å; V103-I379 HydrophobicContact CG2-CG1 4.22Å; V103-L383 HydrophobicContact CG1-CD2 4.42Å; V103-L383 HydrophobicContact CG2-CD1 3.65Å; V103-I429 HydrophobicContact CG1-CG2 3.41Å; V103-I429 VanDerWaalsContact CG1-CG2 3.41Å; V103-C432 HydrophobicContact CG2-CB 4.39Å
104	Q	89.3	Confident	72.8	Confident	37 Å²	37	37 Å²	37	17%	0.173	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.9	179.8	-149.8	-179.1	-12.8	0	0	110	F430 S431 V509	Q104-F430 HydrophobicContact CB-CD2 4.47Å; Q104-F430 HydrophobicContact CB-CE1 4.49Å; Q104-F430 HydrophobicContact CB-CE2 3.85Å; Q104-F430 HydrophobicContact CB-CZ 3.88Å; Q104-F430 VanDerWaalsContact CD-CE2 3.48Å; Q104-F430 VanDerWaalsContact CD-CZ 3.45Å; Q104-F430 HydrophobicContact CG-CE1 4.26Å; Q104-F430 HydrophobicContact CG-CE2 3.8Å; Q104-F430 HydrophobicContact CG-CZ 3.47Å; Q104-F430 VanDerWaalsContact CG-CZ 3.47Å; Q104-F430 PolarHBondContact O-N 2.89Å; Q104-F430 VanDerWaalsContact O-N 3.08Å; Q104-S431 WeakPolarHBondContact CB-OG 3.23Å; Q104-S431 PolarHBondContact N-O 3.03Å; Q104-S431 PolarHBondContact OE1-OG 2.81Å; Q104-V509 HydrophobicContact CG-CG2 3.75Å
105	A	89.7	Confident	69.8	Low	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	168	-177.5	0	0	0	0	0	111.7	S157 V158 L427 Q428 I429	A105-S157 CarbonylContact O-C 3.6Å; A105-S157 VanDerWaalsContact O-CA 3.3Å; A105-S157 WeakPolarHBondContact O-CA 3.4Å; A105-V158 HydrophobicContact CB-CG2 4.29Å; A105-V158 PolarHBondContact N-O 2.79Å; A105-V158 PolarHBondContact O-N 3.39Å; A105-L427 HydrophobicContact CB-CD1 3.74Å; A105-L427 HydrophobicContact CB-CD2 4.13Å; A105-L427 HydrophobicContact CB-CG 3.83Å; A105-Q428 CarbonylContact C-O 3.52Å; A105-Q428 WeakPolarHBondContact CA-O 3.22Å; A105-Q428 WeakPolarHBondContact CB-O 3.29Å; A105-I429 HydrophobicContact CB-CB 4.45Å; A105-I429 HydrophobicContact CB-CG1 4.04Å
106	E	87.9	Confident	66.8	Low	51 Å²	51	47.9 Å²	47.9	24%	0.238	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	-177.7	-176.8	170	125.8	0	0	111.1	L108 S155 L427 Q428 F430	E106-L108 PolarHBondContact O-N 2.85Å; E106-S155 VanDerWaalsContact OE1-CB 3.23Å; E106-S155 WeakPolarHBondContact OE1-CB 3.39Å; E106-S155 WeakPolarHBondContact OE2-CB 3.4Å; E106-L427 WeakPolarHBondContact O-CA 3.19Å; E106-Q428 PolarHBondContact N-O 2.75Å; E106-Q428 PolarHBondContact O-N 3.29Å; E106-F430 HydrophobicContact CB-CE1 4.14Å
107	W	84	Confident	64	Low	8 Å²	8	50.8 Å²	50.8	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	106.4	171.8	-72.3	111	0	0	0	110.8	L109 H156 P394 L398 L427	W107-L109 VanDerWaalsContact C-N 3.34Å; W107-L109 PolarHBondContact O-N 2.82Å; W107-H156 HydrophobicContact CB-CB 4.46Å; W107-H156 PolarHBondContact N-O 3.42Å; W107-P394 HydrophobicContact CH2-CG 3.8Å; W107-P394 HydrophobicContact CZ3-CG 3.84Å; W107-L398 HydrophobicContact CH2-CB 4.36Å; W107-L427 HydrophobicContact CD2-CD1 3.95Å; W107-L427 HydrophobicContact CE3-CB 4.39Å; W107-L427 HydrophobicContact CE3-CD1 4.14Å; W107-L427 HydrophobicContact CG-CD1 4.34Å; W107-L427 HydrophobicContact CZ3-CB 4.37Å
108	L	79.3	Confident	61.4	Low	37 Å²	37	59.1 Å²	59.1	19%	0.194	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	89.5	167.9	-62.5	-178.3	0	0	0	108.8	E106 P110 I391 L426 Q428	E106-L108 PolarHBondContact O-N 2.85Å; L108-P110 WeakPolarHBondContact O-CD 3.29Å; L108-I391 HydrophobicContact CD1-CD1 4.21Å; L108-I391 HydrophobicContact CD1-CG2 4.23Å; L108-L426 HydrophobicContact CB-CB 4.14Å; L108-L426 PolarHBondContact N-O 2.81Å; L108-Q428 HydrophobicContact CD1-CB 3.97Å; L108-Q428 HydrophobicContact CD2-CB 4.48Å; L108-Q428 HydrophobicContact CG-CB 4.03Å
109	L	64.6	Low	59	Low	74 Å²	74	67.7 Å²	67.7	39%	0.387	40%	0.396	S	S	.	.			trans	-59.2	123.4	164	-88.4	162.8	0	0	0	108.9	W107 N111 F404	W107-L109 VanDerWaalsContact C-N 3.34Å; W107-L109 PolarHBondContact O-N 2.82Å; L109-N111 PolarHBondContact O-N 2.82Å; L109-N111 VanDerWaalsContact O-N 3.1Å; L109-F404 HydrophobicContact CD1-CE1 4.01Å; L109-F404 HydrophobicContact CD1-CZ 4.35Å; L109-F404 HydrophobicContact CD2-CE1 3.87Å; L109-F404 HydrophobicContact CD2-CE2 3.95Å; L109-F404 HydrophobicContact CD2-CZ 3.41Å; L109-F404 VanDerWaalsContact CD2-CZ 3.41Å; L109-F404 HydrophobicContact CG-CE1 4.01Å; L109-F404 HydrophobicContact CG-CZ 3.85Å
110	P	51	Low	56.7	Low	54 Å²	54	70.6 Å²	70.6	35%	0.351	41%	0.409	S	S	.	.			trans	-65.9	114.4	169.5	24.5	-28.1	0	0	0	108.3	L108 S112 M423	L108-P110 WeakPolarHBondContact O-CD 3.29Å; P110-S112 PolarHBondContact O-N 3.16Å; P110-M423 HydrophobicContact CB-CG 4.43Å; P110-M423 HydrophobicContact CB-SD 3.59Å; P110-M423 VanDerWaalsContact CB-SD 3.59Å; P110-M423 HydrophobicContact CG-CB 3.76Å; P110-M423 HydrophobicContact CG-CG 4.03Å; P110-M423 HydrophobicContact CG-SD 3.76Å
111	N	42.2	Very low	54.2	Low	92 Å²	92	81.4 Å²	81.4	49%	0.492	45%	0.45	S	S	.	.			trans	-51.9	125.6	175.9	-72.3	-30.4	0	0	0	109.2	L109 V113	L109-N111 PolarHBondContact O-N 2.82Å; L109-N111 VanDerWaalsContact O-N 3.1Å; N111-V113 PolarHBondContact O-N 3.18Å
112	S	32.1	Very low	51.5	Low	101 Å²	101	86 Å²	86	71%	0.706	48%	0.483	S	S	*	.			trans	-60.3	113.8	170.4	47.9	0	0	0	0	108	P110 V114	P110-S112 PolarHBondContact O-N 3.16Å; S112-V114 VanDerWaalsContact C-N 3.25Å; S112-V114 PolarHBondContact O-N 2.86Å
113	V	31.6	Very low	48.7	Very low	130 Å²	130	93.8 Å²	93.8	79%	0.788	52%	0.518	S	S	*	.			trans	-71	90.3	179.1	-179.1	0	0	0	0	107.2	N111 S115	N111-V113 PolarHBondContact O-N 3.18Å; V113-S115 PolarHBondContact O-N 2.87Å
114	V	28.6	Very low	45.8	Very low	113 Å²	113	103 Å²	103	69%	0.685	56%	0.561	S	S	*	*			trans	-61.9	97	161.8	179.7	0	0	0	0	105.5	S112 N116	S112-V114 VanDerWaalsContact C-N 3.25Å; S112-V114 PolarHBondContact O-N 2.86Å; V114-N116 VanDerWaalsContact C-N 3.27Å; V114-N116 PolarHBondContact O-N 2.91Å
115	S	29.5	Very low	42.8	Very low	103 Å²	103	106.5 Å²	106.5	72%	0.72	59%	0.59	S	S	*	*			trans	-71.1	86.1	-177.6	41.2	0	0	0	0	109.2	V113 G117	V113-S115 PolarHBondContact O-N 2.87Å; S115-G117 VanDerWaalsContact C-N 3.26Å; S115-G117 PolarHBondContact O-N 2.98Å
116	N	28.5	Very low	39.8	Very low	133 Å²	133	111.4 Å²	111.4	71%	0.711	62%	0.624	S	S	*	*			trans	-58.7	92.7	168	-76.8	-4.4	0	0	0	108.4	V114 E118	V114-N116 VanDerWaalsContact C-N 3.27Å; V114-N116 PolarHBondContact O-N 2.91Å; N116-E118 PolarHBondContact O-N 2.94Å
117	G	29	Very low	36.8	Very low	65 Å²	65	118 Å²	118	67%	0.67	66%	0.655	S	S	*	*			trans	-73.9	64.2	-177.3	0	0	0	0	0	111.9	S115 K119	S115-G117 VanDerWaalsContact C-N 3.26Å; S115-G117 PolarHBondContact O-N 2.98Å; G117-K119 PolarHBondContact O-N 2.96Å
118	E	27.7	Very low	33.9	Very low	175 Å²	175	126.4 Å²	126.4	82%	0.818	69%	0.694	S	S	*	*			trans	-65.3	97.3	173	-67	-164.4	140.7	0	0	109.3	N116 S120	N116-E118 PolarHBondContact O-N 2.94Å; E118-S120 VanDerWaalsContact C-N 3.27Å; E118-S120 PolarHBondContact O-N 2.98Å
119	K	28.4	Very low	31.4	Very low	197 Å²	197	129.6 Å²	129.6	86%	0.857	73%	0.726	S	S	*	*			trans	-68	83.6	178.2	-68	177.5	-179.7	176.2	0	110	G117 R121	G117-K119 PolarHBondContact O-N 2.96Å; K119-R121 PolarHBondContact O-N 2.92Å
120	S	27.9	Very low	29.6	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	74%	0.742	S	S	*	*			trans	-60	99.5	173.4	58.9	0	0	0	0	110.2	E118 S122	E118-S120 VanDerWaalsContact C-N 3.27Å; E118-S120 PolarHBondContact O-N 2.98Å; S120-S122 PolarHBondContact O-N 2.94Å
121	R	27.6	Very low	28.3	Very low	228 Å²	228	135.9 Å²	135.9	86%	0.86	76%	0.761	S	S	*	*			trans	-62.9	95.1	174.3	-75.3	176	166.3	169.3	-5.9	110.4	K119	K119-R121 PolarHBondContact O-N 2.92Å
122	S	27.6	Very low	27.6	Very low	100 Å²	100	139.1 Å²	139.1	70%	0.699	78%	0.778	S	S	*	*			trans	-88	114.5	159.6	45.2	0	0	0	0	109	S120 H124	S120-S122 PolarHBondContact O-N 2.94Å; S122-H124 PolarHBondContact O-N 2.89Å
123	H	27.5	Very low	27.2	Very low	164 Å²	164	140.9 Å²	140.9	76%	0.759	79%	0.785	S	S	*	*			trans	-74.9	125.3	173.1	-81.8	-104.6	0	0	0	109.6	S125	H123-S125 PolarHBondContact O-N 2.98Å
124	H	27.4	Very low	27	Very low	195 Å²	195	139.8 Å²	139.8	90%	0.903	78%	0.783	S	S	*	*			trans	-71.9	92.4	169.2	-72.6	-70.2	0	0	0	110.4	S122	S122-H124 PolarHBondContact O-N 2.89Å
125	S	27.7	Very low	27	Very low	110 Å²	110	142 Å²	142	77%	0.769	79%	0.791	S	S	*	*			trans	-100.5	124.9	148.3	53.1	0	0	0	0	108.5	H123	H123-S125 PolarHBondContact O-N 2.98Å
126	S	25.2	Very low	26.9	Very low	103 Å²	103	144.5 Å²	144.5	72%	0.72	80%	0.797	S	S	*	*			trans	-72.7	145.3	173.5	48.7	0	0	0	0	110.6
127	Q	25.8	Very low	26.7	Very low	189 Å²	189	147.7 Å²	147.7	88%	0.883	80%	0.804	S	S	*	*				-168	145.1	116.1	-99.9	161.7	34.8	0	0	110.8
128	H	23.2	Very low	26.7	Very low	184 Å²	184	151.3 Å²	151.3	85%	0.852	81%	0.813	S	S	*	*			trans	-81.2	128.8	178	-71.8	-110.9	0	0	0	110.2
129	A	26.3	Very low	26.6	Very low	104 Å²	104	146.1 Å²	146.1	86%	0.86	80%	0.8	S	S	*	*			trans	-138.9	102	158.5	0	0	0	0	0	107.9
130	V	27	Very low	26.4	Very low	119 Å²	119	147.1 Å²	147.1	72%	0.721	80%	0.8	S	S	*	*			trans	-94.1	130.9	179.9	-173.8	0	0	0	0	108.8
131	N	23.5	Very low	26.3	Very low	142 Å²	142	149.3 Å²	149.3	76%	0.759	80%	0.803	S	S	*	*			trans	142	106.6	151.3	-75	-26.5	0	0	0	111.5
132	N	27	Very low	26.3	Very low	159 Å²	159	146.2 Å²	146.2	85%	0.85	80%	0.798	S	S	*	*				-162.5	132	109.2	-111	-22.7	0	0	0	113.1
133	T	24.7	Very low	26.3	Very low	138 Å²	138	146.8 Å²	146.8	85%	0.847	80%	0.802	S	S	*	*			trans	-71.6	121.5	173.2	-11.8	0	0	0	0	110.1
134	S	28.2	Very low	26.5	Very low	108 Å²	108	143.2 Å²	143.2	76%	0.755	79%	0.792	S	S	*	*			trans	-150.8	138.2	153.2	60.9	0	0	0	0	110.4
135	N	27.3	Very low	26.7	Very low	160 Å²	160	138.9 Å²	138.9	86%	0.856	78%	0.781	S	S	*	*			trans	-74.4	131.2	-179.2	-56.5	-61.3	0	0	0	109.6
136	N	27.6	Very low	26.8	Very low	155 Å²	155	140.5 Å²	140.5	83%	0.829	78%	0.779	S	S	*	*			trans	-147.9	146.2	155.6	-117.9	-37.1	0	0	0	113.3	V138	N136-V138 PolarHBondContact O-N 2.7Å
137	K	25.3	Very low	27.3	Very low	200 Å²	200	139.9 Å²	139.9	87%	0.87	77%	0.771	S	S	*	*			trans	-74.5	106.1	-175.1	-63.2	171.1	-178.2	173.7	0	109.3	A139	K137-A139 VanDerWaalsContact C-N 3.34Å; K137-A139 PolarHBondContact O-N 2.83Å
138	V	28.9	Very low	27.5	Very low	141 Å²	141	138 Å²	138	86%	0.855	77%	0.767	S	S	*	*			trans	-72.5	94.9	165.7	-177.6	0	0	0	0	107.8	N136	N136-V138 PolarHBondContact O-N 2.7Å
139	A	24.2	Very low	27.8	Very low	66 Å²	66	137.9 Å²	137.9	55%	0.545	77%	0.767	S	S	.	*			trans	-61.4	144.6	167.2	0	0	0	0	0	109.4	K137 N141	K137-A139 VanDerWaalsContact C-N 3.34Å; K137-A139 PolarHBondContact O-N 2.83Å; A139-N141 PolarHBondContact O-N 3.21Å
140	Y	24.9	Very low	28	Very low	218 Å²	218	138.1 Å²	138.1	86%	0.855	75%	0.752	S	S	*	*			trans	-68.5	84.6	172.6	-93.1	-98.3	0	0	0	110	Q142	Y140-Q142 PolarHBondContact O-N 3.29Å
141	N	24.5	Very low	28.1	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	76%	0.758	S	S	*	*			trans	-71.4	66.5	162.3	-79.2	-9.6	0	0	0	109.3	A139 S143	A139-N141 PolarHBondContact O-N 3.21Å; N141-S143 VanDerWaalsContact C-N 3.34Å; N141-S143 PolarHBondContact O-N 3.15Å
142	Q	28.9	Very low	28.6	Very low	164 Å²	164	140.4 Å²	140.4	77%	0.766	76%	0.76	S	S	*	*			trans	-62.8	104.4	153.4	-85.1	-172.7	-23.5	0	0	106.5	Y140 V144	Y140-Q142 PolarHBondContact O-N 3.29Å; Q142-V144 VanDerWaalsContact C-N 3.31Å; Q142-V144 PolarHBondContact O-N 3.26Å
143	S	26.3	Very low	29.1	Very low	112 Å²	112	136 Å²	136	78%	0.783	74%	0.741	S	S	*	*			trans	-67.1	88.8	-179.5	54.2	0	0	0	0	110	N141	N141-S143 VanDerWaalsContact C-N 3.34Å; N141-S143 PolarHBondContact O-N 3.15Å
144	V	32	Very low	30.2	Very low	89 Å²	89	139 Å²	139	54%	0.539	74%	0.738	S	S	.	*			trans	-51.3	131.2	165.1	179.3	0	0	0	0	107.7	Q142 I146	Q142-V144 VanDerWaalsContact C-N 3.31Å; Q142-V144 PolarHBondContact O-N 3.26Å; V144-I146 PolarHBondContact O-N 2.68Å; V144-I146 VanDerWaalsContact O-N 3.16Å
145	P	31.2	Very low	31.4	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	72%	0.723	S	S	*	*			trans	-53.7	124.4	178.7	-27.3	35.2	0	0	0	110.8	V147	P145-V147 PolarHBondContact O-N 3.42Å
146	I	30.2	Very low	33.4	Very low	143 Å²	143	133.2 Å²	133.2	73%	0.733	70%	0.701	S	S	*	*			trans	-65.3	110.3	179.2	-62.9	173.2	0	0	0	107.4	V144 N148 Q149	V144-I146 PolarHBondContact O-N 2.68Å; V144-I146 VanDerWaalsContact O-N 3.16Å; I146-N148 HydrophobicContact CG2-CB 4.19Å; I146-N148 PolarHBondContact O-N 3.25Å; I146-Q149 PolarHBondContact O-N 3.3Å
147	V	36	Very low	36.1	Very low	90 Å²	90	126.9 Å²	126.9	55%	0.545	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-56.4	-24.6	-170.2	177.7	0	0	0	0	112.7	P145 Q149 M150	P145-V147 PolarHBondContact O-N 3.42Å; V147-Q149 PolarHBondContact O-N 3Å; V147-M150 HydrophobicContact CG1-SD 4.11Å; V147-M150 PolarHBondContact O-N 2.91Å
148	N	30.1	Very low	39	Very low	150 Å²	150	117.5 Å²	117.5	80%	0.802	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-66.9	1.3	-178.1	-58.1	7.4	0	0	0	115.1	I146	I146-N148 HydrophobicContact CG2-CB 4.19Å; I146-N148 PolarHBondContact O-N 3.25Å
149	Q	29.7	Very low	41.9	Very low	181 Å²	181	110.8 Å²	110.8	85%	0.846	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-125.9	30.4	166.9	-69	-164.8	-0.3	0	0	113.9	I146 V147 K151	I146-Q149 PolarHBondContact O-N 3.3Å; V147-Q149 PolarHBondContact O-N 3Å; Q149-K151 PolarHBondContact O-N 3.17Å
150	M	30.9	Very low	44.9	Very low	110 Å²	110	107.7 Å²	107.7	54%	0.542	56%	0.562	S	S	.	*			trans	-67.5	77.4	161.1	-76.2	-174.3	163.4	0	0	111	V147 S152	V147-M150 HydrophobicContact CG1-SD 4.11Å; V147-M150 PolarHBondContact O-N 2.91Å; M150-S152 PolarHBondContact O-N 2.7Å
151	K	29.4	Very low	47.7	Very low	195 Å²	195	97.3 Å²	97.3	85%	0.848	52%	0.521	S	S	*	.			trans	-58.4	122.7	165.3	-167.9	177.1	-171.7	177.3	0	107.3	Q149 S153	Q149-K151 PolarHBondContact O-N 3.17Å; K151-S153 PolarHBondContact O-N 3.24Å
152	S	33.7	Very low	50.3	Low	114 Å²	114	90.3 Å²	90.3	80%	0.797	48%	0.484	S	S	*	.			trans	-63.4	83.9	-160.2	60.2	0	0	0	0	114.7	M150	M150-S152 PolarHBondContact O-N 2.7Å
153	S	37.5	Very low	52.4	Low	65 Å²	65	82.6 Å²	82.6	46%	0.455	45%	0.448	S	S	.	.			trans	-57.9	138	148.2	37	0	0	0	0	108	K151 S155	K151-S153 PolarHBondContact O-N 3.24Å; S153-S155 PolarHBondContact O-N 3.17Å
154	Y	47.6	Very low	54.8	Low	203 Å²	203	77.3 Å²	77.3	80%	0.796	41%	0.411	S	S	*	.			trans	-61	108.7	-173.8	-70.2	-89	0	0	0	110.5	H156	Y154-H156 PolarHBondContact O-CE1 3.18Å; Y154-H156 PolarHBondContact O-N 3.01Å; Y154-H156 PolarHBondContact O-ND1 3.22Å
155	S	53	Low	56.5	Low	62 Å²	62	73.9 Å²	73.9	43%	0.434	39%	0.391	S	S	.	.			trans	-70.4	117.4	174.8	38.3	0	0	0	0	109.8	E106 S153 S157	E106-S155 VanDerWaalsContact OE1-CB 3.23Å; E106-S155 WeakPolarHBondContact OE1-CB 3.39Å; E106-S155 WeakPolarHBondContact OE2-CB 3.4Å; S153-S155 PolarHBondContact O-N 3.17Å; S155-S157 VanDerWaalsContact C-N 3.35Å; S155-S157 PolarHBondContact O-N 2.86Å; S155-S157 VanDerWaalsContact O-N 3.11Å
156	H	70	Confident	58.8	Low	83 Å²	83	69 Å²	69	38%	0.384	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	80.6	179.8	-70.9	67.8	0	0	0	108.5	W107 Y154	W107-H156 HydrophobicContact CB-CB 4.46Å; W107-H156 PolarHBondContact N-O 3.42Å; Y154-H156 PolarHBondContact O-CE1 3.18Å; Y154-H156 PolarHBondContact O-N 3.01Å; Y154-H156 PolarHBondContact O-ND1 3.22Å
157	S	83.5	Confident	61.3	Low	23 Å²	23	62.3 Å²	62.3	16%	0.161	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	130.3	176.5	-41.2	0	0	0	0	110.9	A105 S155 V509	A105-S157 CarbonylContact O-C 3.6Å; A105-S157 VanDerWaalsContact O-CA 3.3Å; A105-S157 WeakPolarHBondContact O-CA 3.4Å; S155-S157 VanDerWaalsContact C-N 3.35Å; S155-S157 PolarHBondContact O-N 2.86Å; S155-S157 VanDerWaalsContact O-N 3.11Å; S157-V509 WeakPolarHBondContact O-CB 3.43Å; S157-V509 WeakPolarHBondContact O-CG2 3.25Å; S157-V509 PolarHBondContact O-N 3.47Å; S157-V509 VanDerWaalsContact O-N 3.08Å
158	V	87.5	Confident	63.7	Low	2 Å²	2	58 Å²	58	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	160.9	-175.8	-68	0	0	0	0	112	A105 W403 L427 H507	A105-V158 HydrophobicContact CB-CG2 4.29Å; A105-V158 PolarHBondContact N-O 2.79Å; A105-V158 PolarHBondContact O-N 3.39Å; V158-W403 HydrophobicContact CG1-CE3 4.4Å; V158-W403 HydrophobicContact CG1-CZ3 4.34Å; V158-L427 HydrophobicContact CG2-CD1 3.85Å; V158-H507 CarbonylContact C-O 3.42Å; V158-H507 VanDerWaalsContact CA-O 3.24Å; V158-H507 WeakPolarHBondContact CA-O 3.39Å; V158-H507 WeakPolarHBondContact CB-O 3.46Å
159	V	88	Confident	66.5	Low	1 Å²	1	51 Å²	51	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.8	173.7	-174.6	0	0	0	0	109.1	L102 V103 H507 V509 L512 I516	L102-V159 HydrophobicContact CB-CG1 4.02Å; L102-V159 HydrophobicContact CD2-CG1 4.17Å; L102-V159 HydrophobicContact CG-CG1 4.48Å; V103-V159 WeakPolarHBondContact O-CA 3.31Å; V159-H507 HydrophobicContact CB-CB 4.4Å; V159-H507 PolarHBondContact N-O 2.98Å; V159-H507 PolarHBondContact O-N 2.74Å; V159-V509 HydrophobicContact CG2-CB 4.45Å; V159-V509 HydrophobicContact CG2-CG2 3.7Å; V159-L512 HydrophobicContact CB-CD1 4.05Å; V159-L512 HydrophobicContact CG1-CD1 4.04Å; V159-L512 HydrophobicContact CG2-CB 4.49Å; V159-L512 HydrophobicContact CG2-CD1 4.31Å; V159-I516 HydrophobicContact CG2-CD1 3.58Å; V159-I516 HydrophobicContact CG2-CG1 4.25Å
160	L	87.6	Confident	69.3	Low	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	159.1	162.2	-54.4	178.3	0	0	0	108.8	V103 C164 F168 I379 L398 L427 C506	V103-L160 HydrophobicContact CB-CB 4.27Å; V103-L160 PolarHBondContact N-O 3.35Å; V103-L160 PolarHBondContact O-N 2.98Å; L160-C164 HydrophobicContact CB-CB 4.26Å; L160-F168 HydrophobicContact CD1-CE1 4.18Å; L160-F168 HydrophobicContact CD1-CE2 4.47Å; L160-F168 HydrophobicContact CD1-CZ 3.62Å; L160-I379 HydrophobicContact CD1-CD1 4.05Å; L160-L398 HydrophobicContact CD2-CD1 4Å; L160-L427 HydrophobicContact CD1-CD2 3.89Å; L160-C506 HydrophobicContact CD2-CB 3.71Å
161	T	84.8	Confident	72	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	166.3	164	91.8	0	0	0	0	110.3	T101 L102 C163 C164 L503	T101-T161 CarbonylContact O-C 3.56Å; T101-T161 VanDerWaalsContact O-CA 3.23Å; T101-T161 WeakPolarHBondContact O-CA 3.11Å; L102-T161 HydrophobicContact CD2-CG2 3.82Å; T161-C163 PolarHBondContact O-N 2.87Å; T161-C163 VanDerWaalsContact O-N 3.14Å; T161-C163 WeakPolarHBondContact OG1-CA 3.33Å; T161-C163 WeakPolarHBondContact OG1-CB 3.4Å; T161-C163 PolarHBondContact OG1-N 2.92Å; T161-C164 WeakPolarHBondContact O-CB 3.38Å; T161-C164 PolarHBondContact O-N 2.91Å; T161-L503 HydrophobicContact CG2-CD2 4.07Å; T161-L503 WeakPolarHBondContact CG2-O 3.12Å; T161-L503 PolarHBondContact OG1-O 3.09Å
162	S	77.5	Confident	74.6	Confident	6 Å²	6	34.4 Å²	34.4	4%	0.042	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.3	169.4	43.6	0	0	0	0	113.5	I100 T101 C164 I379 L535	I100-S162 WeakPolarHBondContact CD1-OG 3.34Å; T101-S162 PolarHBondContact N-OG 2.76Å; T101-S162 VanDerWaalsContact N-OG 3.16Å; T101-S162 PolarHBondContact O-N 3.15Å; S162-C164 VanDerWaalsContact C-N 3.29Å; S162-I379 WeakPolarHBondContact O-CG2 3.24Å; S162-L535 WeakPolarHBondContact O-CD1 3.38Å
163	C	73.5	Confident	77	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.007	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	6.9	171.5	-54.4	0	0	0	0	114.1	I100 T161 P165 L503 L535 I558	I100-C163 WeakPolarHBondContact CD1-SG 3.26Å; T161-C163 PolarHBondContact O-N 2.87Å; T161-C163 VanDerWaalsContact O-N 3.14Å; T161-C163 WeakPolarHBondContact OG1-CA 3.33Å; T161-C163 WeakPolarHBondContact OG1-CB 3.4Å; T161-C163 PolarHBondContact OG1-N 2.92Å; C163-P165 WeakPolarHBondContact O-CD 3.36Å; C163-L503 HydrophobicContact CB-CB 3.88Å; C163-L535 HydrophobicContact CB-CD1 4.16Å; C163-L535 VanDerWaalsContact SG-CD2 3.55Å; C163-I558 WeakPolarHBondContact O-CD1 3.3Å
164	C	76.8	Confident	78.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.007	15%	0.148	C	C	.	.			trans	-61.3	122.6	174.8	-171.5	0	0	0	0	109.8	L160 T161 S162 S166 I379	L160-C164 HydrophobicContact CB-CB 4.26Å; T161-C164 WeakPolarHBondContact O-CB 3.38Å; T161-C164 PolarHBondContact O-N 2.91Å; S162-C164 VanDerWaalsContact C-N 3.29Å; C164-S166 PolarHBondContact O-N 2.83Å; C164-S166 PolarHBondContact SG-OG 2.99Å; C164-I379 HydrophobicContact CB-CG2 4.11Å
165	P	69.2	Low	79.6	Confident	18 Å²	18	23.6 Å²	23.6	12%	0.117	13%	0.125	C	C	.	.			trans	-79.3	2.4	-175.5	36.1	-39.6	0	0	0	113.1	C163 A504 A554 S557	C163-P165 WeakPolarHBondContact O-CD 3.36Å; P165-A504 WeakPolarHBondContact CD-O 3.4Å; P165-A504 HydrophobicContact CG-CB 4.41Å; P165-A554 VanDerWaalsContact CB-CA 3.46Å; P165-A554 HydrophobicContact CB-CB 3.51Å; P165-A554 HydrophobicContact CG-CB 3.76Å; P165-S557 WeakPolarHBondContact O-CB 2.96Å; P165-S557 PolarHBondContact O-OG 3.44Å
166	S	77.9	Confident	79.9	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.014	12%	0.122	C	C	.	.			trans	-84.7	147.7	-167.7	-56.2	0	0	0	0	111.3	C164 F168 V396 G397 L398	C164-S166 PolarHBondContact O-N 2.83Å; C164-S166 PolarHBondContact SG-OG 2.99Å; S166-F168 WeakPolarHBondContact O-CD2 3.39Å; S166-F168 WeakPolarHBondContact O-CE2 3.44Å; S166-V396 VanDerWaalsContact CA-O 3.27Å; S166-V396 WeakPolarHBondContact CA-O 3.45Å; S166-V396 WeakPolarHBondContact CB-O 3.49Å; S166-G397 VanDerWaalsContact OG-C 3.29Å; S166-G397 PolarHBondContact OG-O 3.48Å; S166-L398 WeakPolarHBondContact OG-CG 3.49Å
167	W	83.9	Confident	79.2	Confident	1 Å²	1	22.4 Å²	22.4	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.9	-179.9	-69.3	86.8	0	0	0	110.1	L207 V254 V338 V376 H377 V395 V396 S557 A560 I561 L564	W167-L207 HydrophobicContact CB-CD2 3.44Å; W167-L207 VanDerWaalsContact CB-CD2 3.44Å; W167-L207 HydrophobicContact CD2-CD1 3.86Å; W167-L207 HydrophobicContact CD2-CD2 3.88Å; W167-L207 HydrophobicContact CD2-CG 4.46Å; W167-L207 HydrophobicContact CE3-CD2 4.41Å; W167-L207 HydrophobicContact CG-CD1 3.83Å; W167-L207 HydrophobicContact CG-CD2 3.42Å; W167-L207 VanDerWaalsContact CG-CD2 3.42Å; W167-L207 HydrophobicContact CG-CG 4.28Å; W167-L207 HydrophobicContact CZ2-CD1 4.42Å; W167-V254 HydrophobicContact CH2-CG2 3.96Å; W167-V254 HydrophobicContact CZ2-CG2 3.63Å; W167-V338 HydrophobicContact CH2-CG1 4.17Å; W167-V338 HydrophobicContact CZ3-CG1 3.72Å; W167-V376 HydrophobicContact CE3-CB 4.36Å; W167-V376 HydrophobicContact CE3-CG2 3.9Å; W167-V376 HydrophobicContact CZ3-CG2 4.47Å; W167-H377 WeakPolarHBondContact CA-O 3.46Å; W167-H377 VanDerWaalsContact CE3-C 3.45Å; W167-V395 HydrophobicContact CB-CB 4.45Å; W167-V395 PolarHBondContact O-N 3.11Å; W167-V396 PolarHBondContact N-O 2.89Å; W167-S557 PolarHBondContact NE1-OG 3.14Å; W167-A560 HydrophobicContact CZ2-CB 4Å; W167-I561 HydrophobicContact CH2-CG1 4.5Å; W167-L564 HydrophobicContact CH2-CD1 4.06Å; W167-L564 HydrophobicContact CZ3-CD1 4.41Å
168	F	86	Confident	77.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.9	-170.3	-61.3	-86.4	0	0	0	110.1	L160 S166 H377 I379 L382 R393 P394 L398 L427	L160-F168 HydrophobicContact CD1-CE1 4.18Å; L160-F168 HydrophobicContact CD1-CE2 4.47Å; L160-F168 HydrophobicContact CD1-CZ 3.62Å; S166-F168 WeakPolarHBondContact O-CD2 3.39Å; S166-F168 WeakPolarHBondContact O-CE2 3.44Å; F168-H377 PolarHBondContact N-O 3.44Å; F168-H377 PolarHBondContact O-N 2.88Å; F168-I379 HydrophobicContact CE2-CB 4.07Å; F168-I379 HydrophobicContact CE2-CD1 4.31Å; F168-L382 HydrophobicContact CB-CD1 3.7Å; F168-L382 HydrophobicContact CD2-CD1 4.21Å; F168-L382 HydrophobicContact CG-CD1 3.98Å; F168-R393 WeakPolarHBondContact CA-O 3.46Å; F168-P394 HydrophobicContact CE1-CG 4.42Å; F168-L398 HydrophobicContact CE1-CD1 3.95Å; F168-L398 HydrophobicContact CZ-CD1 3.75Å; F168-L427 HydrophobicContact CE1-CD2 3.78Å
169	E	88.6	Confident	76.2	Confident	3 Å²	3	32.6 Å²	32.6	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.4	165.6	158.9	167.4	-142.3	0	0	108.1	V171 V189 T392 R393 V395	E169-V171 HydrophobicContact CG-CG2 4.42Å; E169-V189 HydrophobicContact CB-CG2 4.36Å; E169-V189 HydrophobicContact CG-CB 4.38Å; E169-V189 HydrophobicContact CG-CG2 3.92Å; E169-V189 PolarHBondContact OE1-N 3Å; E169-T392 CarbonylContact O-C 3.58Å; E169-T392 VanDerWaalsContact O-CA 3.22Å; E169-T392 WeakPolarHBondContact O-CA 3.29Å; E169-R393 HydrophobicContact CB-CB 4.26Å; E169-R393 VanDerWaalsContact CD-NH1 3.27Å; E169-R393 HydrophobicContact CG-CB 4.39Å; E169-R393 PolarHBondContact N-O 3.28Å; E169-R393 PolarHBondContact O-N 3.01Å; E169-R393 IonicContact OE1-NH1 2.65Å; E169-R393 PolarHBondContact OE1-NH1 3.3Å; E169-R393 IonicContact OE2-CZ 3.87Å; E169-R393 IonicContact OE2-NE 3.21Å; E169-R393 IonicContact OE2-NH1 4Å; E169-R393 PolarHBondContact OE2-NH1 3.01Å; E169-V395 HydrophobicContact CB-CG2 3.54Å
170	L	88.3	Confident	74.7	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.7	178	-179.4	63	0	0	0	109.1	R172 R173 C186 L382 Y386 L390 T392	L170-R172 WeakPolarHBondContact CD1-O 3.48Å; L170-R173 HydrophobicContact CD1-CB 4.37Å; L170-R173 HydrophobicContact CD2-CB 4.2Å; L170-C186 HydrophobicContact CG-CB 4.45Å; L170-C186 VanDerWaalsContact O-CB 3.27Å; L170-C186 WeakPolarHBondContact O-CB 3.34Å; L170-L382 HydrophobicContact CB-CD2 4.43Å; L170-L382 HydrophobicContact CD1-CD2 4.4Å; L170-Y386 HydrophobicContact CD2-CD1 4.23Å; L170-Y386 HydrophobicContact CD2-CD2 3.94Å; L170-Y386 HydrophobicContact CD2-CE1 3.81Å; L170-Y386 HydrophobicContact CD2-CE2 3.5Å; L170-Y386 HydrophobicContact CD2-CG 4.29Å; L170-Y386 VanDerWaalsContact CD2-CZ 3.43Å; L170-L390 HydrophobicContact CD1-CB 4.28Å; L170-L390 HydrophobicContact CD1-CD2 4.18Å; L170-T392 HydrophobicContact CD1-CG2 4.31Å
171	V	87	Confident	73.3	Confident	36 Å²	36	41.7 Å²	41.7	22%	0.218	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-40.7	-177.2	179.9	0	0	0	0	111.1	E169 C186 I391 R393 L426	E169-V171 HydrophobicContact CG-CG2 4.42Å; V171-C186 PolarHBondContact O-N 2.68Å; V171-I391 PolarHBondContact N-O 3.49Å; V171-R393 HydrophobicContact CG2-CB 3.87Å; V171-L426 HydrophobicContact CG2-CD2 4.05Å
172	R	84.4	Confident	72.2	Confident	95 Å²	95	43 Å²	43	36%	0.358	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	137.5	174.3	-160.7	-175.4	-173.4	177.5	2.3	110.1	L170 Q184 I391	L170-R172 WeakPolarHBondContact CD1-O 3.48Å; R172-Q184 WeakPolarHBondContact CA-O 3.24Å; R172-Q184 HydrophobicContact CG-CG 4.2Å; R172-Q184 WeakPolarHBondContact CG-O 3.39Å; R172-Q184 VanDerWaalsContact NE-OE1 3.12Å; R172-I391 HydrophobicContact CB-CB 3.87Å; R172-I391 HydrophobicContact CB-CD1 4.13Å; R172-I391 HydrophobicContact CB-CG1 4.11Å; R172-I391 PolarHBondContact N-O 3.29Å; R172-I391 PolarHBondContact O-N 3.35Å
173	R	84	Confident	71.6	Confident	36 Å²	36	46.8 Å²	46.8	14%	0.136	28%	0.282	C	S	.	.			trans	-121.2	160.6	174	65.4	-178.3	-167.6	88.9	-16.5	111.4	L170 D180 Q184 L390	L170-R173 HydrophobicContact CD1-CB 4.37Å; L170-R173 HydrophobicContact CD2-CB 4.2Å; R173-D180 IonicContact CZ-OD1 3.75Å; R173-D180 IonicContact CZ-OD2 3.69Å; R173-D180 IonicContact NH1-OD1 2.75Å; R173-D180 PolarHBondContact NH1-OD1 2.83Å; R173-D180 IonicContact NH1-OD2 3.84Å; R173-D180 PolarHBondContact NH1-OD2 3.09Å; R173-D180 IonicContact NH2-OD1 2.67Å; R173-D180 PolarHBondContact NH2-OD1 2.69Å; R173-D180 IonicContact NH2-OD2 3.66Å; R173-Q184 PolarHBondContact N-O 2.91Å; R173-Q184 WeakPolarHBondContact O-CG 3.32Å; R173-L390 HydrophobicContact CB-CD2 3.95Å
174	N	74.8	Confident	71.5	Confident	69 Å²	69	50.6 Å²	50.6	37%	0.369	30%	0.299	S	S	.	.			trans	-72.4	151.8	164.9	-155.4	-1.3	0	0	0	110.2
175	V	65.5	Low	71.5	Confident	49 Å²	49	55.7 Å²	55.7	30%	0.297	33%	0.325	S	S	.	.			trans	-114.6	119.6	180	170.3	0	0	0	0	108.2	G177 D180 Q184	V175-G177 PolarHBondContact O-N 2.82Å; V175-D180 WeakPolarHBondContact CA-OD2 3.35Å; V175-D180 HydrophobicContact CG1-CB 4Å; V175-D180 VanDerWaalsContact CG1-O 3.29Å; V175-D180 WeakPolarHBondContact CG1-O 3.26Å; V175-Q184 HydrophobicContact CG2-CB 3.86Å; V175-Q184 HydrophobicContact CG2-CG 3.98Å
176	I	60.2	Low	71.9	Confident	74 Å²	74	55.7 Å²	55.7	38%	0.379	33%	0.326	S	S	.	.			trans	-99.9	82.2	-163.7	-51.1	166.9	0	0	0	110.5	D180 R387	I176-D180 PolarHBondContact N-OD2 2.78Å; I176-R387 HydrophobicContact CD1-CB 3.99Å; I176-R387 HydrophobicContact CD1-CG 3.68Å
177	G	55.1	Low	71.9	Confident	47 Å²	47	58.7 Å²	58.7	49%	0.485	35%	0.345	S	S	.	.	S	Bend	trans	73.7	-176.4	172.9	0	0	0	0	0	114.7	V175 S179 D180	V175-G177 PolarHBondContact O-N 2.82Å; G177-S179 PolarHBondContact O-N 3.41Å; G177-S179 VanDerWaalsContact O-N 3.11Å; G177-D180 PolarHBondContact O-N 2.98Å
178	P	54.3	Low	71.8	Confident	136 Å²	136	65 Å²	65	88%	0.883	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.3	-167.9	29.9	-36.9	0	0	0	115.2
179	S	53.5	Low	71.8	Confident	103 Å²	103	65.2 Å²	65.2	72%	0.72	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-19.8	174.9	49.6	0	0	0	0	113.7	G177 N181	G177-S179 PolarHBondContact O-N 3.41Å; G177-S179 VanDerWaalsContact O-N 3.11Å; S179-N181 PolarHBondContact O-N 3.17Å; S179-N181 VanDerWaalsContact O-N 3.1Å
180	D	56.8	Low	71.7	Confident	39 Å²	39	67.7 Å²	67.7	21%	0.209	39%	0.392	C	S	.	.			trans	-88.4	72.3	-173.6	-173.8	7.2	0	0	0	111	R173 V175 I176 G177 G182	R173-D180 IonicContact CZ-OD1 3.75Å; R173-D180 IonicContact CZ-OD2 3.69Å; R173-D180 IonicContact NH1-OD1 2.75Å; R173-D180 PolarHBondContact NH1-OD1 2.83Å; R173-D180 IonicContact NH1-OD2 3.84Å; R173-D180 PolarHBondContact NH1-OD2 3.09Å; R173-D180 IonicContact NH2-OD1 2.67Å; R173-D180 PolarHBondContact NH2-OD1 2.69Å; R173-D180 IonicContact NH2-OD2 3.66Å; V175-D180 WeakPolarHBondContact CA-OD2 3.35Å; V175-D180 HydrophobicContact CG1-CB 4Å; V175-D180 VanDerWaalsContact CG1-O 3.29Å; V175-D180 WeakPolarHBondContact CG1-O 3.26Å; I176-D180 PolarHBondContact N-OD2 2.78Å; G177-D180 PolarHBondContact O-N 2.98Å; D180-G182 PolarHBondContact O-N 3.12Å
181	N	56.4	Low	71.6	Confident	153 Å²	153	70.6 Å²	70.6	82%	0.818	41%	0.41	S	S	*	.			trans	-70.6	7.3	-174.7	-70	-37.5	0	0	0	115.1	S179	S179-N181 PolarHBondContact O-N 3.17Å; S179-N181 VanDerWaalsContact O-N 3.1Å
182	G	62.4	Low	71.7	Confident	28 Å²	28	70.2 Å²	70.2	29%	0.289	41%	0.405	S	S	.	.	S	Bend	trans	-78.8	153.6	179.5	0	0	0	0	0	112.8	D180	D180-G182 PolarHBondContact O-N 3.12Å
183	P	65.9	Low	71.9	Confident	85 Å²	85	69.3 Å²	69.3	55%	0.552	41%	0.413	S	S	*	.			trans	-67.7	138.9	-179	30.8	-36.4	0	0	0	111	I185	P183-I185 VanDerWaalsContact C-N 3.31Å; P183-I185 WeakPolarHBondContact CB-O 3.44Å; P183-I185 PolarHBondContact O-N 3.35Å
184	Q	69.6	Low	72	Confident	81 Å²	81	68.7 Å²	68.7	38%	0.379	41%	0.414	S	S	.	.	S	Bend	trans	-67.6	-34.3	179.2	-164.4	-171.4	55.5	0	0	112	R172 R173 V175	R172-Q184 WeakPolarHBondContact CA-O 3.24Å; R172-Q184 HydrophobicContact CG-CG 4.2Å; R172-Q184 WeakPolarHBondContact CG-O 3.39Å; R172-Q184 VanDerWaalsContact NE-OE1 3.12Å; R173-Q184 PolarHBondContact N-O 2.91Å; R173-Q184 WeakPolarHBondContact O-CG 3.32Å; V175-Q184 HydrophobicContact CG2-CB 3.86Å; V175-Q184 HydrophobicContact CG2-CG 3.98Å
185	I	77.2	Confident	72.7	Confident	107 Å²	107	65.4 Å²	65.4	55%	0.549	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-90.6	122.6	168.9	-59.1	173.3	0	0	0	106.8	P183	P183-I185 VanDerWaalsContact C-N 3.31Å; P183-I185 WeakPolarHBondContact CB-O 3.44Å; P183-I185 PolarHBondContact O-N 3.35Å
186	C	78.8	Confident	73.7	Confident	19 Å²	19	67.7 Å²	67.7	13%	0.128	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-83.6	144.9	177.6	-62.9	0	0	0	0	110	L170 V171	L170-C186 HydrophobicContact CG-CB 4.45Å; L170-C186 VanDerWaalsContact O-CB 3.27Å; L170-C186 WeakPolarHBondContact O-CB 3.34Å; V171-C186 PolarHBondContact O-N 2.68Å
187	P	77.5	Confident	75	Confident	65 Å²	65	65.7 Å²	65.7	42%	0.422	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-70.3	150.1	175.9	31.7	-35.9	0	0	0	111.1	V189 N374	P187-V189 PolarHBondContact O-N 2.8Å; P187-N374 WeakPolarHBondContact CD-OD1 3.39Å; P187-N374 HydrophobicContact CG-CB 4.27Å; P187-N374 VanDerWaalsContact CG-CG 3.43Å; P187-N374 WeakPolarHBondContact CG-ND2 3.46Å; P187-N374 WeakPolarHBondContact CG-OD1 3.2Å
188	E	81.3	Confident	76.6	Confident	133 Å²	133	63.4 Å²	63.4	62%	0.621	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-60.5	132.6	-179.9	-176.2	155.1	-110.1	0	0	111.8	R393	E188-R393 IonicContact OE1-CZ 3.73Å; E188-R393 IonicContact OE1-NH1 3.67Å; E188-R393 PolarHBondContact OE1-NH1 2.95Å; E188-R393 IonicContact OE1-NH2 2.75Å; E188-R393 PolarHBondContact OE1-NH2 3.46Å
189	V	86.4	Confident	78.1	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73	123.1	-174.5	174.7	0	0	0	0	109.3	E169 P187 P337 V376	E169-V189 HydrophobicContact CB-CG2 4.36Å; E169-V189 HydrophobicContact CG-CB 4.38Å; E169-V189 HydrophobicContact CG-CG2 3.92Å; E169-V189 PolarHBondContact OE1-N 3Å; P187-V189 PolarHBondContact O-N 2.8Å; V189-P337 HydrophobicContact CG1-CG 4.16Å; V189-V376 HydrophobicContact CG1-CG1 4.07Å
190	P	85.4	Confident	79.7	Confident	56 Å²	56	58.4 Å²	58.4	36%	0.364	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.4	-171.6	22.4	-33.1	0	0	0	112.4	W192 S336 P337	P190-W192 HydrophobicContact CG-CZ2 4.34Å; P190-S336 WeakPolarHBondContact O-CA 3.41Å; P190-S336 WeakPolarHBondContact O-CB 3.34Å; P190-S336 PolarHBondContact O-OG 3.13Å; P190-P337 HydrophobicContact CG-CG 3.88Å; P190-P337 WeakPolarHBondContact O-CD 3.21Å
191	V	87.9	Confident	81	Confident	68 Å²	68	57.8 Å²	57.8	41%	0.412	33%	0.329	S	S	.	.			trans	-116.9	121.1	179.2	-173.1	0	0	0	0	109.5	M334 C335	V191-M334 HydrophobicContact CG1-CG 3.5Å; V191-M334 VanDerWaalsContact CG1-CG 3.5Å; V191-M334 HydrophobicContact CG1-SD 4.24Å; V191-C335 CarbonylContact C-O 3.3Å; V191-C335 WeakPolarHBondContact CA-O 3.4Å
192	W	88.8	Confident	82.5	Confident	27 Å²	27	54.7 Å²	54.7	10%	0.102	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-101	108.1	178	-57.5	-50.1	0	0	0	110.1	P190 S194 A197 V198 A201 P203 I206 M334 C335 P337	P190-W192 HydrophobicContact CG-CZ2 4.34Å; W192-S194 PolarHBondContact O-N 2.79Å; W192-A197 HydrophobicContact CB-CB 4.09Å; W192-A197 HydrophobicContact CG-CB 3.83Å; W192-V198 HydrophobicContact CB-CG2 3.7Å; W192-V198 HydrophobicContact CD2-CG2 4.18Å; W192-V198 HydrophobicContact CE3-CG2 3.91Å; W192-V198 HydrophobicContact CG-CG2 4.15Å; W192-A201 HydrophobicContact CH2-CB 3.94Å; W192-A201 HydrophobicContact CZ2-CB 3.31Å; W192-P203 HydrophobicContact CH2-CB 3.96Å; W192-P203 HydrophobicContact CH2-CG 3.79Å; W192-P203 HydrophobicContact CZ3-CB 4.11Å; W192-P203 HydrophobicContact CZ3-CG 3.65Å; W192-I206 HydrophobicContact CZ3-CG2 4.04Å; W192-M334 WeakPolarHBondContact O-CA 3.3Å; W192-C335 PolarHBondContact N-O 3.16Å; W192-C335 PolarHBondContact O-N 2.8Å; W192-C335 VanDerWaalsContact O-N 3.13Å; W192-P337 HydrophobicContact CH2-CB 3.78Å; W192-P337 HydrophobicContact CH2-CG 3.82Å; W192-P337 HydrophobicContact CZ3-CB 4.04Å; W192-P337 VanDerWaalsContact CZ3-CD 3.49Å; W192-P337 HydrophobicContact CZ3-CG 4.2Å
193	S	87.3	Confident	83.6	Confident	77 Å²	77	53.7 Å²	53.7	54%	0.538	30%	0.296	S	S	.	.	S	Bend	trans	-76.8	-1.7	174.6	56.2	0	0	0	0	114	K331 I333	S193-K331 CarbonylContact O-C 3.57Å; S193-K331 WeakPolarHBondContact O-CA 3.35Å; S193-I333 CarbonylContact C-O 3.54Å; S193-I333 VanDerWaalsContact CA-O 3.29Å; S193-I333 WeakPolarHBondContact CA-O 3.18Å; S193-I333 VanDerWaalsContact O-O 3.09Å
194	S	87.3	Confident	84.4	Confident	22 Å²	22	53.6 Å²	53.6	15%	0.154	29%	0.287	C	S	.	.	S	Bend	trans	-149.3	138.8	-179.7	55.1	0	0	0	0	108.7	W192 K196 A197 S330	W192-S194 PolarHBondContact O-N 2.79Å; S194-K196 PolarHBondContact O-N 2.86Å; S194-A197 PolarHBondContact O-N 2.88Å; S194-A197 VanDerWaalsContact O-N 3.13Å; S194-S330 WeakPolarHBondContact CB-O 3.49Å
195	C	88.1	Confident	85.3	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-17.8	171.4	-63.9	0	0	0	0	111.2	A197 V198 W199 L288 L328 S330 I333	C195-A197 PolarHBondContact O-N 3.35Å; C195-V198 WeakPolarHBondContact O-CA 3.29Å; C195-V198 VanDerWaalsContact O-CB 3.29Å; C195-V198 WeakPolarHBondContact O-CB 3.38Å; C195-V198 PolarHBondContact O-N 3.35Å; C195-V198 VanDerWaalsContact O-N 3.08Å; C195-W199 PolarHBondContact O-N 3.35Å; C195-L288 HydrophobicContact CB-CD1 3.63Å; C195-L288 HydrophobicContact CB-CG 4.44Å; C195-L328 HydrophobicContact CB-CB 3.56Å; C195-L328 HydrophobicContact CB-CD2 3.48Å; C195-L328 VanDerWaalsContact CB-CD2 3.48Å; C195-L328 HydrophobicContact CB-CG 3.26Å; C195-L328 WeakPolarHBondContact O-CD2 3.37Å; C195-S330 WeakPolarHBondContact CB-OG 3.47Å; C195-S330 VanDerWaalsContact N-CB 3.32Å; C195-S330 PolarHBondContact N-OG 2.73Å; C195-S330 PolarHBondContact SG-OG 2.91Å; C195-I333 VanDerWaalsContact N-CG2 3.34Å; C195-I333 WeakPolarHBondContact SG-CD1 3.47Å
196	K	87.4	Confident	85.7	Confident	98 Å²	98	44.9 Å²	44.9	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-46.9	-57.2	169.1	177.7	121.1	-146.5	140.7	0	112.2	S194 V198 L200 Y578	S194-K196 PolarHBondContact O-N 2.86Å; K196-V198 VanDerWaalsContact C-N 3.28Å; K196-V198 PolarHBondContact O-N 2.98Å; K196-L200 HydrophobicContact CG-CD1 4.12Å; K196-L200 VanDerWaalsContact O-CG 3.31Å; K196-L200 WeakPolarHBondContact O-CG 3.32Å; K196-L200 PolarHBondContact O-N 2.94Å; K196-Y578 VanDerWaalsContact CA-CE1 3.49Å; K196-Y578 WeakPolarHBondContact CA-OH 3.1Å; K196-Y578 HydrophobicContact CB-CE1 3.57Å; K196-Y578 HydrophobicContact CD-CD1 4.25Å; K196-Y578 HydrophobicContact CD-CE1 3.35Å; K196-Y578 VanDerWaalsContact CE-CZ 3.48Å; K196-Y578 WeakPolarHBondContact CE-OH 3.48Å; K196-Y578 HydrophobicContact CG-CE1 3.66Å; K196-Y578 WeakPolarHBondContact CG-OH 3.3Å; K196-Y578 PolarHBondContact NZ-OH 3.34Å; K196-Y578 PolarHBondContact O-OH 3.5Å; K196-Y578 VanDerWaalsContact O-OH 3.06Å
197	A	88.2	Confident	86.1	Confident	31 Å²	31	44 Å²	44	26%	0.256	24%	0.238	S	C	.	.	H	α-helix	trans	-71	-27.8	-179.1	0	0	0	0	0	111.7	W192 S194 C195 L200 A201	W192-A197 HydrophobicContact CB-CB 4.09Å; W192-A197 HydrophobicContact CG-CB 3.83Å; S194-A197 PolarHBondContact O-N 2.88Å; S194-A197 VanDerWaalsContact O-N 3.13Å; C195-A197 PolarHBondContact O-N 3.35Å; A197-L200 PolarHBondContact O-N 3.42Å; A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.28Å; A197-A201 PolarHBondContact O-N 3.49Å
198	V	87.2	Confident	86.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-56.6	174.1	179.3	0	0	0	0	112.2	W192 C195 K196 L200 A201 K202 P203 I206 L257 C335	W192-V198 HydrophobicContact CB-CG2 3.7Å; W192-V198 HydrophobicContact CD2-CG2 4.18Å; W192-V198 HydrophobicContact CE3-CG2 3.91Å; W192-V198 HydrophobicContact CG-CG2 4.15Å; C195-V198 WeakPolarHBondContact O-CA 3.29Å; C195-V198 VanDerWaalsContact O-CB 3.29Å; C195-V198 WeakPolarHBondContact O-CB 3.38Å; C195-V198 PolarHBondContact O-N 3.35Å; C195-V198 VanDerWaalsContact O-N 3.08Å; K196-V198 VanDerWaalsContact C-N 3.28Å; K196-V198 PolarHBondContact O-N 2.98Å; V198-L200 VanDerWaalsContact C-N 3.29Å; V198-L200 PolarHBondContact O-N 3.38Å; V198-A201 PolarHBondContact O-N 3.4Å; V198-K202 PolarHBondContact O-N 2.88Å; V198-K202 VanDerWaalsContact O-N 3.09Å; V198-P203 HydrophobicContact CG1-CG 4.29Å; V198-P203 WeakPolarHBondContact O-CD 3.31Å; V198-I206 HydrophobicContact CG1-CD1 3.84Å; V198-I206 HydrophobicContact CG1-CG2 4.07Å; V198-L257 HydrophobicContact CG1-CD2 3.68Å; V198-C335 WeakPolarHBondContact CG2-SG 3.06Å
199	W	87.1	Confident	86.5	Confident	34 Å²	34	36.6 Å²	36.6	13%	0.129	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-43.7	175.9	164.3	-75.9	0	0	0	110.3	C195 A201 K202 D259 C260 L288 L328 P574 N575 D576	C195-W199 PolarHBondContact O-N 3.35Å; W199-A201 VanDerWaalsContact C-N 3.28Å; W199-A201 PolarHBondContact O-N 2.96Å; W199-K202 VanDerWaalsContact CZ2-NZ 3.35Å; W199-K202 WeakPolarHBondContact O-CG 3.34Å; W199-K202 PolarHBondContact O-N 2.87Å; W199-D259 VanDerWaalsContact CZ3-OD1 3.25Å; W199-D259 WeakPolarHBondContact CZ3-OD1 3.18Å; W199-C260 HydrophobicContact CE3-CB 3.75Å; W199-C260 HydrophobicContact CZ3-CB 3.25Å; W199-C260 VanDerWaalsContact CZ3-N 3.32Å; W199-L288 HydrophobicContact CB-CD2 4.2Å; W199-L328 HydrophobicContact CB-CD2 4.04Å; W199-P574 WeakPolarHBondContact CH2-O 3.1Å; W199-N575 HydrophobicContact CD2-CB 4.2Å; W199-N575 HydrophobicContact CE3-CB 3.76Å; W199-N575 VanDerWaalsContact CE3-O 3.27Å; W199-N575 HydrophobicContact CH2-CB 4.5Å; W199-N575 WeakPolarHBondContact CH2-O 3.08Å; W199-N575 WeakPolarHBondContact CZ2-O 3.47Å; W199-N575 HydrophobicContact CZ3-CB 3.97Å; W199-N575 PolarHBondContact NE1-O 3.36Å; W199-D576 HydrophobicContact CD2-CB 4.04Å; W199-D576 HydrophobicContact CH2-CB 4.03Å; W199-D576 HydrophobicContact CZ2-CB 3.25Å; W199-D576 PolarHBondContact NE1-OD1 3.13Å
200	L	86.6	Confident	86.2	Confident	99 Å²	99	40.7 Å²	40.7	52%	0.518	21%	0.213	S	C	.	.	H	α-helix	trans	-64.7	-32.4	-174.3	-70.2	171.7	0	0	0	112.6	K196 A197 V198	K196-L200 HydrophobicContact CG-CD1 4.12Å; K196-L200 VanDerWaalsContact O-CG 3.31Å; K196-L200 WeakPolarHBondContact O-CG 3.32Å; K196-L200 PolarHBondContact O-N 2.94Å; A197-L200 PolarHBondContact O-N 3.42Å; V198-L200 VanDerWaalsContact C-N 3.29Å; V198-L200 PolarHBondContact O-N 3.38Å
201	A	85.1	Confident	85.9	Confident	27 Å²	27	41.1 Å²	41.1	22%	0.223	21%	0.213	C	C	.	.	H	α-helix	trans	-83	-14.7	174.2	0	0	0	0	0	114.3	W192 A197 V198 W199 F372	W192-A201 HydrophobicContact CH2-CB 3.94Å; W192-A201 HydrophobicContact CZ2-CB 3.31Å; A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.28Å; A197-A201 PolarHBondContact O-N 3.49Å; V198-A201 PolarHBondContact O-N 3.4Å; W199-A201 VanDerWaalsContact C-N 3.28Å; W199-A201 PolarHBondContact O-N 2.96Å; A201-F372 WeakPolarHBondContact O-CZ 3.49Å
202	K	87.3	Confident	85.6	Confident	88 Å²	88	37.9 Å²	37.9	38%	0.383	19%	0.193	S	C	.	.			trans	50.8	41.4	175.6	-53.5	170.6	-175.6	-75.6	0	116.3	V198 W199 P574 N575	V198-K202 PolarHBondContact O-N 2.88Å; V198-K202 VanDerWaalsContact O-N 3.09Å; W199-K202 VanDerWaalsContact CZ2-NZ 3.35Å; W199-K202 WeakPolarHBondContact O-CG 3.34Å; W199-K202 PolarHBondContact O-N 2.87Å; K202-P574 HydrophobicContact CD-CB 3.67Å; K202-P574 HydrophobicContact CD-CG 4.03Å; K202-P574 HydrophobicContact CG-CB 4.13Å; K202-N575 WeakPolarHBondContact CA-ND2 3.3Å; K202-N575 PolarHBondContact NZ-O 2.86Å
203	P	85.6	Confident	85.4	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.039	19%	0.189	C	C	.	.			trans	-66.5	142	179.3	32.1	-38.1	0	0	0	112.1	W192 V198 F205 I206 L257 P337	W192-P203 HydrophobicContact CH2-CB 3.96Å; W192-P203 HydrophobicContact CH2-CG 3.79Å; W192-P203 HydrophobicContact CZ3-CB 4.11Å; W192-P203 HydrophobicContact CZ3-CG 3.65Å; V198-P203 HydrophobicContact CG1-CG 4.29Å; V198-P203 WeakPolarHBondContact O-CD 3.31Å; P203-F205 VanDerWaalsContact C-N 3.35Å; P203-F205 PolarHBondContact O-N 3.25Å; P203-I206 HydrophobicContact CB-CG2 4.02Å; P203-I206 HydrophobicContact CG-CG2 3.34Å; P203-L257 HydrophobicContact CG-CD2 4.17Å; P203-L257 WeakPolarHBondContact O-CB 3.43Å; P203-P337 HydrophobicContact CB-CB 4.35Å
204	K	83.5	Confident	85.3	Confident	84 Å²	84	33.3 Å²	33.3	37%	0.365	17%	0.165	S	C	.	.	S	Bend	trans	-62.6	-39.8	175.7	-170.3	176	177.6	175.6	0	112.2	L257 H567	K204-L257 PolarHBondContact O-N 3.32Å; K204-H567 PolarHBondContact NZ-O 3.37Å
205	F	86.8	Confident	85	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.5	179	-59.9	-78.8	0	0	0	111.4	P203 V254 L255 Q256 V293 V338 T340 L564 H567	P203-F205 VanDerWaalsContact C-N 3.35Å; P203-F205 PolarHBondContact O-N 3.25Å; F205-V254 HydrophobicContact CB-CG1 4.04Å; F205-V254 HydrophobicContact CD1-CG1 4.41Å; F205-L255 WeakPolarHBondContact CA-O 3.27Å; F205-Q256 HydrophobicContact CD1-CB 3.8Å; F205-Q256 HydrophobicContact CD1-CG 4.11Å; F205-Q256 HydrophobicContact CE1-CB 3.73Å; F205-Q256 HydrophobicContact CE1-CG 3.8Å; F205-V293 HydrophobicContact CD1-CG2 4.05Å; F205-V293 HydrophobicContact CE1-CG2 4.25Å; F205-V338 HydrophobicContact CB-CB 4.03Å; F205-V338 HydrophobicContact CB-CG2 4.32Å; F205-V338 PolarHBondContact O-N 3.24Å; F205-V338 VanDerWaalsContact O-N 3.08Å; F205-T340 HydrophobicContact CD2-CG2 3.54Å; F205-T340 HydrophobicContact CE2-CG2 3.77Å; F205-L564 HydrophobicContact CB-CD2 4.28Å; F205-L564 HydrophobicContact CD1-CD2 4.41Å; F205-L564 HydrophobicContact CD2-CD2 3.52Å; F205-L564 HydrophobicContact CE2-CD2 3.81Å; F205-L564 HydrophobicContact CG-CD2 3.85Å; F205-L564 HydrophobicContact CZ-CD2 4.38Å; F205-H567 HydrophobicContact CZ-CB 4.28Å
206	I	87.1	Confident	84.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.3	176.2	63	-176.5	0	0	0	111.7	W192 V198 P203 V254 L255 S336	W192-I206 HydrophobicContact CZ3-CG2 4.04Å; V198-I206 HydrophobicContact CG1-CD1 3.84Å; V198-I206 HydrophobicContact CG1-CG2 4.07Å; P203-I206 HydrophobicContact CB-CG2 4.02Å; P203-I206 HydrophobicContact CG-CG2 3.34Å; I206-V254 CarbonylContact O-C 3.48Å; I206-V254 VanDerWaalsContact O-CA 3.27Å; I206-V254 WeakPolarHBondContact O-CA 3.3Å; I206-V254 WeakPolarHBondContact O-CG1 3.34Å; I206-L255 HydrophobicContact CD1-CB 4.37Å; I206-L255 HydrophobicContact CG1-CB 3.88Å; I206-L255 PolarHBondContact N-O 3.18Å; I206-L255 PolarHBondContact O-N 3.25Å; I206-S336 CarbonylContact C-O 3.56Å; I206-S336 WeakPolarHBondContact CA-O 3.39Å
207	L	86.2	Confident	83.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.1	169.9	179.6	71.7	0	0	0	109.7	W167 G252 V254 C335 S336 V338 V376 V395 V396	W167-L207 HydrophobicContact CB-CD2 3.44Å; W167-L207 VanDerWaalsContact CB-CD2 3.44Å; W167-L207 HydrophobicContact CD2-CD1 3.86Å; W167-L207 HydrophobicContact CD2-CD2 3.88Å; W167-L207 HydrophobicContact CD2-CG 4.46Å; W167-L207 HydrophobicContact CE3-CD2 4.41Å; W167-L207 HydrophobicContact CG-CD1 3.83Å; W167-L207 HydrophobicContact CG-CD2 3.42Å; W167-L207 VanDerWaalsContact CG-CD2 3.42Å; W167-L207 HydrophobicContact CG-CG 4.28Å; W167-L207 HydrophobicContact CZ2-CD1 4.42Å; L207-G252 WeakPolarHBondContact CD1-O 3.06Å; L207-V254 HydrophobicContact CB-CG2 4.43Å; L207-V254 HydrophobicContact CD1-CG2 3.65Å; L207-C335 CarbonylContact O-C 3.2Å; L207-C335 WeakPolarHBondContact O-CA 3.47Å; L207-C335 WeakPolarHBondContact O-CB 3.42Å; L207-S336 PolarHBondContact N-O 3.1Å; L207-S336 PolarHBondContact O-N 3.48Å; L207-S336 VanDerWaalsContact O-N 3.09Å; L207-V338 HydrophobicContact CB-CG2 3.87Å; L207-V376 HydrophobicContact CB-CG2 3.76Å; L207-V376 HydrophobicContact CD2-CB 4.34Å; L207-V376 HydrophobicContact CD2-CG1 4.46Å; L207-V376 HydrophobicContact CD2-CG2 3.73Å; L207-V376 HydrophobicContact CG-CG2 4.36Å; L207-V395 HydrophobicContact CD2-CG1 4.23Å; L207-V396 HydrophobicContact CD2-CG2 4.11Å
208	L	83.5	Confident	81.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124.3	167.4	-60	-174	0	0	0	110.6	L249 P251 G252 T253 L255 I333 C335	L208-L249 HydrophobicContact CD1-CB 3.51Å; L208-L249 HydrophobicContact CD1-CD1 4.16Å; L208-P251 CarbonylContact O-C 3.59Å; L208-P251 VanDerWaalsContact O-CA 3.3Å; L208-P251 WeakPolarHBondContact O-CA 3.05Å; L208-G252 PolarHBondContact O-N 3.12Å; L208-T253 PolarHBondContact N-O 2.78Å; L208-L255 HydrophobicContact CD1-CD1 4.42Å; L208-L255 HydrophobicContact CD2-CD1 4.35Å; L208-L255 HydrophobicContact CG-CD1 4.49Å; L208-I333 HydrophobicContact CD2-CD1 3.82Å; L208-I333 HydrophobicContact CD2-CG1 4.06Å; L208-C335 HydrophobicContact CD2-CB 4.16Å
209	R	83.6	Confident	80	Confident	43 Å²	43	33.4 Å²	33.4	16%	0.162	17%	0.166	C	C	.	.	S	Bend	trans	-94.4	-12.7	169.6	-57.2	-168	-172.8	-144.7	3.7	112.9	M334 S336 V395	R209-M334 WeakPolarHBondContact CA-O 3.35Å; R209-M334 HydrophobicContact CB-CB 4.3Å; R209-M334 HydrophobicContact CB-CE 3.57Å; R209-M334 HydrophobicContact CB-CG 4.14Å; R209-M334 PolarHBondContact N-O 2.76Å; R209-S336 VanDerWaalsContact CZ-OG 3.31Å; R209-S336 PolarHBondContact NE-OG 3.24Å; R209-S336 PolarHBondContact NH2-OG 3.46Å; R209-V395 HydrophobicContact CG-CG1 3.81Å
210	K	80.1	Confident	77.9	Confident	90 Å²	90	38.4 Å²	38.4	39%	0.391	20%	0.2	S	C	.	.	S	Bend	trans	-139.9	151.1	178.8	-167.3	-179.9	-173.5	-166.3	0	111.4	T212 M334	K210-T212 PolarHBondContact O-N 2.92Å; K210-T212 PolarHBondContact O-OG1 2.94Å; K210-M334 HydrophobicContact CB-CB 3.78Å; K210-M334 PolarHBondContact N-O 3.19Å
211	D	80	Confident	75.9	Confident	65 Å²	65	36.6 Å²	36.6	35%	0.348	19%	0.189	S	C	.	.			trans	-50.8	118.8	170.6	-68.9	-69.6	0	0	0	111.8	I248 L249 R250 P251 Q584	D211-I248 HydrophobicContact CB-CG2 3.97Å; D211-L249 CarbonylContact C-O 3.41Å; D211-L249 WeakPolarHBondContact CA-O 3.38Å; D211-R250 WeakPolarHBondContact OD1-CA 3.48Å; D211-P251 WeakPolarHBondContact OD1-CD 3.17Å; D211-Q584 PolarHBondContact O-NE2 3.38Å
212	T	81.5	Confident	73.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.4	-172	-56.4	0	0	0	0	110.1	K210 L249 L326 I333	K210-T212 PolarHBondContact O-N 2.92Å; K210-T212 PolarHBondContact O-OG1 2.94Å; T212-L249 PolarHBondContact N-O 2.91Å; T212-L249 WeakPolarHBondContact O-CB 3.44Å; T212-L249 PolarHBondContact O-N 2.76Å; T212-L326 HydrophobicContact CG2-CD1 4.49Å; T212-L326 HydrophobicContact CG2-CD2 4.26Å; T212-I333 HydrophobicContact CG2-CB 3.79Å; T212-I333 HydrophobicContact CG2-CD1 4.02Å; T212-I333 HydrophobicContact CG2-CG1 3.83Å
213	Q	83.5	Confident	71.6	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	148.9	-173.5	-78	163.5	-41.3	0	0	113.6	I246 G247 I248 L326 I583	Q213-I246 HydrophobicContact CB-CG2 4.39Å; Q213-I246 HydrophobicContact CG-CG2 4.4Å; Q213-G247 CarbonylContact C-O 2.9Å; Q213-G247 VanDerWaalsContact CA-O 3.3Å; Q213-G247 WeakPolarHBondContact CA-O 3.27Å; Q213-I248 HydrophobicContact CG-CG1 3.69Å; Q213-L326 WeakPolarHBondContact O-CD2 3.24Å; Q213-I583 VanDerWaalsContact CD-C 3.46Å; Q213-I583 PolarHBondContact NE2-O 3.39Å; Q213-I583 VanDerWaalsContact OE1-CA 3.28Å; Q213-I583 VanDerWaalsContact OE1-CB 3.31Å; Q213-I583 PolarHBondContact OE1-O 3.03Å
214	C	85.5	Confident	69.4	Low	4 Å²	4	40.1 Å²	40.1	3%	0.027	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160.4	-175	63.8	0	0	0	0	112	F216 G247 L249 V324 Y325 L326	C214-F216 VanDerWaalsContact SG-CE2 3.53Å; C214-G247 PolarHBondContact N-O 2.74Å; C214-G247 PolarHBondContact O-N 3.15Å; C214-L249 HydrophobicContact CB-CD1 4.07Å; C214-L249 HydrophobicContact CB-CG 4.26Å; C214-V324 HydrophobicContact CB-CB 3.99Å; C214-V324 HydrophobicContact CB-CG1 4.27Å; C214-Y325 WeakPolarHBondContact CA-O 3.09Å; C214-L326 HydrophobicContact CB-CD2 3.54Å
215	L	81.6	Confident	67.3	Low	10 Å²	10	39.7 Å²	39.7	5%	0.052	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.3	161	-63.5	177.8	0	0	0	109.6	L241 I246 L265 M287 V324 Y325	L215-L241 HydrophobicContact CB-CD1 4.2Å; L215-L241 HydrophobicContact CD1-CB 4.14Å; L215-L241 HydrophobicContact CD1-CD1 4.03Å; L215-I246 HydrophobicContact CD2-CB 4.36Å; L215-I246 HydrophobicContact CD2-CG1 3.58Å; L215-L265 HydrophobicContact CD1-CD2 3.46Å; L215-L265 VanDerWaalsContact CD1-CD2 3.46Å; L215-M287 HydrophobicContact CB-CE 4.44Å; L215-M287 HydrophobicContact CD1-CE 3.85Å; L215-M287 HydrophobicContact CD1-SD 4.31Å; L215-M287 HydrophobicContact CG-CE 4.2Å; L215-V324 WeakPolarHBondContact O-CA 3.42Å; L215-Y325 PolarHBondContact N-O 3.37Å; L215-Y325 PolarHBondContact O-N 3.41Å
216	F	74.2	Confident	65	Low	3 Å²	3	42 Å²	42	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	144	172.1	-79.2	-105.5	0	0	0	110.8	C214 I292 L301 I305 W316 V324	C214-F216 VanDerWaalsContact SG-CE2 3.53Å; F216-I292 HydrophobicContact CE1-CD1 3.83Å; F216-I292 HydrophobicContact CZ-CD1 3.83Å; F216-L301 HydrophobicContact CE2-CD2 4.3Å; F216-L301 HydrophobicContact CZ-CD2 4.13Å; F216-L301 HydrophobicContact CZ-CG 4.48Å; F216-I305 HydrophobicContact CB-CG2 4.41Å; F216-I305 HydrophobicContact CD2-CD1 3.57Å; F216-I305 HydrophobicContact CD2-CG2 4.17Å; F216-I305 HydrophobicContact CE2-CD1 3.32Å; F216-I305 HydrophobicContact CG-CG2 4.46Å; F216-I305 HydrophobicContact CZ-CD1 4.15Å; F216-W316 HydrophobicContact CD1-CZ3 4.27Å; F216-V324 HydrophobicContact CD1-CG1 4.14Å; F216-V324 HydrophobicContact CD2-CG1 4.2Å; F216-V324 HydrophobicContact CE1-CG1 3.84Å; F216-V324 HydrophobicContact CE2-CG1 3.9Å; F216-V324 HydrophobicContact CG-CG1 4.32Å; F216-V324 HydrophobicContact CZ-CG1 3.72Å
217	A	65.2	Low	62.8	Low	3 Å²	3	46.7 Å²	46.7	3%	0.025	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-67.5	136.5	165.3	0	0	0	0	0	110.6	L223 W316 Y325	A217-L223 HydrophobicContact CB-CD2 3.74Å; A217-W316 WeakPolarHBondContact O-CH2 3.44Å; A217-Y325 HydrophobicContact CB-CE2 4.19Å
218	T	56.5	Low	60.7	Low	35 Å²	35	51.7 Å²	51.7	22%	0.215	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-88.1	160.6	-176.5	52.4	0	0	0	0	112.8	T220 Q221 D242 N245	T218-T220 PolarHBondContact O-N 3.43Å; T218-Q221 PolarHBondContact O-N 3.14Å; T218-Q221 VanDerWaalsContact O-N 3.13Å; T218-D242 HydrophobicContact CG2-CB 4.04Å; T218-N245 WeakPolarHBondContact CG2-ND2 3.38Å
219	N	49.1	Very low	58.6	Low	103 Å²	103	54.5 Å²	54.5	55%	0.551	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.7	-163.6	-144.9	13.9	0	0	0	115.9	W316	N219-W316 HydrophobicContact CB-CZ2 4.46Å; N219-W316 PolarHBondContact OD1-NE1 2.65Å
220	T	43.3	Very low	56.7	Low	139 Å²	139	54.6 Å²	54.6	85%	0.853	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.9	177.6	50.4	0	0	0	0	113.7	T218	T218-T220 PolarHBondContact O-N 3.43Å
221	Q	44.8	Very low	54.8	Low	60 Å²	60	55.7 Å²	55.7	28%	0.28	32%	0.324	S	S	.	.	S	Bend	trans	-89.7	150.5	170.2	-62.2	178	7.2	0	0	109.3	T218 L223 T240	T218-Q221 PolarHBondContact O-N 3.14Å; T218-Q221 VanDerWaalsContact O-N 3.13Å; Q221-L223 PolarHBondContact O-N 2.95Å; Q221-T240 PolarHBondContact NE2-O 2.9Å
222	S	36.6	Very low	53.1	Low	84 Å²	84	58.1 Å²	58.1	59%	0.587	33%	0.331	S	S	*	.			trans	-70.6	75.1	178	47.3	0	0	0	0	111.5	T224 M225	S222-T224 CarbonylContact O-C 3.51Å; S222-T224 PolarHBondContact O-N 2.87Å; S222-T224 VanDerWaalsContact O-N 3.09Å; S222-M225 PolarHBondContact O-N 2.97Å
223	L	45.3	Very low	51.2	Low	30 Å²	30	65.2 Å²	65.2	16%	0.157	36%	0.362	C	S	.	.			trans	-59.9	-17	-179.1	-78.1	159.4	0	0	0	113.6	A217 Q221 M225 W316 R322	A217-L223 HydrophobicContact CB-CD2 3.74Å; Q221-L223 PolarHBondContact O-N 2.95Å; L223-M225 PolarHBondContact O-N 3.26Å; L223-W316 HydrophobicContact CD1-CZ2 3.71Å; L223-R322 PolarHBondContact O-NH1 3.01Å
224	T	39.7	Very low	49.3	Very low	82 Å²	82	70.9 Å²	70.9	50%	0.503	39%	0.392	S	S	.	.			trans	-87.3	78.8	161.8	52.3	0	0	0	0	109.6	S222 N319	S222-T224 CarbonylContact O-C 3.51Å; S222-T224 PolarHBondContact O-N 2.87Å; S222-T224 VanDerWaalsContact O-N 3.09Å; T224-N319 HydrophobicContact CG2-CB 3.98Å
225	M	40.4	Very low	47.3	Very low	74 Å²	74	76.5 Å²	76.5	37%	0.365	42%	0.422	S	S	.	.			trans	-82.1	122.7	150.1	-65.4	-86.6	74.9	0	0	106.4	S222 L223 E229 L230	S222-M225 PolarHBondContact O-N 2.97Å; L223-M225 PolarHBondContact O-N 3.26Å; M225-E229 HydrophobicContact CB-CB 4.21Å; M225-E229 HydrophobicContact CE-CB 3.76Å; M225-E229 HydrophobicContact CE-CG 4.35Å; M225-E229 HydrophobicContact SD-CB 3.91Å; M225-L230 HydrophobicContact CB-CD2 3.9Å; M225-L230 HydrophobicContact CB-CG 4.02Å; M225-L230 HydrophobicContact CG-CD2 4.39Å
226	S	37.8	Very low	45.8	Very low	52 Å²	52	87.7 Å²	87.7	36%	0.364	46%	0.464	S	S	.	.			trans	-62.6	159.5	165.3	57.9	0	0	0	0	110.1	T228 E229 L230	S226-T228 PolarHBondContact O-N 2.73Å; S226-T228 PolarHBondContact OG-OG1 3.1Å; S226-E229 WeakPolarHBondContact CB-OE2 3.39Å; S226-E229 PolarHBondContact N-OE2 3.42Å; S226-E229 PolarHBondContact O-N 2.96Å; S226-E229 VanDerWaalsContact OG-CD 3.24Å; S226-E229 VanDerWaalsContact OG-CG 3.26Å; S226-E229 WeakPolarHBondContact OG-CG 3.43Å; S226-E229 PolarHBondContact OG-OE2 3.09Å; S226-L230 PolarHBondContact O-N 2.97Å; S226-L230 VanDerWaalsContact O-N 3.15Å
227	S	41.4	Very low	45.2	Very low	100 Å²	100	91.1 Å²	91.1	70%	0.699	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.2	-179.1	-49.2	0	0	0	0	113
228	T	40.6	Very low	45.1	Very low	104 Å²	104	94.6 Å²	94.6	64%	0.638	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.5	174.8	47.4	0	0	0	0	114.1	S226	S226-T228 PolarHBondContact O-N 2.73Å; S226-T228 PolarHBondContact OG-OG1 3.1Å
229	E	39.6	Very low	45.8	Very low	60 Å²	60	94.1 Å²	94.1	28%	0.28	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-25.1	176.3	-71	169.9	126.3	0	0	113.3	M225 S226 L231 K232	M225-E229 HydrophobicContact CB-CB 4.21Å; M225-E229 HydrophobicContact CE-CB 3.76Å; M225-E229 HydrophobicContact CE-CG 4.35Å; M225-E229 HydrophobicContact SD-CB 3.91Å; S226-E229 WeakPolarHBondContact CB-OE2 3.39Å; S226-E229 PolarHBondContact N-OE2 3.42Å; S226-E229 PolarHBondContact O-N 2.96Å; S226-E229 VanDerWaalsContact OG-CD 3.24Å; S226-E229 VanDerWaalsContact OG-CG 3.26Å; S226-E229 WeakPolarHBondContact OG-CG 3.43Å; S226-E229 PolarHBondContact OG-OE2 3.09Å; E229-L231 PolarHBondContact O-N 3.08Å; E229-L231 VanDerWaalsContact O-N 3.16Å; E229-K232 HydrophobicContact CG-CD 4.3Å; E229-K232 WeakPolarHBondContact O-CB 3.43Å; E229-K232 PolarHBondContact O-N 2.94Å
230	L	43.5	Very low	46.9	Very low	45 Å²	45	92.5 Å²	92.5	24%	0.236	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.6	171.2	-75.2	172.7	0	0	0	112.3	M225 S226 I258 R261 L323	M225-L230 HydrophobicContact CB-CD2 3.9Å; M225-L230 HydrophobicContact CB-CG 4.02Å; M225-L230 HydrophobicContact CG-CD2 4.39Å; S226-L230 PolarHBondContact O-N 2.97Å; S226-L230 VanDerWaalsContact O-N 3.15Å; L230-I258 HydrophobicContact CD1-CD1 4.43Å; L230-I258 HydrophobicContact CD2-CD1 4.49Å; L230-R261 PolarHBondContact O-NH2 3.39Å; L230-L323 HydrophobicContact CD2-CD1 4.46Å; L230-L323 HydrophobicContact CD2-CD2 4.26Å
231	L	40.6	Very low	48.4	Very low	112 Å²	112	86 Å²	86	59%	0.586	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-5.4	178.1	-67.7	168	0	0	0	114.5	E229 K233	E229-L231 PolarHBondContact O-N 3.08Å; E229-L231 VanDerWaalsContact O-N 3.16Å; L231-K233 PolarHBondContact O-N 3.39Å
232	K	44	Very low	49.8	Very low	117 Å²	117	84.8 Å²	84.8	51%	0.509	45%	0.454	S	S	.	.			trans	-75.3	100.8	177.7	-72.4	180	-178.1	168.8	0	110.7	E229 D234	E229-K232 HydrophobicContact CG-CD 4.3Å; E229-K232 WeakPolarHBondContact O-CB 3.43Å; E229-K232 PolarHBondContact O-N 2.94Å; K232-D234 VanDerWaalsContact C-N 3.28Å; K232-D234 PolarHBondContact O-N 3.24Å
233	K	41.6	Very low	51.6	Low	149 Å²	149	81.1 Å²	81.1	65%	0.648	43%	0.429	S	S	*	.			trans	-79.7	68.6	177.5	-163.9	-167	-178.5	-137.9	0	111.9	L231 D235	L231-K233 PolarHBondContact O-N 3.39Å; K233-D235 VanDerWaalsContact C-N 3.33Å; K233-D235 WeakPolarHBondContact CE-OD1 3.35Å; K233-D235 IonicContact NZ-OD1 3.75Å; K233-D235 PolarHBondContact NZ-OD1 3.13Å; K233-D235 IonicContact NZ-OD2 3.1Å; K233-D235 PolarHBondContact NZ-OD2 3.11Å; K233-D235 PolarHBondContact O-N 2.84Å
234	D	43.3	Very low	53	Low	122 Å²	122	83 Å²	83	65%	0.652	44%	0.44	S	S	*	.			trans	-73.2	87	171.8	-76.8	-36.1	0	0	0	110.3	K232 R236 S237	K232-D234 VanDerWaalsContact C-N 3.28Å; K232-D234 PolarHBondContact O-N 3.24Å; D234-R236 PolarHBondContact O-N 3.19Å; D234-S237 PolarHBondContact O-N 3.35Å
235	D	45.4	Very low	54.6	Low	123 Å²	123	80.5 Å²	80.5	66%	0.658	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	16.1	-168.3	-95	-31.3	0	0	0	116.9	K233	K233-D235 VanDerWaalsContact C-N 3.33Å; K233-D235 WeakPolarHBondContact CE-OD1 3.35Å; K233-D235 IonicContact NZ-OD1 3.75Å; K233-D235 PolarHBondContact NZ-OD1 3.13Å; K233-D235 IonicContact NZ-OD2 3.1Å; K233-D235 PolarHBondContact NZ-OD2 3.11Å; K233-D235 PolarHBondContact O-N 2.84Å
236	R	50	Low	56.3	Low	245 Å²	245	79.1 Å²	79.1	93%	0.925	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	-6.3	-175.9	-67.4	-170.2	175.4	-179.9	-0.9	117.4	D234 T238	D234-R236 PolarHBondContact O-N 3.19Å; R236-T238 PolarHBondContact O-N 3.34Å
237	S	60	Low	58.1	Low	75 Å²	75	76.8 Å²	76.8	52%	0.524	40%	0.4	S	S	.	.			trans	-92.2	94.4	178.6	58.5	0	0	0	0	112.4	D234 I239	D234-S237 PolarHBondContact O-N 3.35Å; S237-I239 PolarHBondContact O-N 3.29Å
238	T	64.4	Low	59.8	Low	76 Å²	76	74.8 Å²	74.8	47%	0.466	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-64.3	116.2	166	53.2	0	0	0	0	109.4	R236 T240 S262 P284	R236-T238 PolarHBondContact O-N 3.34Å; T238-T240 PolarHBondContact O-N 2.9Å; T238-S262 VanDerWaalsContact CA-O 3.31Å; T238-S262 WeakPolarHBondContact CA-O 3.36Å; T238-S262 WeakPolarHBondContact CB-O 3.3Å; T238-P284 HydrophobicContact CG2-CB 4.37Å
239	I	71	Confident	61.5	Low	24 Å²	24	69.8 Å²	69.8	12%	0.123	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118.7	-177.3	-62.5	-176.3	0	0	0	109.4	S237 L241 R261 S262 C263 R264	S237-I239 PolarHBondContact O-N 3.29Å; I239-L241 HydrophobicContact CG2-CD2 3.84Å; I239-L241 HydrophobicContact CG2-CG 4.16Å; I239-L241 PolarHBondContact O-N 3.06Å; I239-R261 HydrophobicContact CD1-CB 4.34Å; I239-R261 HydrophobicContact CD1-CG 4.43Å; I239-S262 PolarHBondContact N-O 2.8Å; I239-C263 CarbonylContact O-C 3.58Å; I239-C263 WeakPolarHBondContact O-CA 3.48Å; I239-R264 PolarHBondContact O-N 3.37Å
240	T	70.9	Confident	63	Low	70 Å²	70	71.7 Å²	71.7	43%	0.429	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.3	170.5	-52.8	0	0	0	0	109.4	Q221 T238 R264 V266	Q221-T240 PolarHBondContact NE2-O 2.9Å; T238-T240 PolarHBondContact O-N 2.9Å; T240-R264 CarbonylContact C-O 3.52Å; T240-R264 WeakPolarHBondContact CA-O 3.33Å; T240-V266 HydrophobicContact CG2-CB 4.29Å; T240-V266 HydrophobicContact CG2-CG2 3.63Å
241	L	75.8	Confident	64.3	Low	1 Å²	1	71.2 Å²	71.2	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	140.1	173.5	-64	177.4	0	0	0	110	L215 I239 A243 C263 R264 L265 V266 M287 Y325	L215-L241 HydrophobicContact CB-CD1 4.2Å; L215-L241 HydrophobicContact CD1-CB 4.14Å; L215-L241 HydrophobicContact CD1-CD1 4.03Å; I239-L241 HydrophobicContact CG2-CD2 3.84Å; I239-L241 HydrophobicContact CG2-CG 4.16Å; I239-L241 PolarHBondContact O-N 3.06Å; L241-A243 PolarHBondContact O-N 3.47Å; L241-C263 HydrophobicContact CD1-CB 3.78Å; L241-C263 HydrophobicContact CG-CB 4.21Å; L241-R264 PolarHBondContact N-O 2.91Å; L241-L265 HydrophobicContact CB-CD2 4.22Å; L241-V266 PolarHBondContact O-N 2.97Å; L241-V266 VanDerWaalsContact O-N 3.1Å; L241-M287 HydrophobicContact CD1-CE 4.49Å; L241-M287 HydrophobicContact CD1-SD 3.57Å; L241-M287 VanDerWaalsContact CD1-SD 3.57Å; L241-Y325 HydrophobicContact CD1-CD1 4.45Å; L241-Y325 HydrophobicContact CD1-CD2 3.74Å; L241-Y325 HydrophobicContact CD1-CE2 4.37Å; L241-Y325 HydrophobicContact CD1-CG 3.78Å; L241-Y325 HydrophobicContact CD2-CD2 4.02Å; L241-Y325 HydrophobicContact CD2-CE2 4.01Å
242	D	73.7	Confident	65.8	Low	35 Å²	35	65.9 Å²	65.9	19%	0.187	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	111	171.5	-174.6	-23.8	0	0	0	108.4	T218 D244 N245 K268	T218-D242 HydrophobicContact CG2-CB 4.04Å; D242-D244 PolarHBondContact O-N 2.84Å; D242-D244 PolarHBondContact OD1-N 3.28Å; D242-N245 HydrophobicContact CB-CB 4.34Å; D242-N245 WeakPolarHBondContact CB-ND2 3.35Å; D242-N245 PolarHBondContact O-N 2.85Å; D242-N245 PolarHBondContact OD1-OD1 2.97Å; D242-N245 VanDerWaalsContact OD2-CG 3.3Å; D242-N245 PolarHBondContact OD2-ND2 3.45Å; D242-N245 PolarHBondContact OD2-OD1 3.4Å; D242-K268 IonicContact OD1-NZ 2.71Å; D242-K268 PolarHBondContact OD1-NZ 2.99Å; D242-K268 VanDerWaalsContact OD2-CE 3.31Å; D242-K268 WeakPolarHBondContact OD2-CE 3.39Å; D242-K268 IonicContact OD2-NZ 2.77Å; D242-K268 PolarHBondContact OD2-NZ 3.17Å
243	A	75.6	Confident	67.3	Low	7 Å²	7	60.5 Å²	60.5	6%	0.058	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-14.2	-171.3	0	0	0	0	0	113.1	L241 I246 L265 V266 H267	L241-A243 PolarHBondContact O-N 3.47Å; A243-I246 WeakPolarHBondContact O-CD1 3.3Å; A243-I246 WeakPolarHBondContact O-CG1 3.46Å; A243-L265 HydrophobicContact CB-CB 4.03Å; A243-V266 WeakPolarHBondContact CB-O 3.49Å; A243-V266 PolarHBondContact N-O 2.68Å; A243-H267 WeakPolarHBondContact CB-CE1 3.48Å
244	D	74.1	Confident	69.1	Low	71 Å²	71	53.4 Å²	53.4	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-18.7	179.4	-52.7	-43.9	0	0	0	111.5	D242 I246 H267 K268	D242-D244 PolarHBondContact O-N 2.84Å; D242-D244 PolarHBondContact OD1-N 3.28Å; D244-I246 PolarHBondContact O-N 3.08Å; D244-H267 IonicContact OD1-CE1 3.44Å; D244-H267 IonicContact OD1-CG 3.68Å; D244-H267 IonicContact OD1-ND1 2.79Å; D244-H267 PolarHBondContact OD1-ND1 2.91Å; D244-K268 WeakPolarHBondContact OD2-CG 3.26Å; D244-K268 PolarHBondContact OD2-N 3.46Å; D244-K268 IonicContact OD2-NZ 2.68Å
245	N	73	Confident	71	Confident	28 Å²	28	47.6 Å²	47.6	15%	0.15	24%	0.242	C	C	.	.			trans	-85	56.9	-177.3	-60.1	-7.2	0	0	0	112.1	T218 D242 K268 I305	T218-N245 WeakPolarHBondContact CG2-ND2 3.38Å; D242-N245 HydrophobicContact CB-CB 4.34Å; D242-N245 WeakPolarHBondContact CB-ND2 3.35Å; D242-N245 PolarHBondContact O-N 2.85Å; D242-N245 PolarHBondContact OD1-OD1 2.97Å; D242-N245 VanDerWaalsContact OD2-CG 3.3Å; D242-N245 PolarHBondContact OD2-ND2 3.45Å; D242-N245 PolarHBondContact OD2-OD1 3.4Å; N245-K268 PolarHBondContact OD1-NZ 2.89Å; N245-I305 HydrophobicContact CB-CG2 4Å
246	I	75.8	Confident	72.9	Confident	46 Å²	46	44.2 Å²	44.2	24%	0.236	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.1	-177.8	-61.4	153.8	0	0	0	110.8	Q213 L215 A243 D244 I583	Q213-I246 HydrophobicContact CB-CG2 4.39Å; Q213-I246 HydrophobicContact CG-CG2 4.4Å; L215-I246 HydrophobicContact CD2-CB 4.36Å; L215-I246 HydrophobicContact CD2-CG1 3.58Å; A243-I246 WeakPolarHBondContact O-CD1 3.3Å; A243-I246 WeakPolarHBondContact O-CG1 3.46Å; D244-I246 PolarHBondContact O-N 3.08Å; I246-I583 HydrophobicContact CD1-CD1 3.63Å; I246-I583 HydrophobicContact CD1-CG2 4.43Å; I246-I583 HydrophobicContact CG1-CD1 4.34Å
247	G	75.7	Confident	74.6	Confident	2 Å²	2	33.2 Å²	33.2	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	160.4	171.4	0	0	0	0	0	113.5	Q213 C214	Q213-G247 CarbonylContact C-O 2.9Å; Q213-G247 VanDerWaalsContact CA-O 3.3Å; Q213-G247 WeakPolarHBondContact CA-O 3.27Å; C214-G247 PolarHBondContact N-O 2.74Å; C214-G247 PolarHBondContact O-N 3.15Å
248	I	77.7	Confident	75.7	Confident	58 Å²	58	31.2 Å²	31.2	30%	0.297	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.6	172.4	-59.8	145	0	0	0	108.2	D211 Q213 L301 I587	D211-I248 HydrophobicContact CB-CG2 3.97Å; Q213-I248 HydrophobicContact CG-CG1 3.69Å; I248-L301 WeakPolarHBondContact O-CD2 3.38Å; I248-I587 HydrophobicContact CD1-CD1 3.74Å; I248-I587 HydrophobicContact CD1-CG1 3.66Å; I248-I587 HydrophobicContact CG1-CD1 4.14Å; I248-I587 HydrophobicContact CG1-CG1 4.46Å; I248-I587 HydrophobicContact CG2-CD1 4.2Å
249	L	76	Confident	76.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.8	173.7	-55.6	173.5	0	0	0	108.8	L208 D211 T212 C214 L255 I292 L298 L301 V324 L326	L208-L249 HydrophobicContact CD1-CB 3.51Å; L208-L249 HydrophobicContact CD1-CD1 4.16Å; D211-L249 CarbonylContact C-O 3.41Å; D211-L249 WeakPolarHBondContact CA-O 3.38Å; T212-L249 PolarHBondContact N-O 2.91Å; T212-L249 WeakPolarHBondContact O-CB 3.44Å; T212-L249 PolarHBondContact O-N 2.76Å; C214-L249 HydrophobicContact CB-CD1 4.07Å; C214-L249 HydrophobicContact CB-CG 4.26Å; L249-L255 HydrophobicContact CD1-CD1 3.93Å; L249-L255 HydrophobicContact CD1-CD2 4.13Å; L249-I292 HydrophobicContact CD2-CD1 4.29Å; L249-L298 HydrophobicContact CD2-CD1 3.96Å; L249-L301 HydrophobicContact CD2-CD2 3.92Å; L249-V324 HydrophobicContact CD1-CG2 4.23Å; L249-L326 HydrophobicContact CD1-CD2 4.06Å
250	R	70.6	Confident	77.3	Confident	100 Å²	100	29.6 Å²	29.6	38%	0.377	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-81.4	160.1	-175.9	-69	-177.7	-179.7	173	1.1	112.6	D211 T253 I549	D211-R250 WeakPolarHBondContact OD1-CA 3.48Å; R250-T253 PolarHBondContact N-OG1 2.87Å; R250-T253 VanDerWaalsContact O-CB 3.3Å; R250-T253 WeakPolarHBondContact O-CB 3.23Å; R250-T253 PolarHBondContact O-N 2.83Å; R250-T253 PolarHBondContact O-OG1 2.74Å; R250-I549 PolarHBondContact NH1-O 3.17Å
251	P	71.9	Confident	77.8	Confident	35 Å²	35	28.7 Å²	28.7	23%	0.227	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	147.2	159.9	-22.6	32	0	0	0	111.3	L208 D211 T253 V396	L208-P251 CarbonylContact O-C 3.59Å; L208-P251 VanDerWaalsContact O-CA 3.3Å; L208-P251 WeakPolarHBondContact O-CA 3.05Å; D211-P251 WeakPolarHBondContact OD1-CD 3.17Å; P251-T253 PolarHBondContact O-N 2.81Å; P251-V396 HydrophobicContact CB-CG1 3.79Å; P251-V396 HydrophobicContact CB-CG2 4.39Å
252	G	72	Confident	77.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	-22.4	-177.1	0	0	0	0	0	113.7	L207 L208 V254	L207-G252 WeakPolarHBondContact CD1-O 3.06Å; L208-G252 PolarHBondContact O-N 3.12Å; G252-V254 PolarHBondContact O-N 3.45Å
253	T	75.1	Confident	78.3	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.018	15%	0.151	C	C	.	.			trans	-63.7	125.5	172.3	-46.4	0	0	0	0	109.6	L208 R250 P251 L255 I292 L298	L208-T253 PolarHBondContact N-O 2.78Å; R250-T253 PolarHBondContact N-OG1 2.87Å; R250-T253 VanDerWaalsContact O-CB 3.3Å; R250-T253 WeakPolarHBondContact O-CB 3.23Å; R250-T253 PolarHBondContact O-N 2.83Å; R250-T253 PolarHBondContact O-OG1 2.74Å; P251-T253 PolarHBondContact O-N 2.81Å; T253-L255 HydrophobicContact CG2-CD2 4.12Å; T253-I292 HydrophobicContact CG2-CG2 4.12Å; T253-L298 HydrophobicContact CG2-CD1 4.46Å
254	V	79.5	Confident	78.5	Confident	1 Å²	1	33 Å²	33	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.2	167.2	179.8	0	0	0	0	109.6	W167 F205 I206 L207 G252 V293 V338 A560	W167-V254 HydrophobicContact CH2-CG2 3.96Å; W167-V254 HydrophobicContact CZ2-CG2 3.63Å; F205-V254 HydrophobicContact CB-CG1 4.04Å; F205-V254 HydrophobicContact CD1-CG1 4.41Å; I206-V254 CarbonylContact O-C 3.48Å; I206-V254 VanDerWaalsContact O-CA 3.27Å; I206-V254 WeakPolarHBondContact O-CA 3.3Å; I206-V254 WeakPolarHBondContact O-CG1 3.34Å; L207-V254 HydrophobicContact CB-CG2 4.43Å; L207-V254 HydrophobicContact CD1-CG2 3.65Å; G252-V254 PolarHBondContact O-N 3.45Å; V254-V293 HydrophobicContact CB-CB 4.26Å; V254-V293 HydrophobicContact CB-CG2 4.33Å; V254-V293 HydrophobicContact CG1-CB 4.36Å; V254-V293 HydrophobicContact CG1-CG2 3.96Å; V254-V293 VanDerWaalsContact O-CB 3.29Å; V254-V293 WeakPolarHBondContact O-CB 3.08Å; V254-V293 WeakPolarHBondContact O-CG2 3.5Å; V254-V293 PolarHBondContact O-N 3.46Å; V254-V338 HydrophobicContact CG1-CG2 3.99Å; V254-V338 HydrophobicContact CG2-CG2 4.13Å; V254-A560 HydrophobicContact CB-CB 3.53Å; V254-A560 HydrophobicContact CG1-CB 4.48Å; V254-A560 HydrophobicContact CG2-CB 3.48Å; V254-A560 VanDerWaalsContact CG2-CB 3.48Å
255	L	82.9	Confident	78.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.7	175.6	-61.3	179	0	0	0	109.6	F205 I206 L208 L249 T253 C290 I292 V324 L326	F205-L255 WeakPolarHBondContact CA-O 3.27Å; I206-L255 HydrophobicContact CD1-CB 4.37Å; I206-L255 HydrophobicContact CG1-CB 3.88Å; I206-L255 PolarHBondContact N-O 3.18Å; I206-L255 PolarHBondContact O-N 3.25Å; L208-L255 HydrophobicContact CD1-CD1 4.42Å; L208-L255 HydrophobicContact CD2-CD1 4.35Å; L208-L255 HydrophobicContact CG-CD1 4.49Å; L249-L255 HydrophobicContact CD1-CD1 3.93Å; L249-L255 HydrophobicContact CD1-CD2 4.13Å; T253-L255 HydrophobicContact CG2-CD2 4.12Å; L255-C290 HydrophobicContact CB-CB 4.1Å; L255-C290 HydrophobicContact CD1-CB 4.28Å; L255-I292 HydrophobicContact CD2-CB 4.33Å; L255-I292 HydrophobicContact CD2-CG1 4.25Å; L255-I292 HydrophobicContact CD2-CG2 4.3Å; L255-V324 HydrophobicContact CD2-CG2 3.99Å; L255-L326 HydrophobicContact CD1-CD1 3.6Å; L255-L326 HydrophobicContact CD1-CG 4.49Å
256	Q	84.8	Confident	78.8	Confident	51 Å²	51	33 Å²	33	24%	0.238	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.5	164.5	-177.2	179.8	9.6	0	0	106.7	F205 C290 A291 V293	F205-Q256 HydrophobicContact CD1-CB 3.8Å; F205-Q256 HydrophobicContact CD1-CG 4.11Å; F205-Q256 HydrophobicContact CE1-CB 3.73Å; F205-Q256 HydrophobicContact CE1-CG 3.8Å; Q256-C290 CarbonylContact O-C 3.56Å; Q256-C290 VanDerWaalsContact O-CA 3.24Å; Q256-C290 WeakPolarHBondContact O-CA 3.27Å; Q256-C290 WeakPolarHBondContact O-CB 3.42Å; Q256-A291 HydrophobicContact CB-CB 4.26Å; Q256-A291 PolarHBondContact N-O 3.49Å; Q256-A291 PolarHBondContact O-N 3.27Å; Q256-V293 HydrophobicContact CB-CG2 3.98Å; Q256-V293 VanDerWaalsContact N-CG2 3.27Å
257	L	85.3	Confident	78.9	Confident	15 Å²	15	35.7 Å²	35.7	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.9	179.8	176.6	49.8	0	0	0	108.9	V198 P203 K204 L288 N575	V198-L257 HydrophobicContact CG1-CD2 3.68Å; P203-L257 HydrophobicContact CG-CD2 4.17Å; P203-L257 WeakPolarHBondContact O-CB 3.43Å; K204-L257 PolarHBondContact O-N 3.32Å; L257-L288 HydrophobicContact CD1-CB 4.41Å; L257-L288 HydrophobicContact CD1-CD2 3.48Å; L257-L288 VanDerWaalsContact CD1-CD2 3.48Å; L257-L288 HydrophobicContact CD1-CG 4.38Å; L257-L288 HydrophobicContact CD2-CD2 4.46Å; L257-N575 WeakPolarHBondContact CD2-ND2 3.19Å; L257-N575 VanDerWaalsContact CG-ND2 3.28Å; L257-N575 WeakPolarHBondContact CG-ND2 3.46Å
258	I	84.1	Confident	78.4	Confident	32 Å²	32	41.1 Å²	41.1	16%	0.164	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-70	-176.3	-53.7	170.1	0	0	0	109.5	L230 Q289 A291 L323	L230-I258 HydrophobicContact CD1-CD1 4.43Å; L230-I258 HydrophobicContact CD2-CD1 4.49Å; I258-Q289 WeakPolarHBondContact CA-O 3.23Å; I258-Q289 HydrophobicContact CB-CG 4.4Å; I258-Q289 WeakPolarHBondContact CB-O 3.37Å; I258-Q289 HydrophobicContact CD1-CG 4.39Å; I258-Q289 PolarHBondContact N-O 3.07Å; I258-A291 HydrophobicContact CD1-CB 3.77Å; I258-A291 HydrophobicContact CG1-CB 4.44Å; I258-L323 HydrophobicContact CD1-CD2 3.51Å
259	D	84.8	Confident	77.5	Confident	43 Å²	43	45 Å²	45	23%	0.23	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	-166.4	-164.9	-165.1	23.1	0	0	0	112.8	W199 Q289 N575	W199-D259 VanDerWaalsContact CZ3-OD1 3.25Å; W199-D259 WeakPolarHBondContact CZ3-OD1 3.18Å; D259-Q289 PolarHBondContact N-O 2.91Å; D259-Q289 PolarHBondContact O-N 2.85Å; D259-N575 PolarHBondContact OD1-N 3.02Å
260	C	84.1	Confident	76.2	Confident	24 Å²	24	51 Å²	51	16%	0.162	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.4	170.3	174.3	0	0	0	0	109.6	W199 M287 D576 S577	W199-C260 HydrophobicContact CE3-CB 3.75Å; W199-C260 HydrophobicContact CZ3-CB 3.25Å; W199-C260 VanDerWaalsContact CZ3-N 3.32Å; C260-M287 WeakPolarHBondContact CA-O 3.37Å; C260-D576 VanDerWaalsContact CB-O 3.24Å; C260-D576 WeakPolarHBondContact CB-O 3.4Å; C260-D576 PolarHBondContact SG-O 2.68Å; C260-S577 VanDerWaalsContact CB-CB 3.5Å; C260-S577 WeakPolarHBondContact SG-CA 3.2Å; C260-S577 WeakPolarHBondContact SG-CB 3.43Å
261	R	81.2	Confident	75.1	Confident	50 Å²	50	53.2 Å²	53.2	19%	0.189	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.3	161.1	-62.8	-168.8	-176.5	-141	-3.4	112.2	L230 I239 C263 M287 Q289	L230-R261 PolarHBondContact O-NH2 3.39Å; I239-R261 HydrophobicContact CD1-CB 4.34Å; I239-R261 HydrophobicContact CD1-CG 4.43Å; R261-C263 PolarHBondContact O-N 3.38Å; R261-C263 PolarHBondContact O-SG 3.24Å; R261-M287 PolarHBondContact N-O 2.93Å; R261-M287 PolarHBondContact O-N 3.29Å; R261-Q289 VanDerWaalsContact CD-OE1 3.3Å
262	S	78.3	Confident	73.8	Confident	47 Å²	47	57.9 Å²	57.9	33%	0.329	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	98.4	173	-152.7	0	0	0	0	108.1	T238 I239	T238-S262 VanDerWaalsContact CA-O 3.31Å; T238-S262 WeakPolarHBondContact CA-O 3.36Å; T238-S262 WeakPolarHBondContact CB-O 3.3Å; I239-S262 PolarHBondContact N-O 2.8Å
263	C	81	Confident	72.1	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	143.4	-171.8	-60.4	0	0	0	0	110.9	I239 L241 R261 P284 V285 M287	I239-C263 CarbonylContact O-C 3.58Å; I239-C263 WeakPolarHBondContact O-CA 3.48Å; L241-C263 HydrophobicContact CD1-CB 3.78Å; L241-C263 HydrophobicContact CG-CB 4.21Å; R261-C263 PolarHBondContact O-N 3.38Å; R261-C263 PolarHBondContact O-SG 3.24Å; C263-P284 CarbonylContact O-C 3.42Å; C263-P284 WeakPolarHBondContact O-CA 3.2Å; C263-V285 PolarHBondContact N-O 3.16Å; C263-V285 WeakPolarHBondContact O-CB 3.29Å; C263-V285 PolarHBondContact O-N 3.47Å; C263-M287 HydrophobicContact CB-CG 3.98Å; C263-M287 HydrophobicContact CB-SD 3.66Å
264	R	79.6	Confident	70.4	Confident	87 Å²	87	71.7 Å²	71.7	33%	0.328	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.9	174.7	-175	175.1	176.1	-144.8	-14.2	109.9	I239 T240 L241 H280 S282	I239-R264 PolarHBondContact O-N 3.37Å; T240-R264 CarbonylContact C-O 3.52Å; T240-R264 WeakPolarHBondContact CA-O 3.33Å; L241-R264 PolarHBondContact N-O 2.91Å; R264-H280 PolarHBondContact NH2-O 3.48Å; R264-S282 WeakPolarHBondContact CG-OG 3.4Å; R264-S282 PolarHBondContact NE-OG 2.85Å; R264-S282 PolarHBondContact NH2-OG 3.24Å
265	L	79.4	Confident	68.3	Low	46 Å²	46	82.5 Å²	82.5	24%	0.241	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.5	177.5	-58.7	-174.4	0	0	0	111.1	L215 L241 A243 S282 V285	L215-L265 HydrophobicContact CD1-CD2 3.46Å; L215-L265 VanDerWaalsContact CD1-CD2 3.46Å; L241-L265 HydrophobicContact CB-CD2 4.22Å; A243-L265 HydrophobicContact CB-CB 4.03Å; L265-S282 WeakPolarHBondContact O-CB 3.08Å; L265-S282 PolarHBondContact O-OG 3.14Å; L265-V285 HydrophobicContact CD1-CG2 4.16Å; L265-V285 HydrophobicContact CG-CG2 4.18Å
266	V	75.9	Confident	66.2	Low	54 Å²	54	90 Å²	90	33%	0.327	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.6	177.9	175	0	0	0	0	109.3	T240 L241 A243	T240-V266 HydrophobicContact CG2-CB 4.29Å; T240-V266 HydrophobicContact CG2-CG2 3.63Å; L241-V266 PolarHBondContact O-N 2.97Å; L241-V266 VanDerWaalsContact O-N 3.1Å; A243-V266 WeakPolarHBondContact CB-O 3.49Å; A243-V266 PolarHBondContact N-O 2.68Å
267	H	75.9	Confident	63.9	Low	102 Å²	102	93.7 Å²	93.7	47%	0.472	46%	0.464	S	S	.	.			trans	-102.7	158.1	175.6	-67.2	-80.8	0	0	0	111.1	A243 D244	A243-H267 WeakPolarHBondContact CB-CE1 3.48Å; D244-H267 IonicContact OD1-CE1 3.44Å; D244-H267 IonicContact OD1-CG 3.68Å; D244-H267 IonicContact OD1-ND1 2.79Å; D244-H267 PolarHBondContact OD1-ND1 2.91Å
268	K	65.6	Low	61.7	Low	116 Å²	116	96 Å²	96	50%	0.504	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-75.6	-19.7	-176.3	-67.6	176.3	-177.9	75.9	0	115.2	D242 D244 N245 D270	D242-K268 IonicContact OD1-NZ 2.71Å; D242-K268 PolarHBondContact OD1-NZ 2.99Å; D242-K268 VanDerWaalsContact OD2-CE 3.31Å; D242-K268 WeakPolarHBondContact OD2-CE 3.39Å; D242-K268 IonicContact OD2-NZ 2.77Å; D242-K268 PolarHBondContact OD2-NZ 3.17Å; D244-K268 WeakPolarHBondContact OD2-CG 3.26Å; D244-K268 PolarHBondContact OD2-N 3.46Å; D244-K268 IonicContact OD2-NZ 2.68Å; N245-K268 PolarHBondContact OD1-NZ 2.89Å; K268-D270 PolarHBondContact O-N 2.83Å
269	E	59	Low	59.5	Low	138 Å²	138	104.4 Å²	104.4	65%	0.645	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-74.2	-21.7	-170.4	-141.5	77	-110.9	0	0	114.9	Q271	E269-Q271 PolarHBondContact O-N 3.44Å
270	D	48.5	Very low	57.5	Low	126 Å²	126	110 Å²	110	67%	0.674	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-63.5	-5	-168.2	-82.9	-18.9	0	0	0	115.7	K268 I272	K268-D270 PolarHBondContact O-N 2.83Å; D270-I272 PolarHBondContact O-N 2.83Å
271	Q	48.4	Very low	55.9	Low	147 Å²	147	117.6 Å²	117.6	69%	0.687	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-76	-13.3	-174	-67	-156.9	26.3	0	0	115.8	E269 Y274	E269-Q271 PolarHBondContact O-N 3.44Å; Q271-Y274 WeakPolarHBondContact O-CD2 3.41Å; Q271-Y274 VanDerWaalsContact O-CE2 3.22Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.48Å
272	I	44.2	Very low	55.1	Low	133 Å²	133	117.3 Å²	117.3	68%	0.682	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-80.5	-23.4	-175.7	-62.2	-179.8	0	0	0	112.2	D270 Y274	D270-I272 PolarHBondContact O-N 2.83Å; I272-Y274 VanDerWaalsContact C-N 3.27Å; I272-Y274 PolarHBondContact O-N 3.14Å
273	S	37.1	Very low	54.8	Low	97 Å²	97	123.6 Å²	123.6	68%	0.678	59%	0.591	S	S	*	*			trans	-84	53.8	-172.3	-155.8	0	0	0	0	114.5	R275	S273-R275 PolarHBondContact O-N 2.99Å
274	Y	38.9	Very low	54.6	Low	197 Å²	197	126.7 Å²	126.7	77%	0.773	61%	0.612	S	S	*	*			trans	-73.2	38.5	174.2	-86.6	-79.3	0	0	0	113.9	Q271 I272	Q271-Y274 WeakPolarHBondContact O-CD2 3.41Å; Q271-Y274 VanDerWaalsContact O-CE2 3.22Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.48Å; I272-Y274 VanDerWaalsContact C-N 3.27Å; I272-Y274 PolarHBondContact O-N 3.14Å
275	R	36.3	Very low	54.7	Low	228 Å²	228	123.5 Å²	123.5	86%	0.86	60%	0.602	S	S	*	*	S	Bend	trans	-167.2	77.2	171.9	-106	159.5	-159.4	-131.4	7.3	112	S273	S273-R275 PolarHBondContact O-N 2.99Å
276	L	38.2	Very low	54.9	Low	158 Å²	158	122.8 Å²	122.8	83%	0.827	60%	0.601	S	S	*	*			trans	174.3	134.9	141.7	-95.5	157.6	0	0	0	109.9	A278	L276-A278 PolarHBondContact O-N 3.48Å
277	S	36.7	Very low	55.5	Low	127 Å²	127	120.3 Å²	120.3	89%	0.888	59%	0.585	S	S	*	*			trans	-80.8	32.2	-172	-69.7	0	0	0	0	114.9	R279	S277-R279 PolarHBondContact O-N 3.19Å; S277-R279 VanDerWaalsContact O-N 3.1Å
278	A	38.2	Very low	56.1	Low	63 Å²	63	115.4 Å²	115.4	52%	0.521	56%	0.563	S	S	.	*			trans	-71.3	101.7	171.8	0	0	0	0	0	109.4	L276 H280	L276-A278 PolarHBondContact O-N 3.48Å; A278-H280 VanDerWaalsContact C-N 3.3Å; A278-H280 PolarHBondContact O-CD2 2.81Å; A278-H280 PolarHBondContact O-N 2.87Å
279	R	38.9	Very low	57.2	Low	209 Å²	209	110 Å²	110	79%	0.789	54%	0.539	S	S	*	.			trans	-70.4	81.7	180	-68.1	176.6	175.3	167.1	-0.9	111	S277 R281	S277-R279 PolarHBondContact O-N 3.19Å; S277-R279 VanDerWaalsContact O-N 3.1Å; R279-R281 PolarHBondContact O-N 3.33Å
280	H	42.9	Very low	58.5	Low	160 Å²	160	103.4 Å²	103.4	74%	0.741	51%	0.509	S	S	*	.			trans	-67.2	71.8	169.9	-74.2	-87.7	0	0	0	111.2	R264 A278 S282	R264-H280 PolarHBondContact NH2-O 3.48Å; A278-H280 VanDerWaalsContact C-N 3.3Å; A278-H280 PolarHBondContact O-CD2 2.81Å; A278-H280 PolarHBondContact O-N 2.87Å; H280-S282 VanDerWaalsContact C-N 3.35Å; H280-S282 PolarHBondContact O-N 3.13Å
281	R	50.7	Low	59.9	Low	185 Å²	185	97.6 Å²	97.6	70%	0.698	48%	0.478	S	S	*	.			trans	-73	90.6	168.8	-71.5	-179.8	171.2	-173.6	-4.2	107.9	R279 K283	R279-R281 PolarHBondContact O-N 3.33Å; R281-K283 PolarHBondContact O-N 3.17Å; R281-K283 VanDerWaalsContact O-N 3.15Å
282	S	62.9	Low	61	Low	44 Å²	44	90.7 Å²	90.7	31%	0.308	45%	0.446	S	S	.	.			trans	-45.5	121.7	164.5	44.1	0	0	0	0	109.2	R264 L265 H280	R264-S282 WeakPolarHBondContact CG-OG 3.4Å; R264-S282 PolarHBondContact NE-OG 2.85Å; R264-S282 PolarHBondContact NH2-OG 3.24Å; L265-S282 WeakPolarHBondContact O-CB 3.08Å; L265-S282 PolarHBondContact O-OG 3.14Å; H280-S282 VanDerWaalsContact C-N 3.35Å; H280-S282 PolarHBondContact O-N 3.13Å
283	K	72	Confident	62.1	Low	178 Å²	178	84.8 Å²	84.8	77%	0.774	42%	0.416	S	S	*	.			trans	-62.8	141.9	-177.9	-68.4	179.3	-179.2	174.9	0	108.9	R281 V285	R281-K283 PolarHBondContact O-N 3.17Å; R281-K283 VanDerWaalsContact O-N 3.15Å; K283-V285 WeakPolarHBondContact O-CG2 3.44Å
284	P	77.4	Confident	63.2	Low	66 Å²	66	81 Å²	81	43%	0.429	39%	0.393	S	S	.	.			trans	-72.7	145.9	178.9	32.5	-36	0	0	0	111.1	T238 C263	T238-P284 HydrophobicContact CG2-CB 4.37Å; C263-P284 CarbonylContact O-C 3.42Å; C263-P284 WeakPolarHBondContact O-CA 3.2Å
285	V	81.4	Confident	63.9	Low	19 Å²	19	72 Å²	72	12%	0.115	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.5	-162.7	-179.7	0	0	0	0	108.3	C263 L265 K283 M287 Q579	C263-V285 PolarHBondContact N-O 3.16Å; C263-V285 WeakPolarHBondContact O-CB 3.29Å; C263-V285 PolarHBondContact O-N 3.47Å; L265-V285 HydrophobicContact CD1-CG2 4.16Å; L265-V285 HydrophobicContact CG-CG2 4.18Å; K283-V285 WeakPolarHBondContact O-CG2 3.44Å; V285-M287 HydrophobicContact CG1-CG 4.43Å; V285-M287 WeakPolarHBondContact O-CG 3.24Å; V285-M287 PolarHBondContact O-N 2.77Å; V285-Q579 HydrophobicContact CG1-CB 3.38Å; V285-Q579 HydrophobicContact CG1-CG 4.1Å
286	S	84.3	Confident	64.8	Low	32 Å²	32	64.4 Å²	64.4	22%	0.224	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.5	-175.5	-58.8	0	0	0	0	111.6	S327 Y578 Q579	S286-S327 WeakPolarHBondContact O-CB 3.37Å; S286-Y578 VanDerWaalsContact CB-N 3.34Å; S286-Y578 WeakPolarHBondContact CB-O 3.45Å; S286-Y578 CarbonylContact O-C 3.47Å; S286-Y578 WeakPolarHBondContact O-CA 3.33Å; S286-Y578 PolarHBondContact O-N 3.36Å; S286-Y578 VanDerWaalsContact O-N 3.08Å; S286-Y578 VanDerWaalsContact O-O 3.09Å; S286-Q579 VanDerWaalsContact N-NE2 3.18Å; S286-Q579 PolarHBondContact O-N 3.46Å
287	M	88.1	Confident	65.3	Low	1 Å²	1	57 Å²	57	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.1	-175.5	-44.6	-169.8	70.9	0	0	111.7	L215 L241 C260 R261 C263 V285 Q289 Y325 S327	L215-M287 HydrophobicContact CB-CE 4.44Å; L215-M287 HydrophobicContact CD1-CE 3.85Å; L215-M287 HydrophobicContact CD1-SD 4.31Å; L215-M287 HydrophobicContact CG-CE 4.2Å; L241-M287 HydrophobicContact CD1-CE 4.49Å; L241-M287 HydrophobicContact CD1-SD 3.57Å; L241-M287 VanDerWaalsContact CD1-SD 3.57Å; C260-M287 WeakPolarHBondContact CA-O 3.37Å; R261-M287 PolarHBondContact N-O 2.93Å; R261-M287 PolarHBondContact O-N 3.29Å; C263-M287 HydrophobicContact CB-CG 3.98Å; C263-M287 HydrophobicContact CB-SD 3.66Å; V285-M287 HydrophobicContact CG1-CG 4.43Å; V285-M287 WeakPolarHBondContact O-CG 3.24Å; V285-M287 PolarHBondContact O-N 2.77Å; M287-Q289 PolarHBondContact O-N 2.89Å; M287-Y325 HydrophobicContact CB-CD1 4.21Å; M287-Y325 WeakPolarHBondContact CE-O 3.07Å; M287-Y325 HydrophobicContact SD-CG 4.44Å; M287-S327 WeakPolarHBondContact CE-OG 3.1Å
288	L	88.9	Confident	66.2	Low	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	133.3	160.4	-68	166.1	0	0	0	106.6	C195 W199 L257 Y325 L326 L328 S577	C195-L288 HydrophobicContact CB-CD1 3.63Å; C195-L288 HydrophobicContact CB-CG 4.44Å; W199-L288 HydrophobicContact CB-CD2 4.2Å; L257-L288 HydrophobicContact CD1-CB 4.41Å; L257-L288 HydrophobicContact CD1-CD2 3.48Å; L257-L288 VanDerWaalsContact CD1-CD2 3.48Å; L257-L288 HydrophobicContact CD1-CG 4.38Å; L257-L288 HydrophobicContact CD2-CD2 4.46Å; L288-Y325 VanDerWaalsContact O-CA 3.27Å; L288-Y325 WeakPolarHBondContact O-CA 3.46Å; L288-L326 WeakPolarHBondContact CA-O 3.35Å; L288-L326 HydrophobicContact CB-CB 4.24Å; L288-L326 WeakPolarHBondContact CB-O 3.32Å; L288-L326 HydrophobicContact CD1-CB 4.04Å; L288-L326 HydrophobicContact CD1-CD1 4.27Å; L288-L326 PolarHBondContact N-O 3.1Å; L288-L326 PolarHBondContact O-N 3.19Å; L288-L326 VanDerWaalsContact O-N 3.12Å; L288-L328 HydrophobicContact CB-CD1 4.35Å; L288-L328 HydrophobicContact CD1-CD2 4.12Å; L288-L328 HydrophobicContact CD1-CG 4.2Å; L288-L328 HydrophobicContact CD2-CD1 4.45Å; L288-L328 HydrophobicContact CD2-CD2 3.72Å; L288-L328 HydrophobicContact CD2-CG 4.41Å; L288-L328 HydrophobicContact CG-CD1 3.72Å; L288-L328 HydrophobicContact CG-CD2 3.65Å; L288-L328 HydrophobicContact CG-CG 3.79Å; L288-S577 WeakPolarHBondContact CD2-OG 3.24Å
289	Q	88.3	Confident	67.2	Low	2 Å²	2	48.6 Å²	48.6	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	112.8	161.3	-179.5	-175.5	-7.4	0	0	107.1	I258 D259 R261 M287 L323 Y325	I258-Q289 WeakPolarHBondContact CA-O 3.23Å; I258-Q289 HydrophobicContact CB-CG 4.4Å; I258-Q289 WeakPolarHBondContact CB-O 3.37Å; I258-Q289 HydrophobicContact CD1-CG 4.39Å; I258-Q289 PolarHBondContact N-O 3.07Å; D259-Q289 PolarHBondContact N-O 2.91Å; D259-Q289 PolarHBondContact O-N 2.85Å; R261-Q289 VanDerWaalsContact CD-OE1 3.3Å; M287-Q289 PolarHBondContact O-N 2.89Å; Q289-L323 HydrophobicContact CG-CD1 4.48Å; Q289-L323 HydrophobicContact CG-CD2 3.94Å; Q289-Y325 HydrophobicContact CB-CD1 4.29Å; Q289-Y325 HydrophobicContact CB-CE1 3.91Å; Q289-Y325 HydrophobicContact CG-CE1 3.91Å
290	C	86.1	Confident	68.1	Low	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.5	173.5	-61	0	0	0	0	110.1	L255 Q256 L323 V324	L255-C290 HydrophobicContact CB-CB 4.1Å; L255-C290 HydrophobicContact CD1-CB 4.28Å; Q256-C290 CarbonylContact O-C 3.56Å; Q256-C290 VanDerWaalsContact O-CA 3.24Å; Q256-C290 WeakPolarHBondContact O-CA 3.27Å; Q256-C290 WeakPolarHBondContact O-CB 3.42Å; C290-L323 WeakPolarHBondContact O-CA 3.18Å; C290-V324 HydrophobicContact CB-CG2 4.1Å; C290-V324 PolarHBondContact N-O 3.25Å; C290-V324 PolarHBondContact O-N 2.8Å
291	A	77.4	Confident	68.8	Low	4 Å²	4	34.7 Å²	34.7	3%	0.033	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.8	162	0	0	0	0	0	109.7	Q256 I258 V293 P321	Q256-A291 HydrophobicContact CB-CB 4.26Å; Q256-A291 PolarHBondContact N-O 3.49Å; Q256-A291 PolarHBondContact O-N 3.27Å; I258-A291 HydrophobicContact CD1-CB 3.77Å; I258-A291 HydrophobicContact CG1-CB 4.44Å; A291-V293 PolarHBondContact O-N 3.04Å; A291-P321 HydrophobicContact CB-CB 4.17Å; A291-P321 HydrophobicContact CB-CG 4.49Å
292	I	73	Confident	69.3	Low	1 Å²	1	25.9 Å²	25.9	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	122	168.7	-43.9	179.3	0	0	0	108.9	F216 L249 T253 L255 L298 P321 R322 V324	F216-I292 HydrophobicContact CE1-CD1 3.83Å; F216-I292 HydrophobicContact CZ-CD1 3.83Å; L249-I292 HydrophobicContact CD2-CD1 4.29Å; T253-I292 HydrophobicContact CG2-CG2 4.12Å; L255-I292 HydrophobicContact CD2-CB 4.33Å; L255-I292 HydrophobicContact CD2-CG1 4.25Å; L255-I292 HydrophobicContact CD2-CG2 4.3Å; I292-L298 HydrophobicContact CD1-CD1 3.56Å; I292-L298 HydrophobicContact CG1-CD1 4.46Å; I292-L298 HydrophobicContact CG2-CD1 3.48Å; I292-L298 VanDerWaalsContact CG2-CD1 3.48Å; I292-P321 WeakPolarHBondContact O-CB 3.39Å; I292-R322 PolarHBondContact N-O 2.92Å; I292-V324 HydrophobicContact CD1-CG1 3.51Å; I292-V324 HydrophobicContact CD1-CG2 4.44Å; I292-V324 HydrophobicContact CG1-CB 4.29Å; I292-V324 HydrophobicContact CG1-CG1 3.64Å; I292-V324 HydrophobicContact CG1-CG2 3.66Å
293	V	67.5	Low	69.2	Low	10 Å²	10	24.8 Å²	24.8	6%	0.061	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	131.8	174.9	-167.7	0	0	0	0	109.1	F205 V254 Q256 A291 A560 S563	F205-V293 HydrophobicContact CD1-CG2 4.05Å; F205-V293 HydrophobicContact CE1-CG2 4.25Å; V254-V293 HydrophobicContact CB-CB 4.26Å; V254-V293 HydrophobicContact CB-CG2 4.33Å; V254-V293 HydrophobicContact CG1-CB 4.36Å; V254-V293 HydrophobicContact CG1-CG2 3.96Å; V254-V293 VanDerWaalsContact O-CB 3.29Å; V254-V293 WeakPolarHBondContact O-CB 3.08Å; V254-V293 WeakPolarHBondContact O-CG2 3.5Å; V254-V293 PolarHBondContact O-N 3.46Å; Q256-V293 HydrophobicContact CB-CG2 3.98Å; Q256-V293 VanDerWaalsContact N-CG2 3.27Å; A291-V293 PolarHBondContact O-N 3.04Å; V293-A560 HydrophobicContact CG1-CB 4.29Å; V293-S563 WeakPolarHBondContact CG1-OG 2.62Å
294	G	59.3	Low	68.6	Low	18 Å²	18	20.1 Å²	20.1	19%	0.186	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	23.4	177	0	0	0	0	0	116.7	K296 A297 A559	G294-K296 VanDerWaalsContact C-N 3.26Å; G294-K296 PolarHBondContact O-N 3.36Å; G294-A297 WeakPolarHBondContact O-CB 3.4Å; G294-A297 PolarHBondContact O-N 3.4Å; G294-A559 VanDerWaalsContact CA-CB 3.42Å; G294-A559 WeakPolarHBondContact CA-O 3.29Å
295	G	53	Low	67.6	Low	8 Å²	8	17.9 Å²	17.9	8%	0.082	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-47.5	-19.1	-162.4	0	0	0	0	0	120.5	A297 L298 F317	G295-A297 PolarHBondContact O-N 2.77Å; G295-A297 VanDerWaalsContact O-N 3.14Å; G295-L298 PolarHBondContact O-N 3.39Å; G295-F317 VanDerWaalsContact C-CD1 3.5Å; G295-F317 WeakPolarHBondContact O-CD1 3.39Å; G295-F317 VanDerWaalsContact O-CD2 3.26Å; G295-F317 WeakPolarHBondContact O-CD2 3.27Å; G295-F317 WeakPolarHBondContact O-CE1 3.07Å; G295-F317 VanDerWaalsContact O-CE2 3.29Å; G295-F317 WeakPolarHBondContact O-CE2 3.4Å; G295-F317 VanDerWaalsContact O-CG 3.3Å; G295-F317 WeakPolarHBondContact O-CG 3.36Å; G295-F317 WeakPolarHBondContact O-CZ 3.42Å
296	K	54.8	Low	66.7	Low	68 Å²	68	18.9 Å²	18.9	30%	0.296	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-54.3	-32.6	170.3	-69.7	-166.3	173.3	-161.1	0	112.2	G294 L298 A299 L314 F317 N318 I542	G294-K296 VanDerWaalsContact C-N 3.26Å; G294-K296 PolarHBondContact O-N 3.36Å; K296-L298 PolarHBondContact O-N 3.34Å; K296-A299 PolarHBondContact O-N 3.26Å; K296-L314 HydrophobicContact CB-CD1 4.09Å; K296-L314 HydrophobicContact CD-CD1 4.27Å; K296-L314 HydrophobicContact CG-CD1 4.11Å; K296-F317 HydrophobicContact CG-CB 4.3Å; K296-N318 WeakPolarHBondContact CE-OD1 3.34Å; K296-N318 PolarHBondContact NZ-OD1 3.23Å; K296-I542 HydrophobicContact CB-CD1 4.24Å
297	A	50.5	Low	65.6	Low	1 Å²	1	24.6 Å²	24.6	1%	0.008	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-65.4	0.5	173.5	0	0	0	0	0	114.7	G294 G295 Q552 I555 S556	G294-A297 WeakPolarHBondContact O-CB 3.4Å; G294-A297 PolarHBondContact O-N 3.4Å; G295-A297 PolarHBondContact O-N 2.77Å; G295-A297 VanDerWaalsContact O-N 3.14Å; A297-Q552 WeakPolarHBondContact O-CG 3.47Å; A297-Q552 PolarHBondContact O-NE2 3.07Å; A297-I555 HydrophobicContact CB-CB 3.93Å; A297-I555 HydrophobicContact CB-CG2 3.59Å; A297-S556 VanDerWaalsContact CB-CA 3.45Å; A297-S556 VanDerWaalsContact CB-OG 3.26Å; A297-S556 WeakPolarHBondContact CB-OG 3.18Å; A297-S556 PolarHBondContact O-OG 3.01Å
298	L	55.5	Low	64.4	Low	11 Å²	11	26.7 Å²	26.7	6%	0.058	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-124.1	19.7	173.9	-66.5	179.8	0	0	0	113.2	L249 T253 I292 G295 K296 A300 L301 A302 F317	L249-L298 HydrophobicContact CD2-CD1 3.96Å; T253-L298 HydrophobicContact CG2-CD1 4.46Å; I292-L298 HydrophobicContact CD1-CD1 3.56Å; I292-L298 HydrophobicContact CG1-CD1 4.46Å; I292-L298 HydrophobicContact CG2-CD1 3.48Å; I292-L298 VanDerWaalsContact CG2-CD1 3.48Å; G295-L298 PolarHBondContact O-N 3.39Å; K296-L298 PolarHBondContact O-N 3.34Å; L298-A300 VanDerWaalsContact C-N 3.26Å; L298-A300 PolarHBondContact O-N 3.29Å; L298-L301 HydrophobicContact CB-CB 4.25Å; L298-L301 HydrophobicContact CD1-CD2 4.22Å; L298-L301 HydrophobicContact CD2-CB 4.27Å; L298-L301 HydrophobicContact CD2-CD2 4.07Å; L298-L301 PolarHBondContact O-N 2.88Å; L298-A302 PolarHBondContact O-N 2.81Å; L298-F317 HydrophobicContact CB-CE2 4.39Å; L298-F317 HydrophobicContact CB-CZ 4.06Å
299	A	59.4	Low	63	Low	3 Å²	3	29.4 Å²	29.4	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-52.4	-40.9	173.6	0	0	0	0	0	113.1	K296 S303 A313 L314	K296-A299 PolarHBondContact O-N 3.26Å; A299-S303 WeakPolarHBondContact O-CB 3.42Å; A299-S303 PolarHBondContact O-N 2.97Å; A299-A313 VanDerWaalsContact O-CB 3.28Å; A299-A313 WeakPolarHBondContact O-CB 3.39Å; A299-L314 HydrophobicContact CB-CB 4.09Å; A299-L314 HydrophobicContact CB-CD1 4.09Å
300	A	57.5	Low	61.7	Low	45 Å²	45	31.9 Å²	31.9	37%	0.372	20%	0.198	S	C	.	.	H	α-helix	trans	-64.7	-42.8	175.7	0	0	0	0	0	112.8	L298 S303 S304	L298-A300 VanDerWaalsContact C-N 3.26Å; L298-A300 PolarHBondContact O-N 3.29Å; A300-S303 PolarHBondContact O-N 2.84Å; A300-S304 PolarHBondContact O-N 2.93Å; A300-S304 PolarHBondContact O-OG 3.1Å
301	L	57.8	Low	60.3	Low	32 Å²	32	37.1 Å²	37.1	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-48.3	177.2	-178.1	65.6	0	0	0	110.7	F216 I248 L249 L298 S303 S304 I305	F216-L301 HydrophobicContact CE2-CD2 4.3Å; F216-L301 HydrophobicContact CZ-CD2 4.13Å; F216-L301 HydrophobicContact CZ-CG 4.48Å; I248-L301 WeakPolarHBondContact O-CD2 3.38Å; L249-L301 HydrophobicContact CD2-CD2 3.92Å; L298-L301 HydrophobicContact CB-CB 4.25Å; L298-L301 HydrophobicContact CD1-CD2 4.22Å; L298-L301 HydrophobicContact CD2-CB 4.27Å; L298-L301 HydrophobicContact CD2-CD2 4.07Å; L298-L301 PolarHBondContact O-N 2.88Å; L301-S303 VanDerWaalsContact C-N 3.34Å; L301-S303 PolarHBondContact O-N 2.9Å; L301-S304 PolarHBondContact O-N 2.85Å; L301-S304 PolarHBondContact O-OG 2.89Å; L301-I305 HydrophobicContact CD1-CD1 3.75Å; L301-I305 HydrophobicContact CD1-CG1 4.43Å; L301-I305 HydrophobicContact CD2-CD1 4.44Å; L301-I305 HydrophobicContact CG-CD1 3.68Å; L301-I305 WeakPolarHBondContact O-CG1 3.39Å; L301-I305 PolarHBondContact O-N 2.97Å
302	A	60.7	Low	59.5	Low	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-41.8	176.5	0	0	0	0	0	112.6	L298 S304 I305 T306 A313 W316 F317	L298-A302 PolarHBondContact O-N 2.81Å; A302-S304 PolarHBondContact O-N 3.19Å; A302-I305 PolarHBondContact O-N 3.13Å; A302-T306 WeakPolarHBondContact O-CB 3.26Å; A302-T306 PolarHBondContact O-N 2.85Å; A302-T306 PolarHBondContact O-OG1 2.88Å; A302-A313 HydrophobicContact CB-CB 4.2Å; A302-W316 HydrophobicContact CB-CE3 3.97Å; A302-W316 HydrophobicContact CB-CZ3 4.18Å; A302-F317 HydrophobicContact CB-CE2 3.56Å; A302-F317 HydrophobicContact CB-CZ 3.96Å
303	S	61	Low	58.9	Low	22 Å²	22	40.8 Å²	40.8	15%	0.154	24%	0.242	C	C	.	.	H	α-helix	trans	-55.5	-49	173.9	-178.2	0	0	0	0	111.1	A299 A300 L301 I305 N307 L308	A299-S303 WeakPolarHBondContact O-CB 3.42Å; A299-S303 PolarHBondContact O-N 2.97Å; A300-S303 PolarHBondContact O-N 2.84Å; L301-S303 VanDerWaalsContact C-N 3.34Å; L301-S303 PolarHBondContact O-N 2.9Å; S303-I305 PolarHBondContact O-N 3.01Å; S303-N307 WeakPolarHBondContact O-CA 3.5Å; S303-N307 PolarHBondContact O-N 2.68Å; S303-L308 WeakPolarHBondContact CA-O 3.27Å; S303-L308 WeakPolarHBondContact CB-O 3.43Å; S303-L308 PolarHBondContact OG-O 3.4Å
304	S	59.6	Low	58.5	Low	80 Å²	80	41.6 Å²	41.6	56%	0.559	25%	0.246	S	C	*	.	H	α-helix	trans	-65.9	-28.8	177.7	66.2	0	0	0	0	115.3	A300 L301 A302	A300-S304 PolarHBondContact O-N 2.93Å; A300-S304 PolarHBondContact O-OG 3.1Å; L301-S304 PolarHBondContact O-N 2.85Å; L301-S304 PolarHBondContact O-OG 2.89Å; A302-S304 PolarHBondContact O-N 3.19Å
305	I	56.4	Low	58.6	Low	19 Å²	19	43.9 Å²	43.9	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-88.4	-28.2	-176.4	-67.5	165.7	0	0	0	112.3	F216 N245 L301 A302 S303	F216-I305 HydrophobicContact CB-CG2 4.41Å; F216-I305 HydrophobicContact CD2-CD1 3.57Å; F216-I305 HydrophobicContact CD2-CG2 4.17Å; F216-I305 HydrophobicContact CE2-CD1 3.32Å; F216-I305 HydrophobicContact CG-CG2 4.46Å; F216-I305 HydrophobicContact CZ-CD1 4.15Å; N245-I305 HydrophobicContact CB-CG2 4Å; L301-I305 HydrophobicContact CD1-CD1 3.75Å; L301-I305 HydrophobicContact CD1-CG1 4.43Å; L301-I305 HydrophobicContact CD2-CD1 4.44Å; L301-I305 HydrophobicContact CG-CD1 3.68Å; L301-I305 WeakPolarHBondContact O-CG1 3.39Å; L301-I305 PolarHBondContact O-N 2.97Å; A302-I305 PolarHBondContact O-N 3.13Å; S303-I305 PolarHBondContact O-N 3.01Å
306	T	62	Low	58.9	Low	39 Å²	39	44.3 Å²	44.3	24%	0.239	25%	0.253	C	S	.	.	H	α-helix	trans	-109.2	-3.1	-174.9	58.4	0	0	0	0	114	A302 L308 W316	A302-T306 WeakPolarHBondContact O-CB 3.26Å; A302-T306 PolarHBondContact O-N 2.85Å; A302-T306 PolarHBondContact O-OG1 2.88Å; T306-L308 PolarHBondContact O-N 3.38Å; T306-L308 VanDerWaalsContact O-N 3.13Å; T306-L308 WeakPolarHBondContact OG1-CB 3.38Å; T306-L308 WeakPolarHBondContact OG1-CD1 3.32Å; T306-L308 VanDerWaalsContact OG1-CG 3.26Å; T306-L308 WeakPolarHBondContact OG1-CG 3.25Å; T306-W316 HydrophobicContact CG2-CE3 4.39Å; T306-W316 HydrophobicContact CG2-CH2 3.51Å; T306-W316 HydrophobicContact CG2-CZ2 4.2Å; T306-W316 HydrophobicContact CG2-CZ3 3.6Å
307	N	62.2	Low	59.1	Low	152 Å²	152	41.6 Å²	41.6	81%	0.813	24%	0.241	S	C	*	.			trans	55.1	19.7	-170	-57.2	-37.9	0	0	0	113.8	S303	S303-N307 WeakPolarHBondContact O-CA 3.5Å; S303-N307 PolarHBondContact O-N 2.68Å
308	L	62.2	Low	59.5	Low	45 Å²	45	45.5 Å²	45.5	24%	0.236	26%	0.262	C	S	.	.			trans	-72.4	148.4	170.4	-70.9	177.5	0	0	0	110.2	S303 T306 D312 A313 W316	S303-L308 WeakPolarHBondContact CA-O 3.27Å; S303-L308 WeakPolarHBondContact CB-O 3.43Å; S303-L308 PolarHBondContact OG-O 3.4Å; T306-L308 PolarHBondContact O-N 3.38Å; T306-L308 VanDerWaalsContact O-N 3.13Å; T306-L308 WeakPolarHBondContact OG1-CB 3.38Å; T306-L308 WeakPolarHBondContact OG1-CD1 3.32Å; T306-L308 VanDerWaalsContact OG1-CG 3.26Å; T306-L308 WeakPolarHBondContact OG1-CG 3.25Å; L308-D312 HydrophobicContact CB-CB 4.15Å; L308-D312 HydrophobicContact CD2-CB 4.25Å; L308-A313 HydrophobicContact CB-CB 4.33Å; L308-W316 HydrophobicContact CD1-CB 4.35Å; L308-W316 HydrophobicContact CD1-CD2 4.07Å; L308-W316 HydrophobicContact CD1-CG 4.01Å
309	S	59	Low	59.5	Low	57 Å²	57	50.1 Å²	50.1	40%	0.399	29%	0.287	S	S	.	.			trans	-58.2	154.7	168.7	86.3	0	0	0	0	110.3	Q311 D312 A313	S309-Q311 PolarHBondContact O-N 2.8Å; S309-Q311 VanDerWaalsContact O-N 3.15Å; S309-Q311 PolarHBondContact OG-N 3.07Å; S309-D312 WeakPolarHBondContact CB-OD2 3.28Å; S309-D312 PolarHBondContact O-N 3.18Å; S309-D312 VanDerWaalsContact OG-CG 3.23Å; S309-D312 PolarHBondContact OG-N 3.27Å; S309-D312 PolarHBondContact OG-OD2 3.17Å; S309-A313 WeakPolarHBondContact O-CB 3.42Å; S309-A313 PolarHBondContact O-N 2.94Å
310	S	60.9	Low	59.3	Low	54 Å²	54	51.3 Å²	51.3	38%	0.378	30%	0.299	S	S	.	.	H	α-helix	trans	-61	-28.3	-179.5	-43.2	0	0	0	0	112.8	L314	S310-L314 WeakPolarHBondContact O-CB 3.26Å; S310-L314 PolarHBondContact O-N 3.16Å
311	Q	57.3	Low	59.5	Low	110 Å²	110	53 Å²	53	51%	0.514	31%	0.307	S	S	.	.	H	α-helix	trans	-74.3	-41.3	174.4	-174.8	59.4	49.4	0	0	111.7	S309 L314 N315	S309-Q311 PolarHBondContact O-N 2.8Å; S309-Q311 VanDerWaalsContact O-N 3.15Å; S309-Q311 PolarHBondContact OG-N 3.07Å; Q311-L314 PolarHBondContact O-N 2.64Å; Q311-N315 PolarHBondContact NE2-OD1 3.42Å; Q311-N315 WeakPolarHBondContact O-CB 3.43Å; Q311-N315 PolarHBondContact O-N 2.79Å; Q311-N315 PolarHBondContact O-ND2 2.88Å
312	D	60.6	Low	59.8	Low	82 Å²	82	51.9 Å²	51.9	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-68.1	-37.6	176.1	-64.2	-52	0	0	0	111.3	L308 S309 N315 W316	L308-D312 HydrophobicContact CB-CB 4.15Å; L308-D312 HydrophobicContact CD2-CB 4.25Å; S309-D312 WeakPolarHBondContact CB-OD2 3.28Å; S309-D312 PolarHBondContact O-N 3.18Å; S309-D312 VanDerWaalsContact OG-CG 3.23Å; S309-D312 PolarHBondContact OG-N 3.27Å; S309-D312 PolarHBondContact OG-OD2 3.17Å; D312-N315 CarbonylContact O-C 3.56Å; D312-N315 WeakPolarHBondContact O-CB 3.42Å; D312-N315 PolarHBondContact O-N 2.83Å; D312-W316 VanDerWaalsContact O-CB 3.32Å; D312-W316 WeakPolarHBondContact O-CB 3.41Å; D312-W316 PolarHBondContact O-N 3.32Å
313	A	59.9	Low	60.6	Low	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-36.1	172.2	0	0	0	0	0	112.6	A299 A302 L308 S309 W316 F317	A299-A313 VanDerWaalsContact O-CB 3.28Å; A299-A313 WeakPolarHBondContact O-CB 3.39Å; A302-A313 HydrophobicContact CB-CB 4.2Å; L308-A313 HydrophobicContact CB-CB 4.33Å; S309-A313 WeakPolarHBondContact O-CB 3.42Å; S309-A313 PolarHBondContact O-N 2.94Å; A313-W316 VanDerWaalsContact O-CB 3.25Å; A313-W316 WeakPolarHBondContact O-CB 3.44Å; A313-W316 PolarHBondContact O-N 3.04Å; A313-F317 VanDerWaalsContact O-CD2 3.24Å; A313-F317 WeakPolarHBondContact O-CD2 3.5Å; A313-F317 PolarHBondContact O-N 2.77Å
314	L	59.2	Low	61.5	Low	27 Å²	27	52.2 Å²	52.2	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-67.7	-43.1	171.4	-176.1	65.2	0	0	0	111.3	K296 A299 S310 Q311 W316 F317 N318 I542	K296-L314 HydrophobicContact CB-CD1 4.09Å; K296-L314 HydrophobicContact CD-CD1 4.27Å; K296-L314 HydrophobicContact CG-CD1 4.11Å; A299-L314 HydrophobicContact CB-CB 4.09Å; A299-L314 HydrophobicContact CB-CD1 4.09Å; S310-L314 WeakPolarHBondContact O-CB 3.26Å; S310-L314 PolarHBondContact O-N 3.16Å; Q311-L314 PolarHBondContact O-N 2.64Å; L314-W316 PolarHBondContact O-N 3.35Å; L314-F317 PolarHBondContact O-N 3.4Å; L314-F317 VanDerWaalsContact O-N 3.14Å; L314-N318 PolarHBondContact O-N 3.03Å; L314-I542 HydrophobicContact CD1-CD1 4.27Å
315	N	61.3	Low	62.8	Low	67 Å²	67	48.6 Å²	48.6	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-59.4	-34.7	171.2	-67.4	-24.5	0	0	0	111.3	Q311 D312 F317 N318	Q311-N315 PolarHBondContact NE2-OD1 3.42Å; Q311-N315 WeakPolarHBondContact O-CB 3.43Å; Q311-N315 PolarHBondContact O-N 2.79Å; Q311-N315 PolarHBondContact O-ND2 2.88Å; D312-N315 CarbonylContact O-C 3.56Å; D312-N315 WeakPolarHBondContact O-CB 3.42Å; D312-N315 PolarHBondContact O-N 2.83Å; N315-F317 PolarHBondContact O-N 2.88Å; N315-N318 WeakPolarHBondContact O-CB 3.23Å; N315-N318 PolarHBondContact O-N 3.22Å
316	W	58.8	Low	64.4	Low	17 Å²	17	47.7 Å²	47.7	6%	0.064	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-21.2	178	-148.9	49.5	0	0	0	113.1	F216 A217 N219 L223 A302 T306 L308 D312 A313 L314 R322	F216-W316 HydrophobicContact CD1-CZ3 4.27Å; A217-W316 WeakPolarHBondContact O-CH2 3.44Å; N219-W316 HydrophobicContact CB-CZ2 4.46Å; N219-W316 PolarHBondContact OD1-NE1 2.65Å; L223-W316 HydrophobicContact CD1-CZ2 3.71Å; A302-W316 HydrophobicContact CB-CE3 3.97Å; A302-W316 HydrophobicContact CB-CZ3 4.18Å; T306-W316 HydrophobicContact CG2-CE3 4.39Å; T306-W316 HydrophobicContact CG2-CH2 3.51Å; T306-W316 HydrophobicContact CG2-CZ2 4.2Å; T306-W316 HydrophobicContact CG2-CZ3 3.6Å; L308-W316 HydrophobicContact CD1-CB 4.35Å; L308-W316 HydrophobicContact CD1-CD2 4.07Å; L308-W316 HydrophobicContact CD1-CG 4.01Å; D312-W316 VanDerWaalsContact O-CB 3.32Å; D312-W316 WeakPolarHBondContact O-CB 3.41Å; D312-W316 PolarHBondContact O-N 3.32Å; A313-W316 VanDerWaalsContact O-CB 3.25Å; A313-W316 WeakPolarHBondContact O-CB 3.44Å; A313-W316 PolarHBondContact O-N 3.04Å; L314-W316 PolarHBondContact O-N 3.35Å; W316-R322 PolarHBondContact O-NE 3.2Å; W316-R322 PolarHBondContact O-NH2 2.79Å
317	F	59.7	Low	65.5	Low	11 Å²	11	46 Å²	46	5%	0.048	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-7.9	171.3	-72.5	-73.6	0	0	0	114.6	G295 K296 L298 A302 A313 L314 N315 N319 G320 R322	G295-F317 VanDerWaalsContact C-CD1 3.5Å; G295-F317 WeakPolarHBondContact O-CD1 3.39Å; G295-F317 VanDerWaalsContact O-CD2 3.26Å; G295-F317 WeakPolarHBondContact O-CD2 3.27Å; G295-F317 WeakPolarHBondContact O-CE1 3.07Å; G295-F317 VanDerWaalsContact O-CE2 3.29Å; G295-F317 WeakPolarHBondContact O-CE2 3.4Å; G295-F317 VanDerWaalsContact O-CG 3.3Å; G295-F317 WeakPolarHBondContact O-CG 3.36Å; G295-F317 WeakPolarHBondContact O-CZ 3.42Å; K296-F317 HydrophobicContact CG-CB 4.3Å; L298-F317 HydrophobicContact CB-CE2 4.39Å; L298-F317 HydrophobicContact CB-CZ 4.06Å; A302-F317 HydrophobicContact CB-CE2 3.56Å; A302-F317 HydrophobicContact CB-CZ 3.96Å; A313-F317 VanDerWaalsContact O-CD2 3.24Å; A313-F317 WeakPolarHBondContact O-CD2 3.5Å; A313-F317 PolarHBondContact O-N 2.77Å; L314-F317 PolarHBondContact O-N 3.4Å; L314-F317 VanDerWaalsContact O-N 3.14Å; N315-F317 PolarHBondContact O-N 2.88Å; F317-N319 VanDerWaalsContact C-N 3.26Å; F317-N319 PolarHBondContact O-N 3.44Å; F317-G320 PolarHBondContact O-N 3.46Å; F317-R322 HydrophobicContact CD1-CB 4.37Å; F317-R322 HydrophobicContact CD1-CG 3.73Å; F317-R322 HydrophobicContact CE1-CB 3.9Å; F317-R322 HydrophobicContact CE1-CG 3.68Å
318	N	59	Low	66.5	Low	82 Å²	82	38.9 Å²	38.9	44%	0.439	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-25	178.4	-75.6	-29.3	0	0	0	112.7	K296 L314 N315 G320	K296-N318 WeakPolarHBondContact CE-OD1 3.34Å; K296-N318 PolarHBondContact NZ-OD1 3.23Å; L314-N318 PolarHBondContact O-N 3.03Å; N315-N318 WeakPolarHBondContact O-CB 3.23Å; N315-N318 PolarHBondContact O-N 3.22Å; N318-G320 VanDerWaalsContact C-N 3.28Å; N318-G320 PolarHBondContact O-N 3.45Å
319	N	55.7	Low	67	Low	109 Å²	109	39.8 Å²	39.8	58%	0.583	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	18.4	-178.4	-55.9	7.2	0	0	0	113.5	T224 F317	T224-N319 HydrophobicContact CG2-CB 3.98Å; F317-N319 VanDerWaalsContact C-N 3.26Å; F317-N319 PolarHBondContact O-N 3.44Å
320	G	55.8	Low	67.6	Low	28 Å²	28	37.2 Å²	37.2	29%	0.289	22%	0.217	S	C	.	.	S	Bend	trans	116.4	171	177.2	0	0	0	0	0	114.8	F317 N318	F317-G320 PolarHBondContact O-N 3.46Å; N318-G320 VanDerWaalsContact C-N 3.28Å; N318-G320 PolarHBondContact O-N 3.45Å
321	P	60.3	Low	68.1	Low	80 Å²	80	43.6 Å²	43.6	52%	0.519	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-62.3	145.9	176.9	29.2	-35.4	0	0	0	110.5	A291 I292	A291-P321 HydrophobicContact CB-CB 4.17Å; A291-P321 HydrophobicContact CB-CG 4.49Å; I292-P321 WeakPolarHBondContact O-CB 3.39Å
322	R	65.2	Low	68.7	Low	9 Å²	9	38.9 Å²	38.9	3%	0.034	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-101.4	146.6	-177.1	-61.8	-47.9	-167.2	-167.7	6.5	112.4	L223 I292 W316 F317	L223-R322 PolarHBondContact O-NH1 3.01Å; I292-R322 PolarHBondContact N-O 2.92Å; W316-R322 PolarHBondContact O-NE 3.2Å; W316-R322 PolarHBondContact O-NH2 2.79Å; F317-R322 HydrophobicContact CD1-CB 4.37Å; F317-R322 HydrophobicContact CD1-CG 3.73Å; F317-R322 HydrophobicContact CE1-CB 3.9Å; F317-R322 HydrophobicContact CE1-CG 3.68Å
323	L	76.1	Confident	69.9	Low	28 Å²	28	35.1 Å²	35.1	15%	0.147	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.8	-179.7	-61.3	178	0	0	0	110	L230 I258 Q289 C290 Y325	L230-L323 HydrophobicContact CD2-CD1 4.46Å; L230-L323 HydrophobicContact CD2-CD2 4.26Å; I258-L323 HydrophobicContact CD1-CD2 3.51Å; Q289-L323 HydrophobicContact CG-CD1 4.48Å; Q289-L323 HydrophobicContact CG-CD2 3.94Å; C290-L323 WeakPolarHBondContact O-CA 3.18Å; L323-Y325 HydrophobicContact CB-CE2 4.13Å
324	V	81.6	Confident	71.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.2	169.2	-75.7	0	0	0	0	109.5	C214 L215 F216 L249 L255 C290 I292	C214-V324 HydrophobicContact CB-CB 3.99Å; C214-V324 HydrophobicContact CB-CG1 4.27Å; L215-V324 WeakPolarHBondContact O-CA 3.42Å; F216-V324 HydrophobicContact CD1-CG1 4.14Å; F216-V324 HydrophobicContact CD2-CG1 4.2Å; F216-V324 HydrophobicContact CE1-CG1 3.84Å; F216-V324 HydrophobicContact CE2-CG1 3.9Å; F216-V324 HydrophobicContact CG-CG1 4.32Å; F216-V324 HydrophobicContact CZ-CG1 3.72Å; L249-V324 HydrophobicContact CD1-CG2 4.23Å; L255-V324 HydrophobicContact CD2-CG2 3.99Å; C290-V324 HydrophobicContact CB-CG2 4.1Å; C290-V324 PolarHBondContact N-O 3.25Å; C290-V324 PolarHBondContact O-N 2.8Å; I292-V324 HydrophobicContact CD1-CG1 3.51Å; I292-V324 HydrophobicContact CD1-CG2 4.44Å; I292-V324 HydrophobicContact CG1-CB 4.29Å; I292-V324 HydrophobicContact CG1-CG1 3.64Å; I292-V324 HydrophobicContact CG1-CG2 3.66Å
325	Y	86	Confident	72.5	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114.4	-178.8	-63.1	-86.5	0	0	0	110.5	C214 L215 A217 L241 M287 L288 Q289 L323	C214-Y325 WeakPolarHBondContact CA-O 3.09Å; L215-Y325 PolarHBondContact N-O 3.37Å; L215-Y325 PolarHBondContact O-N 3.41Å; A217-Y325 HydrophobicContact CB-CE2 4.19Å; L241-Y325 HydrophobicContact CD1-CD1 4.45Å; L241-Y325 HydrophobicContact CD1-CD2 3.74Å; L241-Y325 HydrophobicContact CD1-CE2 4.37Å; L241-Y325 HydrophobicContact CD1-CG 3.78Å; L241-Y325 HydrophobicContact CD2-CD2 4.02Å; L241-Y325 HydrophobicContact CD2-CE2 4.01Å; M287-Y325 HydrophobicContact CB-CD1 4.21Å; M287-Y325 WeakPolarHBondContact CE-O 3.07Å; M287-Y325 HydrophobicContact SD-CG 4.44Å; L288-Y325 VanDerWaalsContact O-CA 3.27Å; L288-Y325 WeakPolarHBondContact O-CA 3.46Å; Q289-Y325 HydrophobicContact CB-CD1 4.29Å; Q289-Y325 HydrophobicContact CB-CE1 3.91Å; Q289-Y325 HydrophobicContact CG-CE1 3.91Å; L323-Y325 HydrophobicContact CB-CE2 4.13Å
326	L	89.5	Confident	73.8	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107	173.9	-50.1	-179.7	0	0	0	107.6	T212 Q213 C214 L249 L255 L288 L328 I333	T212-L326 HydrophobicContact CG2-CD1 4.49Å; T212-L326 HydrophobicContact CG2-CD2 4.26Å; Q213-L326 WeakPolarHBondContact O-CD2 3.24Å; C214-L326 HydrophobicContact CB-CD2 3.54Å; L249-L326 HydrophobicContact CD1-CD2 4.06Å; L255-L326 HydrophobicContact CD1-CD1 3.6Å; L255-L326 HydrophobicContact CD1-CG 4.49Å; L288-L326 WeakPolarHBondContact CA-O 3.35Å; L288-L326 HydrophobicContact CB-CB 4.24Å; L288-L326 WeakPolarHBondContact CB-O 3.32Å; L288-L326 HydrophobicContact CD1-CB 4.04Å; L288-L326 HydrophobicContact CD1-CD1 4.27Å; L288-L326 PolarHBondContact N-O 3.1Å; L288-L326 PolarHBondContact O-N 3.19Å; L288-L326 VanDerWaalsContact O-N 3.12Å; L326-L328 WeakPolarHBondContact O-CD1 3.31Å; L326-I333 HydrophobicContact CD1-CD1 4.4Å
327	S	84.9	Confident	75.3	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	169.7	171.4	16.8	0	0	0	0	112.6	S286 M287 S330 L580	S286-S327 WeakPolarHBondContact O-CB 3.37Å; M287-S327 WeakPolarHBondContact CE-OG 3.1Å; S327-S330 PolarHBondContact O-OG 3.28Å; S327-L580 CarbonylContact C-O 3.49Å; S327-L580 VanDerWaalsContact C-O 3.3Å; S327-L580 VanDerWaalsContact CB-CB 3.47Å; S327-L580 VanDerWaalsContact CB-N 3.32Å; S327-L580 WeakPolarHBondContact OG-CB 3.49Å
328	L	83.3	Confident	76.4	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	19%	0.19	C	C	.	.	S	Bend	trans	-128.1	18.1	-163.4	-36.8	64.3	0	0	0	120.9	C195 W199 L288 L326 S330 S577 Y578	C195-L328 HydrophobicContact CB-CB 3.56Å; C195-L328 HydrophobicContact CB-CD2 3.48Å; C195-L328 VanDerWaalsContact CB-CD2 3.48Å; C195-L328 HydrophobicContact CB-CG 3.26Å; C195-L328 WeakPolarHBondContact O-CD2 3.37Å; W199-L328 HydrophobicContact CB-CD2 4.04Å; L288-L328 HydrophobicContact CB-CD1 4.35Å; L288-L328 HydrophobicContact CD1-CD2 4.12Å; L288-L328 HydrophobicContact CD1-CG 4.2Å; L288-L328 HydrophobicContact CD2-CD1 4.45Å; L288-L328 HydrophobicContact CD2-CD2 3.72Å; L288-L328 HydrophobicContact CD2-CG 4.41Å; L288-L328 HydrophobicContact CG-CD1 3.72Å; L288-L328 HydrophobicContact CG-CD2 3.65Å; L288-L328 HydrophobicContact CG-CG 3.79Å; L326-L328 WeakPolarHBondContact O-CD1 3.31Å; L328-S330 WeakPolarHBondContact CA-OG 3.3Å; L328-S330 PolarHBondContact O-N 3.32Å; L328-S577 WeakPolarHBondContact CB-O 3.41Å; L328-S577 VanDerWaalsContact CD1-CB 3.45Å; L328-S577 WeakPolarHBondContact CD1-O 3.48Å; L328-S577 WeakPolarHBondContact CD2-O 3.5Å; L328-S577 WeakPolarHBondContact CD2-OG 3.43Å; L328-S577 WeakPolarHBondContact CG-O 3.42Å; L328-Y578 HydrophobicContact CB-CD1 3.75Å; L328-Y578 HydrophobicContact CB-CE1 3.95Å; L328-Y578 HydrophobicContact CD2-CE1 4.41Å; L328-Y578 WeakPolarHBondContact O-CD1 3.47Å
329	A	73.7	Confident	77.4	Confident	65 Å²	65	30.7 Å²	30.7	54%	0.537	17%	0.173	S	C	.	.	S	Bend	trans	-66.1	-11.4	155	0	0	0	0	0	111.2	Q579	A329-Q579 VanDerWaalsContact CB-O 3.23Å; A329-Q579 WeakPolarHBondContact CB-O 3.21Å; A329-Q579 VanDerWaalsContact N-N 3.14Å
330	S	71.2	Confident	78.1	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.021	16%	0.159	C	C	.	.			trans	11	109.9	148.5	-89.8	0	0	0	0	117.6	S194 C195 S327 L328 L580 N581	S194-S330 WeakPolarHBondContact CB-O 3.49Å; C195-S330 WeakPolarHBondContact CB-OG 3.47Å; C195-S330 VanDerWaalsContact N-CB 3.32Å; C195-S330 PolarHBondContact N-OG 2.73Å; C195-S330 PolarHBondContact SG-OG 2.91Å; S327-S330 PolarHBondContact O-OG 3.28Å; L328-S330 WeakPolarHBondContact CA-OG 3.3Å; L328-S330 PolarHBondContact O-N 3.32Å; S330-L580 WeakPolarHBondContact CA-O 3.18Å; S330-L580 WeakPolarHBondContact CB-O 3.11Å; S330-L580 PolarHBondContact N-O 3.19Å; S330-L580 PolarHBondContact OG-O 3.34Å; S330-N581 WeakPolarHBondContact CB-ND2 3.48Å; S330-N581 PolarHBondContact OG-ND2 2.86Å
331	K	71.5	Confident	78.2	Confident	187 Å²	187	30.2 Å²	30.2	81%	0.813	17%	0.169	S	C	*	.	S	Bend	trans	-133.1	3.6	157.1	-59.6	-176	-176.3	176.4	0	114.5	S193	S193-K331 CarbonylContact O-C 3.57Å; S193-K331 WeakPolarHBondContact O-CA 3.35Å
332	S	70.5	Confident	77.7	Confident	12 Å²	12	29.7 Å²	29.7	8%	0.084	17%	0.167	C	C	.	.	S	Bend	trans	-110.6	-6.8	-176.2	99.9	0	0	0	0	115.8	N581 Q584	S332-N581 WeakPolarHBondContact OG-CB 3.04Å; S332-N581 PolarHBondContact OG-OD1 2.95Å; S332-Q584 PolarHBondContact O-NE2 3.3Å; S332-Q584 PolarHBondContact OG-NE2 3.47Å
333	I	84	Confident	76.5	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.015	19%	0.192	C	C	.	.			trans	-72.7	146.2	165.8	-174.1	169.1	0	0	0	109.1	S193 C195 L208 T212 L326 C335 N581	S193-I333 CarbonylContact C-O 3.54Å; S193-I333 VanDerWaalsContact CA-O 3.29Å; S193-I333 WeakPolarHBondContact CA-O 3.18Å; S193-I333 VanDerWaalsContact O-O 3.09Å; C195-I333 VanDerWaalsContact N-CG2 3.34Å; C195-I333 WeakPolarHBondContact SG-CD1 3.47Å; L208-I333 HydrophobicContact CD2-CD1 3.82Å; L208-I333 HydrophobicContact CD2-CG1 4.06Å; T212-I333 HydrophobicContact CG2-CB 3.79Å; T212-I333 HydrophobicContact CG2-CD1 4.02Å; T212-I333 HydrophobicContact CG2-CG1 3.83Å; L326-I333 HydrophobicContact CD1-CD1 4.4Å; I333-C335 HydrophobicContact CD1-CB 4.11Å; I333-C335 HydrophobicContact CG1-CB 4.12Å; I333-N581 PolarHBondContact N-ND2 2.57Å; I333-N581 VanDerWaalsContact N-ND2 3.12Å
334	M	85.3	Confident	74.4	Confident	76 Å²	76	38.2 Å²	38.2	37%	0.374	22%	0.216	S	C	.	.			trans	-135.2	124.1	160.9	-167.6	170.8	72.2	0	0	106.9	V191 W192 R209 K210	V191-M334 HydrophobicContact CG1-CG 3.5Å; V191-M334 VanDerWaalsContact CG1-CG 3.5Å; V191-M334 HydrophobicContact CG1-SD 4.24Å; W192-M334 WeakPolarHBondContact O-CA 3.3Å; R209-M334 WeakPolarHBondContact CA-O 3.35Å; R209-M334 HydrophobicContact CB-CB 4.3Å; R209-M334 HydrophobicContact CB-CE 3.57Å; R209-M334 HydrophobicContact CB-CG 4.14Å; R209-M334 PolarHBondContact N-O 2.76Å; K210-M334 HydrophobicContact CB-CB 3.78Å; K210-M334 PolarHBondContact N-O 3.19Å
335	C	89.1	Confident	71.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	164.8	-174.7	62.4	0	0	0	0	112.7	V191 W192 V198 L207 L208 I333	V191-C335 CarbonylContact C-O 3.3Å; V191-C335 WeakPolarHBondContact CA-O 3.4Å; W192-C335 PolarHBondContact N-O 3.16Å; W192-C335 PolarHBondContact O-N 2.8Å; W192-C335 VanDerWaalsContact O-N 3.13Å; V198-C335 WeakPolarHBondContact CG2-SG 3.06Å; L207-C335 CarbonylContact O-C 3.2Å; L207-C335 WeakPolarHBondContact O-CA 3.47Å; L207-C335 WeakPolarHBondContact O-CB 3.42Å; L208-C335 HydrophobicContact CD2-CB 4.16Å; I333-C335 HydrophobicContact CD1-CB 4.11Å; I333-C335 HydrophobicContact CG1-CB 4.12Å
336	S	88.7	Confident	69.2	Low	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.1	179.3	-77.5	0	0	0	0	111.4	P190 I206 L207 R209	P190-S336 WeakPolarHBondContact O-CA 3.41Å; P190-S336 WeakPolarHBondContact O-CB 3.34Å; P190-S336 PolarHBondContact O-OG 3.13Å; I206-S336 CarbonylContact C-O 3.56Å; I206-S336 WeakPolarHBondContact CA-O 3.39Å; L207-S336 PolarHBondContact N-O 3.1Å; L207-S336 PolarHBondContact O-N 3.48Å; L207-S336 VanDerWaalsContact O-N 3.09Å; R209-S336 VanDerWaalsContact CZ-OG 3.31Å; R209-S336 PolarHBondContact NE-OG 3.24Å; R209-S336 PolarHBondContact NH2-OG 3.46Å
337	P	89.4	Confident	66.3	Low	4 Å²	4	56.2 Å²	56.2	3%	0.026	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	139.2	172.1	27.7	-31.6	0	0	0	110.3	V189 P190 W192 P203 G375 V376	V189-P337 HydrophobicContact CG1-CG 4.16Å; P190-P337 HydrophobicContact CG-CG 3.88Å; P190-P337 WeakPolarHBondContact O-CD 3.21Å; W192-P337 HydrophobicContact CH2-CB 3.78Å; W192-P337 HydrophobicContact CH2-CG 3.82Å; W192-P337 HydrophobicContact CZ3-CB 4.04Å; W192-P337 VanDerWaalsContact CZ3-CD 3.49Å; W192-P337 HydrophobicContact CZ3-CG 4.2Å; P203-P337 HydrophobicContact CB-CB 4.35Å; P337-G375 CarbonylContact O-C 3.58Å; P337-G375 VanDerWaalsContact O-CA 3.3Å; P337-G375 WeakPolarHBondContact O-CA 3.21Å; P337-V376 PolarHBondContact O-N 2.85Å
338	V	84	Confident	63.6	Low	10 Å²	10	61.9 Å²	61.9	6%	0.061	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-88.6	134.4	169.3	-177.4	0	0	0	0	108.7	W167 F205 L207 V254 T340 V376 L564	W167-V338 HydrophobicContact CH2-CG1 4.17Å; W167-V338 HydrophobicContact CZ3-CG1 3.72Å; F205-V338 HydrophobicContact CB-CB 4.03Å; F205-V338 HydrophobicContact CB-CG2 4.32Å; F205-V338 PolarHBondContact O-N 3.24Å; F205-V338 VanDerWaalsContact O-N 3.08Å; L207-V338 HydrophobicContact CB-CG2 3.87Å; V254-V338 HydrophobicContact CG1-CG2 3.99Å; V254-V338 HydrophobicContact CG2-CG2 4.13Å; V338-T340 PolarHBondContact O-N 3.21Å; V338-V376 HydrophobicContact CB-CG2 4.31Å; V338-V376 HydrophobicContact CG2-CG2 3.87Å; V338-L564 HydrophobicContact CG1-CD1 3.6Å; V338-L564 HydrophobicContact CG1-CD2 3.79Å; V338-L564 HydrophobicContact CG1-CG 4.34Å
339	K	79.8	Confident	61	Low	20 Å²	20	67.9 Å²	67.9	9%	0.087	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62.4	131.9	173.9	177.4	81.1	172.6	-169	0	109.2	D373 V376 H377	K339-D373 WeakPolarHBondContact CD-O 3.47Å; K339-D373 VanDerWaalsContact NZ-CA 3.34Å; K339-D373 PolarHBondContact NZ-O 3.28Å; K339-D373 IonicContact NZ-OD1 3.44Å; K339-D373 PolarHBondContact NZ-OD1 3.4Å; K339-D373 IonicContact NZ-OD2 2.74Å; K339-V376 PolarHBondContact N-O 3.5Å; K339-H377 VanDerWaalsContact CG-CE1 3.42Å; K339-H377 WeakPolarHBondContact CG-CE1 3.5Å
340	T	69.8	Low	59	Low	45 Å²	45	76 Å²	76	28%	0.276	40%	0.396	S	S	.	.			trans	-110.1	146.2	162	48.3	0	0	0	0	109.2	F205 V338 S342 L564	F205-T340 HydrophobicContact CD2-CG2 3.54Å; F205-T340 HydrophobicContact CE2-CG2 3.77Å; V338-T340 PolarHBondContact O-N 3.21Å; T340-S342 PolarHBondContact O-N 3Å; T340-L564 HydrophobicContact CG2-CD2 4.14Å
341	T	58.9	Low	56.8	Low	83 Å²	83	86.6 Å²	86.6	51%	0.509	44%	0.436	S	S	.	.			trans	-72.9	117.4	170.7	-23	0	0	0	0	108.1	T343	T341-T343 PolarHBondContact O-N 3.44Å
342	S	49.4	Very low	54.8	Low	68 Å²	68	84.4 Å²	84.4	48%	0.476	43%	0.433	S	S	.	.			trans	-88.4	94.4	172.9	38.5	0	0	0	0	109.1	T340 I344	T340-S342 PolarHBondContact O-N 3Å; S342-I344 PolarHBondContact O-N 2.72Å
343	T	39.2	Very low	52.9	Low	91 Å²	91	92.4 Å²	92.4	56%	0.558	47%	0.469	S	S	*	.			trans	-70.1	79	167.9	21.9	0	0	0	0	109.6	T341 N345 E568	T341-T343 PolarHBondContact O-N 3.44Å; T343-N345 PolarHBondContact O-N 2.86Å; T343-E568 WeakPolarHBondContact CB-OE1 3.24Å; T343-E568 WeakPolarHBondContact CG2-OE1 3.36Å; T343-E568 PolarHBondContact OG1-OE1 3.42Å
344	I	32.7	Very low	50.3	Low	125 Å²	125	98.9 Å²	98.9	64%	0.641	50%	0.503	S	S	*	.			trans	-66.1	89.2	171.9	-54.9	179.3	0	0	0	107.4	S342 I346	S342-I344 PolarHBondContact O-N 2.72Å; I344-I346 VanDerWaalsContact C-N 3.31Å; I344-I346 HydrophobicContact CG2-CG1 3.97Å; I344-I346 WeakPolarHBondContact O-CG1 3.47Å; I344-I346 PolarHBondContact O-N 3.5Å
345	N	26.7	Very low	47.7	Very low	137 Å²	137	104 Å²	104	73%	0.733	52%	0.523	S	S	*	.			trans	-75.8	84.7	-179.7	-164.1	-5	0	0	0	108.6	T343 N347	T343-N345 PolarHBondContact O-N 2.86Å; N345-N347 VanDerWaalsContact C-N 3.26Å; N345-N347 PolarHBondContact O-N 2.82Å
346	I	31.1	Very low	44.8	Very low	130 Å²	130	111.7 Å²	111.7	67%	0.667	57%	0.565	S	S	*	*			trans	-68.2	84.7	-176	-47.3	179.7	0	0	0	109.5	I344 T348	I344-I346 VanDerWaalsContact C-N 3.31Å; I344-I346 HydrophobicContact CG2-CG1 3.97Å; I344-I346 WeakPolarHBondContact O-CG1 3.47Å; I344-I346 PolarHBondContact O-N 3.5Å; I346-T348 VanDerWaalsContact C-N 3.32Å; I346-T348 HydrophobicContact CG2-CG2 3.8Å; I346-T348 PolarHBondContact O-N 2.9Å
347	N	28.5	Very low	42	Very low	117 Å²	117	117.2 Å²	117.2	63%	0.626	60%	0.603	S	S	*	*			trans	-74.7	84.1	-179.6	-134.1	-26.6	0	0	0	109.1	N345 N349	N345-N347 VanDerWaalsContact C-N 3.26Å; N345-N347 PolarHBondContact O-N 2.82Å; N347-N349 PolarHBondContact O-N 3.18Å
348	T	29.5	Very low	39.1	Very low	120 Å²	120	122 Å²	122	74%	0.736	64%	0.636	S	S	*	*			trans	-71.3	34.3	-174.2	44.7	0	0	0	0	114.4	I346	I346-T348 VanDerWaalsContact C-N 3.32Å; I346-T348 HydrophobicContact CG2-CG2 3.8Å; I346-T348 PolarHBondContact O-N 2.9Å
349	N	27.8	Very low	36.4	Very low	129 Å²	129	129.1 Å²	129.1	69%	0.69	67%	0.669	S	S	*	*			trans	-109.7	32.6	-172.9	-76.9	-45.9	0	0	0	114.2	N347	N347-N349 PolarHBondContact O-N 3.18Å
350	Y	31	Very low	34	Very low	237 Å²	237	135 Å²	135	93%	0.929	70%	0.7	S	S	*	*			trans	-109.9	69.8	166.4	-84.5	-76.4	0	0	0	111.7
351	R	26.9	Very low	31.8	Very low	225 Å²	225	141.3 Å²	141.3	85%	0.849	72%	0.723	S	S	*	*			trans	-90.5	102.6	176.8	-170.5	179.7	-169.8	176.6	3.4	111.1
352	N	27.9	Very low	30.2	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	74%	0.735	S	S	*	*			trans	42.6	99.4	160.8	-71.5	-14.3	0	0	0	118.4
353	H	32.3	Very low	29	Very low	180 Å²	180	147.1 Å²	147.1	83%	0.833	75%	0.752	S	S	*	*			trans	-128.2	105.3	144.3	-86.5	-71.6	0	0	0	112.1
354	N	29.5	Very low	28.2	Very low	138 Å²	138	145.8 Å²	145.8	74%	0.738	76%	0.757	S	S	*	*			trans	41.6	104.8	152.4	-63.8	-20.8	0	0	0	120.6
355	K	29.7	Very low	28	Very low	184 Å²	184	146.3 Å²	146.3	80%	0.8	76%	0.76	S	S	*	*				37.8	135.3	112.1	-65.9	-178.8	177.2	179.1	0	119.1
356	N	28.7	Very low	28	Very low	162 Å²	162	148.2 Å²	148.2	87%	0.866	77%	0.765	S	S	*	*			trans	80	62.7	158.3	-56.3	1.3	0	0	0	117.6
357	S	29	Very low	27.9	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	76%	0.763	S	S	*	*			trans	-142.6	109.4	140.7	-170.8	0	0	0	0	110.1
358	S	28.8	Very low	27.9	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	76%	0.762	S	S	*	*			trans	-90.3	150	178.8	54.2	0	0	0	0	111.5
359	H	27.5	Very low	28	Very low	160 Å²	160	150.9 Å²	150.9	74%	0.741	77%	0.766	S	S	*	*			trans	70.5	51.6	161.3	-94.5	-105	0	0	0	117.8
360	I	29.4	Very low	28.3	Very low	144 Å²	144	150.2 Å²	150.2	74%	0.738	76%	0.762	S	S	*	*			trans	-106.5	99.2	140.1	-53.4	-176.6	0	0	0	108	L362	I360-L362 HydrophobicContact CG2-CD1 3.85Å; I360-L362 PolarHBondContact O-N 3.45Å
361	K	23.1	Very low	28.8	Very low	177 Å²	177	144 Å²	144	77%	0.77	74%	0.744	S	S	*	*			trans	-79.2	93.4	170.3	-73.5	-175.5	175.2	-176.9	0	108.9
362	L	25	Very low	29.7	Very low	145 Å²	145	137.8 Å²	137.8	76%	0.759	72%	0.723	S	S	*	*			trans	-65.7	143.9	157.2	-79	90.8	0	0	0	108.8	I360 G364	I360-L362 HydrophobicContact CG2-CD1 3.85Å; I360-L362 PolarHBondContact O-N 3.45Å; L362-G364 PolarHBondContact O-N 2.9Å
363	P	24.9	Very low	30.9	Very low	129 Å²	129	134.4 Å²	134.4	84%	0.838	71%	0.705	S	S	*	*			trans	-80.3	104.1	-172.7	30.9	-34.4	0	0	0	112.6
364	G	23.3	Very low	32.7	Very low	63 Å²	63	128.6 Å²	128.6	65%	0.649	68%	0.68	S	S	*	*	S	Bend	trans	55.8	110	144.6	0	0	0	0	0	120.2	L362	L362-G364 PolarHBondContact O-N 2.9Å
365	N	27.7	Very low	35.3	Very low	135 Å²	135	122.1 Å²	122.1	72%	0.722	65%	0.646	S	S	*	*			trans	67.9	66.7	148.2	-58.1	12.9	0	0	0	118.7	T367	N365-T367 PolarHBondContact O-N 2.78Å; N365-T367 VanDerWaalsContact O-N 3.1Å
366	E	27.2	Very low	38	Very low	178 Å²	178	113.4 Å²	113.4	83%	0.832	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	39.6	158.9	-64.5	-175.3	140.9	0	0	112.6
367	T	28.3	Very low	40.7	Very low	102 Å²	102	105.8 Å²	105.8	63%	0.626	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	0.1	-176.8	49.8	0	0	0	0	114.6	N365 Y369	N365-T367 PolarHBondContact O-N 2.78Å; N365-T367 VanDerWaalsContact O-N 3.1Å; T367-Y369 VanDerWaalsContact C-N 3.33Å; T367-Y369 PolarHBondContact O-N 3.13Å
368	D	28.7	Very low	43.1	Very low	111 Å²	111	100.4 Å²	100.4	59%	0.594	53%	0.53	S	S	*	.			trans	-92.3	20.1	-174.2	-72.2	-5	0	0	0	113.9	N370 I371	D368-N370 PolarHBondContact O-N 2.93Å; D368-I371 HydrophobicContact CB-CD1 3.97Å; D368-I371 WeakPolarHBondContact O-CD1 3.38Å; D368-I371 VanDerWaalsContact O-CG1 3.24Å; D368-I371 WeakPolarHBondContact O-CG1 3.47Å; D368-I371 PolarHBondContact O-N 3.27Å
369	Y	30.6	Very low	45.6	Very low	210 Å²	210	95.5 Å²	95.5	82%	0.824	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.7	178	-90.7	-79.2	0	0	0	115.1	T367 I371	T367-Y369 VanDerWaalsContact C-N 3.33Å; T367-Y369 PolarHBondContact O-N 3.13Å; Y369-I371 PolarHBondContact O-N 3Å
370	N	35.1	Very low	48	Very low	115 Å²	115	88.1 Å²	88.1	62%	0.615	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.6	172	-68.5	-10.7	0	0	0	114.1	D368 F372 D373	D368-N370 PolarHBondContact O-N 2.93Å; N370-F372 VanDerWaalsContact C-N 3.28Å; N370-F372 PolarHBondContact O-N 2.96Å; N370-F372 VanDerWaalsContact O-N 3.09Å; N370-D373 PolarHBondContact O-N 3.34Å; N370-D373 VanDerWaalsContact O-N 3.16Å
371	I	41	Very low	50.3	Low	106 Å²	106	82 Å²	82	54%	0.544	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.7	-165.6	-83.9	169.5	0	0	0	115.6	D368 Y369	D368-I371 HydrophobicContact CB-CD1 3.97Å; D368-I371 WeakPolarHBondContact O-CD1 3.38Å; D368-I371 VanDerWaalsContact O-CG1 3.24Å; D368-I371 WeakPolarHBondContact O-CG1 3.47Å; D368-I371 PolarHBondContact O-N 3.27Å; Y369-I371 PolarHBondContact O-N 3Å
372	F	46	Very low	53.1	Low	95 Å²	95	73.6 Å²	73.6	42%	0.417	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	20.6	-179.7	-61.4	-61.7	0	0	0	115	A201 N370 N374	A201-F372 WeakPolarHBondContact O-CZ 3.49Å; N370-F372 VanDerWaalsContact C-N 3.28Å; N370-F372 PolarHBondContact O-N 2.96Å; N370-F372 VanDerWaalsContact O-N 3.09Å; F372-N374 PolarHBondContact O-N 3.48Å
373	D	53.4	Low	55.8	Low	69 Å²	69	66.9 Å²	66.9	37%	0.369	36%	0.359	S	S	.	.	S	Bend	trans	-68.5	-10.3	173.1	-108.1	2.3	0	0	0	114	K339 N370	K339-D373 WeakPolarHBondContact CD-O 3.47Å; K339-D373 VanDerWaalsContact NZ-CA 3.34Å; K339-D373 PolarHBondContact NZ-O 3.28Å; K339-D373 IonicContact NZ-OD1 3.44Å; K339-D373 PolarHBondContact NZ-OD1 3.4Å; K339-D373 IonicContact NZ-OD2 2.74Å; N370-D373 PolarHBondContact O-N 3.34Å; N370-D373 VanDerWaalsContact O-N 3.16Å
374	N	69.4	Low	58.3	Low	59 Å²	59	63.2 Å²	63.2	32%	0.316	34%	0.337	S	S	.	.			trans	-110	115.6	176.4	-49.1	-67.2	0	0	0	109.9	P187 F372	P187-N374 WeakPolarHBondContact CD-OD1 3.39Å; P187-N374 HydrophobicContact CG-CB 4.27Å; P187-N374 VanDerWaalsContact CG-CG 3.43Å; P187-N374 WeakPolarHBondContact CG-ND2 3.46Å; P187-N374 WeakPolarHBondContact CG-OD1 3.2Å; F372-N374 PolarHBondContact O-N 3.48Å
375	G	83.9	Confident	60.8	Low	2 Å²	2	62.6 Å²	62.6	2%	0.021	32%	0.321	C	S	.	.			trans	-157.2	174.2	180	0	0	0	0	0	111.4	P337 H377	P337-G375 CarbonylContact O-C 3.58Å; P337-G375 VanDerWaalsContact O-CA 3.3Å; P337-G375 WeakPolarHBondContact O-CA 3.21Å; G375-H377 PolarHBondContact O-CD2 3.43Å
376	V	87	Confident	63.3	Low	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	143	170.8	-59.1	0	0	0	0	110.5	W167 V189 L207 P337 V338 K339 V395	W167-V376 HydrophobicContact CE3-CB 4.36Å; W167-V376 HydrophobicContact CE3-CG2 3.9Å; W167-V376 HydrophobicContact CZ3-CG2 4.47Å; V189-V376 HydrophobicContact CG1-CG1 4.07Å; L207-V376 HydrophobicContact CB-CG2 3.76Å; L207-V376 HydrophobicContact CD2-CB 4.34Å; L207-V376 HydrophobicContact CD2-CG1 4.46Å; L207-V376 HydrophobicContact CD2-CG2 3.73Å; L207-V376 HydrophobicContact CG-CG2 4.36Å; P337-V376 PolarHBondContact O-N 2.85Å; V338-V376 HydrophobicContact CB-CG2 4.31Å; V338-V376 HydrophobicContact CG2-CG2 3.87Å; K339-V376 PolarHBondContact N-O 3.5Å; V376-V395 HydrophobicContact CG1-CB 4.48Å; V376-V395 HydrophobicContact CG1-CG1 4.18Å; V376-V395 HydrophobicContact CG1-CG2 4.12Å
377	H	84.8	Confident	65.9	Low	3 Å²	3	55.4 Å²	55.4	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	153.2	179.4	-64.7	-101.8	0	0	0	110.6	W167 F168 K339 G375 S381 L382 Y386	W167-H377 WeakPolarHBondContact CA-O 3.46Å; W167-H377 VanDerWaalsContact CE3-C 3.45Å; F168-H377 PolarHBondContact N-O 3.44Å; F168-H377 PolarHBondContact O-N 2.88Å; K339-H377 VanDerWaalsContact CG-CE1 3.42Å; K339-H377 WeakPolarHBondContact CG-CE1 3.5Å; G375-H377 PolarHBondContact O-CD2 3.43Å; H377-S381 PolarHBondContact ND1-OG 2.89Å; H377-L382 HydrophobicContact CB-CD2 3.69Å; H377-L382 HydrophobicContact CB-CG 3.7Å; H377-Y386 AromaticContact CE1-CE2 3.43Å; H377-Y386 VanDerWaalsContact CE1-CE2 3.43Å; H377-Y386 WeakPolarHBondContact CE1-CE2 3.26Å; H377-Y386 AromaticContact CE1-CZ 3.84Å; H377-Y386 PolarHBondContact CE1-OH 2.97Å; H377-Y386 AromaticContact NE2-CE2 3.81Å; H377-Y386 PolarHBondContact NE2-OH 3.34Å
378	S	80.1	Confident	68.5	Low	2 Å²	2	50.8 Å²	50.8	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	166.6	157.8	64.9	0	0	0	0	110.8	L380 S381 L382 I561	S378-L380 VanDerWaalsContact C-N 3.26Å; S378-L380 PolarHBondContact O-N 3.16Å; S378-S381 PolarHBondContact O-N 2.91Å; S378-S381 VanDerWaalsContact O-N 3.09Å; S378-S381 PolarHBondContact OG-N 3.42Å; S378-L382 PolarHBondContact O-N 3.02Å; S378-I561 VanDerWaalsContact CB-CD1 3.42Å; S378-I561 VanDerWaalsContact CB-CG1 3.46Å
379	I	81.5	Confident	71.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-40.8	175.7	-165.8	60.8	0	0	0	112.2	V103 L160 S162 C164 F168 L382 L383 I429	V103-I379 HydrophobicContact CG1-CD1 4.25Å; V103-I379 HydrophobicContact CG2-CG1 4.22Å; L160-I379 HydrophobicContact CD1-CD1 4.05Å; S162-I379 WeakPolarHBondContact O-CG2 3.24Å; C164-I379 HydrophobicContact CB-CG2 4.11Å; F168-I379 HydrophobicContact CE2-CB 4.07Å; F168-I379 HydrophobicContact CE2-CD1 4.31Å; I379-L382 HydrophobicContact CD1-CD1 4.46Å; I379-L382 PolarHBondContact O-N 3.38Å; I379-L383 HydrophobicContact CG1-CD1 4.1Å; I379-L383 VanDerWaalsContact O-CG 3.23Å; I379-L383 WeakPolarHBondContact O-CG 3.37Å; I379-L383 PolarHBondContact O-N 3.49Å; I379-L383 VanDerWaalsContact O-N 3.13Å; I379-I429 HydrophobicContact CD1-CD1 3.84Å
380	L	77.5	Confident	74.1	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-40.2	176.7	-173.9	64.5	0	0	0	112	S378 L383 S384 Y532 I561	S378-L380 VanDerWaalsContact C-N 3.26Å; S378-L380 PolarHBondContact O-N 3.16Å; L380-L383 PolarHBondContact O-N 3.26Å; L380-S384 WeakPolarHBondContact O-CB 3.15Å; L380-S384 PolarHBondContact O-N 3.25Å; L380-S384 PolarHBondContact O-OG 3.21Å; L380-Y532 HydrophobicContact CD2-CD2 4.45Å; L380-Y532 HydrophobicContact CG-CD2 4.48Å; L380-I561 HydrophobicContact CD2-CG2 4.15Å
381	S	77.5	Confident	76.7	Confident	15 Å²	15	34.5 Å²	34.5	11%	0.105	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-38.7	177	174.7	0	0	0	0	112.5	H377 S378 S384 T385	H377-S381 PolarHBondContact ND1-OG 2.89Å; S378-S381 PolarHBondContact O-N 2.91Å; S378-S381 VanDerWaalsContact O-N 3.09Å; S378-S381 PolarHBondContact OG-N 3.42Å; S381-S384 PolarHBondContact O-OG 2.92Å; S381-T385 WeakPolarHBondContact O-CB 3.49Å; S381-T385 PolarHBondContact O-N 3.43Å; S381-T385 VanDerWaalsContact O-N 3.16Å; S381-T385 PolarHBondContact O-OG1 3.26Å
382	L	82.6	Confident	79	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-52.6	173.8	-71.7	174.2	0	0	0	111	F168 L170 H377 S378 I379 S384 T385 Y386 L390 T392 I429	F168-L382 HydrophobicContact CB-CD1 3.7Å; F168-L382 HydrophobicContact CD2-CD1 4.21Å; F168-L382 HydrophobicContact CG-CD1 3.98Å; L170-L382 HydrophobicContact CB-CD2 4.43Å; L170-L382 HydrophobicContact CD1-CD2 4.4Å; H377-L382 HydrophobicContact CB-CD2 3.69Å; H377-L382 HydrophobicContact CB-CG 3.7Å; S378-L382 PolarHBondContact O-N 3.02Å; I379-L382 HydrophobicContact CD1-CD1 4.46Å; I379-L382 PolarHBondContact O-N 3.38Å; L382-S384 VanDerWaalsContact C-N 3.32Å; L382-S384 PolarHBondContact O-N 3.32Å; L382-T385 PolarHBondContact O-N 2.95Å; L382-Y386 HydrophobicContact CD2-CD2 4.26Å; L382-Y386 HydrophobicContact CD2-CE2 4.31Å; L382-Y386 PolarHBondContact O-N 3.39Å; L382-L390 HydrophobicContact CB-CD1 4.28Å; L382-T392 HydrophobicContact CD1-CG2 3.81Å; L382-T392 HydrophobicContact CD2-CG2 4.46Å; L382-I429 HydrophobicContact CD1-CD1 3.97Å
383	L	81.9	Confident	80.9	Confident	4 Å²	4	27 Å²	27	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-66.8	-30.3	-174.4	-66.4	170.4	0	0	0	113.2	T101 V103 I379 L380 L388 C432 G529	T101-L383 HydrophobicContact CG2-CD1 4.33Å; V103-L383 HydrophobicContact CG1-CD2 4.42Å; V103-L383 HydrophobicContact CG2-CD1 3.65Å; I379-L383 HydrophobicContact CG1-CD1 4.1Å; I379-L383 VanDerWaalsContact O-CG 3.23Å; I379-L383 WeakPolarHBondContact O-CG 3.37Å; I379-L383 PolarHBondContact O-N 3.49Å; I379-L383 VanDerWaalsContact O-N 3.13Å; L380-L383 PolarHBondContact O-N 3.26Å; L383-L388 HydrophobicContact CD2-CD1 4.27Å; L383-L388 HydrophobicContact CD2-CD2 4.1Å; L383-C432 HydrophobicContact CD2-CB 4.34Å; L383-G529 WeakPolarHBondContact O-CA 3.22Å; L383-G529 PolarHBondContact O-N 3.42Å
384	S	75.7	Confident	82.4	Confident	52 Å²	52	24.7 Å²	24.7	36%	0.364	13%	0.129	S	C	.	.	H	α-helix	trans	-83	-20.7	175.7	69.5	0	0	0	0	113.9	L380 S381 L382	L380-S384 WeakPolarHBondContact O-CB 3.15Å; L380-S384 PolarHBondContact O-N 3.25Å; L380-S384 PolarHBondContact O-OG 3.21Å; S381-S384 PolarHBondContact O-OG 2.92Å; L382-S384 VanDerWaalsContact C-N 3.32Å; L382-S384 PolarHBondContact O-N 3.32Å
385	T	75.9	Confident	82.7	Confident	51 Å²	51	23.1 Å²	23.1	31%	0.313	12%	0.121	S	C	.	.	H	α-helix	trans	-101.6	-31.5	-173.4	-49.4	0	0	0	0	112.9	S381 L382	S381-T385 WeakPolarHBondContact O-CB 3.49Å; S381-T385 PolarHBondContact O-N 3.43Å; S381-T385 VanDerWaalsContact O-N 3.16Å; S381-T385 PolarHBondContact O-OG1 3.26Å; L382-T385 PolarHBondContact O-N 2.95Å
386	Y	80.5	Confident	82.1	Confident	35 Å²	35	23.9 Å²	23.9	14%	0.137	13%	0.126	C	C	.	.	S	Bend	trans	-130.9	154.4	-172.5	-49	-78.3	0	0	0	112.7	L170 H377 L382 L390	L170-Y386 HydrophobicContact CD2-CD1 4.23Å; L170-Y386 HydrophobicContact CD2-CD2 3.94Å; L170-Y386 HydrophobicContact CD2-CE1 3.81Å; L170-Y386 HydrophobicContact CD2-CE2 3.5Å; L170-Y386 HydrophobicContact CD2-CG 4.29Å; L170-Y386 VanDerWaalsContact CD2-CZ 3.43Å; H377-Y386 AromaticContact CE1-CE2 3.43Å; H377-Y386 VanDerWaalsContact CE1-CE2 3.43Å; H377-Y386 WeakPolarHBondContact CE1-CE2 3.26Å; H377-Y386 AromaticContact CE1-CZ 3.84Å; H377-Y386 PolarHBondContact CE1-OH 2.97Å; H377-Y386 AromaticContact NE2-CE2 3.81Å; H377-Y386 PolarHBondContact NE2-OH 3.34Å; L382-Y386 HydrophobicContact CD2-CD2 4.26Å; L382-Y386 HydrophobicContact CD2-CE2 4.31Å; L382-Y386 PolarHBondContact O-N 3.39Å; Y386-L390 HydrophobicContact CG-CD2 4.45Å
387	R	81.3	Confident	80.9	Confident	126 Å²	126	25.8 Å²	25.8	48%	0.475	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-84.2	143.6	169.9	-71.6	-167.9	177.5	163.6	-0.7	111.9	I176 L390 N527 T528	I176-R387 HydrophobicContact CD1-CB 3.99Å; I176-R387 HydrophobicContact CD1-CG 3.68Å; R387-L390 VanDerWaalsContact O-CD2 3.24Å; R387-L390 WeakPolarHBondContact O-CD2 3.35Å; R387-N527 VanDerWaalsContact CA-O 3.24Å; R387-N527 WeakPolarHBondContact CA-O 3.47Å; R387-N527 WeakPolarHBondContact CB-O 3.42Å; R387-T528 HydrophobicContact CG-CG2 3.68Å
388	L	84.5	Confident	79.9	Confident	5 Å²	5	26.6 Å²	26.6	3%	0.026	15%	0.15	C	C	.	.	S	Bend	trans	-71.3	155.5	171.3	-56.8	-174	0	0	0	110.8	L383 L390 I429 S431 C432 N527	L383-L388 HydrophobicContact CD2-CD1 4.27Å; L383-L388 HydrophobicContact CD2-CD2 4.1Å; L388-L390 HydrophobicContact CD2-CD1 3.85Å; L388-L390 HydrophobicContact CD2-CG 3.87Å; L388-I429 HydrophobicContact CD1-CG2 4.21Å; L388-I429 HydrophobicContact CD2-CB 4.28Å; L388-I429 HydrophobicContact CD2-CG2 3.68Å; L388-S431 VanDerWaalsContact CD1-C 3.45Å; L388-C432 HydrophobicContact CD1-CB 4.41Å; L388-N527 PolarHBondContact N-O 2.82Å
389	P	86.7	Confident	78.8	Confident	65 Å²	65	31.6 Å²	31.6	42%	0.422	17%	0.173	S	C	.	.	P	Polyproline II helix	cis	-77.6	154.9	-5.9	33.2	-35.8	0	0	0	113.4	I429 F430	P389-I429 CarbonylContact C-O 3.6Å; P389-I429 WeakPolarHBondContact CA-O 3.39Å; P389-I429 WeakPolarHBondContact CB-O 3.37Å; P389-F430 HydrophobicContact CB-CB 4.21Å
390	L	88.8	Confident	77.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	147.2	177.7	-57.6	174.5	0	0	0	109.9	L170 R173 L382 Y386 R387 L388 T392 Q428 I429	L170-L390 HydrophobicContact CD1-CB 4.28Å; L170-L390 HydrophobicContact CD1-CD2 4.18Å; R173-L390 HydrophobicContact CB-CD2 3.95Å; L382-L390 HydrophobicContact CB-CD1 4.28Å; Y386-L390 HydrophobicContact CG-CD2 4.45Å; R387-L390 VanDerWaalsContact O-CD2 3.24Å; R387-L390 WeakPolarHBondContact O-CD2 3.35Å; L388-L390 HydrophobicContact CD2-CD1 3.85Å; L388-L390 HydrophobicContact CD2-CG 3.87Å; L390-T392 HydrophobicContact CB-CG2 4.36Å; L390-Q428 CarbonylContact O-C 3.58Å; L390-Q428 VanDerWaalsContact O-CA 3.31Å; L390-Q428 WeakPolarHBondContact O-CA 3.3Å; L390-I429 PolarHBondContact N-O 3.43Å; L390-I429 PolarHBondContact O-N 3.29Å
391	I	89.6	Confident	76.1	Confident	29 Å²	29	35.9 Å²	35.9	15%	0.149	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.1	165.3	-52.9	178.4	0	0	0	108.2	L108 V171 R172 L426 Q428	L108-I391 HydrophobicContact CD1-CD1 4.21Å; L108-I391 HydrophobicContact CD1-CG2 4.23Å; V171-I391 PolarHBondContact N-O 3.49Å; R172-I391 HydrophobicContact CB-CB 3.87Å; R172-I391 HydrophobicContact CB-CD1 4.13Å; R172-I391 HydrophobicContact CB-CG1 4.11Å; R172-I391 PolarHBondContact N-O 3.29Å; R172-I391 PolarHBondContact O-N 3.35Å; I391-L426 HydrophobicContact CG2-CB 4.02Å; I391-L426 HydrophobicContact CG2-CD1 4.08Å; I391-L426 HydrophobicContact CG2-CG 4.48Å; I391-Q428 HydrophobicContact CG1-CB 4.49Å; I391-Q428 HydrophobicContact CG1-CG 4.43Å
392	T	89.7	Confident	74.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	158	-174.7	63.4	0	0	0	0	111	E169 L170 L382 L390 L426 L427 I429	E169-T392 CarbonylContact O-C 3.58Å; E169-T392 VanDerWaalsContact O-CA 3.22Å; E169-T392 WeakPolarHBondContact O-CA 3.29Å; L170-T392 HydrophobicContact CD1-CG2 4.31Å; L382-T392 HydrophobicContact CD1-CG2 3.81Å; L382-T392 HydrophobicContact CD2-CG2 4.46Å; L390-T392 HydrophobicContact CB-CG2 4.36Å; T392-L426 WeakPolarHBondContact O-CA 3.26Å; T392-L427 PolarHBondContact N-O 2.66Å; T392-L427 PolarHBondContact O-N 3.49Å; T392-L427 PolarHBondContact OG1-O 3.16Å; T392-I429 HydrophobicContact CG2-CD1 4.01Å
393	R	86.7	Confident	72.9	Confident	43 Å²	43	43.2 Å²	43.2	16%	0.162	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.8	170.3	-172.2	-164.8	-67.7	159.4	-16.3	108.1	F168 E169 V171 E188 H424 L426	F168-R393 WeakPolarHBondContact CA-O 3.46Å; E169-R393 HydrophobicContact CB-CB 4.26Å; E169-R393 VanDerWaalsContact CD-NH1 3.27Å; E169-R393 HydrophobicContact CG-CB 4.39Å; E169-R393 PolarHBondContact N-O 3.28Å; E169-R393 PolarHBondContact O-N 3.01Å; E169-R393 IonicContact OE1-NH1 2.65Å; E169-R393 PolarHBondContact OE1-NH1 3.3Å; E169-R393 IonicContact OE2-CZ 3.87Å; E169-R393 IonicContact OE2-NE 3.21Å; E169-R393 IonicContact OE2-NH1 4Å; E169-R393 PolarHBondContact OE2-NH1 3.01Å; V171-R393 HydrophobicContact CG2-CB 3.87Å; E188-R393 IonicContact OE1-CZ 3.73Å; E188-R393 IonicContact OE1-NH1 3.67Å; E188-R393 PolarHBondContact OE1-NH1 2.95Å; E188-R393 IonicContact OE1-NH2 2.75Å; E188-R393 PolarHBondContact OE1-NH2 3.46Å; R393-H424 HydrophobicContact CG-CB 4.07Å; R393-L426 HydrophobicContact CB-CD2 3.89Å; R393-L426 HydrophobicContact CG-CD2 4.22Å
394	P	84.1	Confident	70.9	Confident	21 Å²	21	46.1 Å²	46.1	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	136.3	170.5	-20.5	32.9	0	0	0	111.1	W107 F168 L398 S425	W107-P394 HydrophobicContact CH2-CG 3.8Å; W107-P394 HydrophobicContact CZ3-CG 3.84Å; F168-P394 HydrophobicContact CE1-CG 4.42Å; P394-L398 HydrophobicContact CB-CB 4.06Å; P394-L398 HydrophobicContact CG-CB 4.42Å; P394-S425 WeakPolarHBondContact CD-O 3.24Å
395	V	77.4	Confident	68.9	Low	25 Å²	25	50.1 Å²	50.1	15%	0.152	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	-38.4	-174.6	176.4	0	0	0	0	111.9	W167 E169 L207 R209 V376	W167-V395 HydrophobicContact CB-CB 4.45Å; W167-V395 PolarHBondContact O-N 3.11Å; E169-V395 HydrophobicContact CB-CG2 3.54Å; L207-V395 HydrophobicContact CD2-CG1 4.23Å; R209-V395 HydrophobicContact CG-CG1 3.81Å; V376-V395 HydrophobicContact CG1-CB 4.48Å; V376-V395 HydrophobicContact CG1-CG1 4.18Å; V376-V395 HydrophobicContact CG1-CG2 4.12Å
396	V	71	Confident	66.8	Low	18 Å²	18	54.2 Å²	54.2	11%	0.109	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	142	171.5	-176.1	0	0	0	0	108.4	S166 W167 L207 P251	S166-V396 VanDerWaalsContact CA-O 3.27Å; S166-V396 WeakPolarHBondContact CA-O 3.45Å; S166-V396 WeakPolarHBondContact CB-O 3.49Å; W167-V396 PolarHBondContact N-O 2.89Å; L207-V396 HydrophobicContact CD2-CG2 4.11Å; P251-V396 HydrophobicContact CB-CG1 3.79Å; P251-V396 HydrophobicContact CB-CG2 4.39Å
397	G	61.9	Low	64.4	Low	41 Å²	41	54.1 Å²	54.1	42%	0.423	29%	0.29	S	S	.	.	S	Bend	trans	98.9	-8.4	165.8	0	0	0	0	0	116.4	S166	S166-G397 VanDerWaalsContact OG-C 3.29Å; S166-G397 PolarHBondContact OG-O 3.48Å
398	L	62.3	Low	62.2	Low	19 Å²	19	55.5 Å²	55.5	10%	0.099	30%	0.3	C	S	.	.			trans	-135.5	117.8	172	-74.5	162.7	0	0	0	109.6	W107 L160 S166 F168 P394 C506	W107-L398 HydrophobicContact CH2-CB 4.36Å; L160-L398 HydrophobicContact CD2-CD1 4Å; S166-L398 WeakPolarHBondContact OG-CG 3.49Å; F168-L398 HydrophobicContact CE1-CD1 3.95Å; F168-L398 HydrophobicContact CZ-CD1 3.75Å; P394-L398 HydrophobicContact CB-CB 4.06Å; P394-L398 HydrophobicContact CG-CB 4.42Å; L398-C506 HydrophobicContact CD2-CB 3.68Å
399	H	57.9	Low	59.8	Low	107 Å²	107	65.2 Å²	65.2	50%	0.495	34%	0.337	S	S	.	.			trans	-110	123.3	168.9	-61.2	-67.2	0	0	0	109.8	S401 E402	H399-S401 PolarHBondContact O-N 2.79Å; H399-E402 HydrophobicContact CB-CG 3.99Å; H399-E402 IonicContact CD2-OE1 3.42Å; H399-E402 WeakPolarHBondContact O-CB 3.21Å; H399-E402 PolarHBondContact O-N 3.01Å; H399-E402 VanDerWaalsContact O-N 3.11Å
400	S	52.7	Low	57.1	Low	22 Å²	22	66.3 Å²	66.3	15%	0.154	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-26.8	179.5	55.8	0	0	0	0	112.8	E402 W403 F404 S425	S400-E402 PolarHBondContact O-N 2.92Å; S400-W403 WeakPolarHBondContact O-CB 3.41Å; S400-W403 PolarHBondContact O-N 3.23Å; S400-F404 VanDerWaalsContact CB-CE2 3.45Å; S400-F404 WeakPolarHBondContact O-CD2 3.25Å; S400-F404 WeakPolarHBondContact O-CG 3.39Å; S400-F404 PolarHBondContact O-N 2.63Å; S400-S425 WeakPolarHBondContact CB-OG 3.24Å; S400-S425 WeakPolarHBondContact OG-CB 3.48Å; S400-S425 PolarHBondContact OG-OG 3.01Å
401	S	48.8	Very low	54.3	Low	75 Å²	75	73.6 Å²	73.6	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-60.1	-27.6	171.9	51.7	0	0	0	0	114.1	H399 W403	H399-S401 PolarHBondContact O-N 2.79Å; S401-W403 PolarHBondContact O-N 2.79Å
402	E	48.4	Very low	51.5	Low	120 Å²	120	77.4 Å²	77.4	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-70.6	-23.6	174.8	-63.1	166.8	160.3	0	0	111.4	H399 S400	H399-E402 HydrophobicContact CB-CG 3.99Å; H399-E402 IonicContact CD2-OE1 3.42Å; H399-E402 WeakPolarHBondContact O-CB 3.21Å; H399-E402 PolarHBondContact O-N 3.01Å; H399-E402 VanDerWaalsContact O-N 3.11Å; S400-E402 PolarHBondContact O-N 2.92Å
403	W	44.5	Very low	48.7	Very low	49 Å²	49	83 Å²	83	19%	0.186	44%	0.438	C	S	.	.	H	α-helix	trans	-91	-40.6	177.6	-73.9	79.5	0	0	0	113.2	V158 S400 S401 L405 M406 C506 P508	V158-W403 HydrophobicContact CG1-CE3 4.4Å; V158-W403 HydrophobicContact CG1-CZ3 4.34Å; S400-W403 WeakPolarHBondContact O-CB 3.41Å; S400-W403 PolarHBondContact O-N 3.23Å; S401-W403 PolarHBondContact O-N 2.79Å; W403-L405 PolarHBondContact O-N 3.17Å; W403-L405 VanDerWaalsContact O-N 3.11Å; W403-M406 WeakPolarHBondContact O-CB 3.44Å; W403-M406 PolarHBondContact O-N 3.05Å; W403-M406 VanDerWaalsContact O-N 3.09Å; W403-C506 WeakPolarHBondContact CH2-O 3.41Å; W403-C506 HydrophobicContact CZ2-CB 3.75Å; W403-C506 VanDerWaalsContact CZ2-O 3.28Å; W403-C506 WeakPolarHBondContact CZ2-O 3.28Å; W403-P508 HydrophobicContact CZ3-CB 4.2Å
404	F	41	Very low	46.1	Very low	64 Å²	64	85.2 Å²	85.2	28%	0.281	46%	0.46	S	S	.	.	H	α-helix	trans	-66	-14.4	-177.4	-59.3	-44	0	0	0	113.9	L109 S400 M406 G407	L109-F404 HydrophobicContact CD1-CE1 4.01Å; L109-F404 HydrophobicContact CD1-CZ 4.35Å; L109-F404 HydrophobicContact CD2-CE1 3.87Å; L109-F404 HydrophobicContact CD2-CE2 3.95Å; L109-F404 HydrophobicContact CD2-CZ 3.41Å; L109-F404 VanDerWaalsContact CD2-CZ 3.41Å; L109-F404 HydrophobicContact CG-CE1 4.01Å; L109-F404 HydrophobicContact CG-CZ 3.85Å; S400-F404 VanDerWaalsContact CB-CE2 3.45Å; S400-F404 WeakPolarHBondContact O-CD2 3.25Å; S400-F404 WeakPolarHBondContact O-CG 3.39Å; S400-F404 PolarHBondContact O-N 2.63Å; F404-M406 PolarHBondContact O-N 3.15Å; F404-M406 VanDerWaalsContact O-N 3.13Å; F404-G407 PolarHBondContact O-N 2.84Å
405	L	34.3	Very low	43.5	Very low	136 Å²	136	90.7 Å²	90.7	71%	0.712	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.9	169	-98.1	160.1	0	0	0	114.4	W403 G407	W403-L405 PolarHBondContact O-N 3.17Å; W403-L405 VanDerWaalsContact O-N 3.11Å; L405-G407 PolarHBondContact O-N 3.29Å
406	M	30.3	Very low	41.2	Very low	137 Å²	137	94.6 Å²	94.6	68%	0.675	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.2	170.6	-147.3	78.8	71.8	0	0	112.8	W403 F404	W403-M406 WeakPolarHBondContact O-CB 3.44Å; W403-M406 PolarHBondContact O-N 3.05Å; W403-M406 VanDerWaalsContact O-N 3.09Å; F404-M406 PolarHBondContact O-N 3.15Å; F404-M406 VanDerWaalsContact O-N 3.13Å
407	G	30.2	Very low	39.1	Very low	34 Å²	34	99.2 Å²	99.2	35%	0.351	54%	0.54	S	S	.	.			trans	-104.2	60.3	-170.5	0	0	0	0	0	115.6	F404 L405 Y409 T410	F404-G407 PolarHBondContact O-N 2.84Å; L405-G407 PolarHBondContact O-N 3.29Å; G407-Y409 PolarHBondContact O-N 2.96Å; G407-T410 PolarHBondContact O-N 2.88Å; G407-T410 PolarHBondContact O-OG1 3.28Å
408	K	34.6	Very low	37.7	Very low	155 Å²	155	102.8 Å²	102.8	67%	0.674	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	6.7	173.6	-87.4	-174.9	178.4	173.7	0	115.7
409	Y	35.2	Very low	36.1	Very low	208 Å²	208	108.5 Å²	108.5	82%	0.816	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	0.1	-176.5	-65.2	-76.3	0	0	0	115.1	G407	G407-Y409 PolarHBondContact O-N 2.96Å
410	T	30.7	Very low	34.8	Very low	88 Å²	88	106.8 Å²	106.8	54%	0.54	59%	0.589	S	S	.	*	S	Bend	trans	-91	112.6	167.3	51.4	0	0	0	0	110.2	G407 H412	G407-T410 PolarHBondContact O-N 2.88Å; G407-T410 PolarHBondContact O-OG1 3.28Å; T410-H412 PolarHBondContact O-N 3.4Å
411	N	28.2	Very low	33.9	Very low	154 Å²	154	112.1 Å²	112.1	82%	0.824	61%	0.614	S	S	*	*			trans	-69.6	76.4	178.5	-75.9	-32.1	0	0	0	111.7
412	H	31.6	Very low	33.3	Very low	109 Å²	109	114.6 Å²	114.6	51%	0.505	62%	0.621	S	S	.	*			trans	-111.2	41.6	-179.4	-68.4	-31.3	0	0	0	112.6	T410 S414 I415	T410-H412 PolarHBondContact O-N 3.4Å; H412-S414 PolarHBondContact O-N 3.45Å; H412-I415 HydrophobicContact CB-CD1 4.08Å; H412-I415 HydrophobicContact CB-CG1 4.27Å; H412-I415 PolarHBondContact O-N 2.93Å
413	S	31	Very low	33	Very low	118 Å²	118	114.6 Å²	114.6	83%	0.825	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	6.6	167.3	49.9	0	0	0	0	114.1
414	S	31.3	Very low	33.6	Very low	89 Å²	89	116.1 Å²	116.1	62%	0.622	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-2.9	177.8	52	0	0	0	0	114.5	H412 S416	H412-S414 PolarHBondContact O-N 3.45Å; S414-S416 PolarHBondContact O-N 3.48Å; S414-S416 VanDerWaalsContact O-N 3.15Å
415	I	31.2	Very low	34.8	Very low	136 Å²	136	113.9 Å²	113.9	70%	0.697	62%	0.624	S	S	*	*			trans	-90.2	58.4	174.7	-46	-179.1	0	0	0	110	H412	H412-I415 HydrophobicContact CB-CD1 4.08Å; H412-I415 HydrophobicContact CB-CG1 4.27Å; H412-I415 PolarHBondContact O-N 2.93Å
416	S	27.7	Very low	37.2	Very low	108 Å²	108	109.7 Å²	109.7	76%	0.755	60%	0.602	S	S	*	*			trans	-130.3	45.4	172.8	70.2	0	0	0	0	110.8	S414	S414-S416 PolarHBondContact O-N 3.48Å; S414-S416 VanDerWaalsContact O-N 3.15Å
417	N	26.9	Very low	40	Very low	115 Å²	115	103.2 Å²	103.2	62%	0.615	57%	0.57	S	S	*	*			trans	-136.3	97.2	179.2	-141.5	4.1	0	0	0	108.3	D419 S420	N417-D419 PolarHBondContact O-N 3.38Å; N417-D419 VanDerWaalsContact O-N 3.08Å; N417-S420 PolarHBondContact O-N 2.99Å; N417-S420 PolarHBondContact O-OG 3.45Å
418	S	32.3	Very low	42.9	Very low	115 Å²	115	104.6 Å²	104.6	80%	0.804	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-23.4	-169.4	45	0	0	0	0	114.5
419	D	30.5	Very low	45.6	Very low	140 Å²	140	97.2 Å²	97.2	75%	0.749	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.4	-166.1	-57.8	8	0	0	0	111.9	N417 I421	N417-D419 PolarHBondContact O-N 3.38Å; N417-D419 VanDerWaalsContact O-N 3.08Å; D419-I421 VanDerWaalsContact C-N 3.26Å; D419-I421 PolarHBondContact O-N 3.2Å
420	S	29.6	Very low	48	Very low	71 Å²	71	90.2 Å²	90.2	50%	0.497	51%	0.51	S	S	.	.	S	Bend	trans	-78.9	66	-179.4	59.3	0	0	0	0	113.6	N417 N422	N417-S420 PolarHBondContact O-N 2.99Å; N417-S420 PolarHBondContact O-OG 3.45Å; S420-N422 PolarHBondContact O-N 3.46Å
421	I	34.7	Very low	50.6	Low	134 Å²	134	86.6 Å²	86.6	69%	0.687	49%	0.488	S	S	*	.			trans	53	56	159.4	-38.8	178.6	0	0	0	115	D419 M423	D419-I421 VanDerWaalsContact C-N 3.26Å; D419-I421 PolarHBondContact O-N 3.2Å; I421-M423 VanDerWaalsContact C-N 3.32Å; I421-M423 HydrophobicContact CB-CE 4.29Å; I421-M423 HydrophobicContact CG2-CE 4.23Å; I421-M423 WeakPolarHBondContact O-CG 3.46Å; I421-M423 PolarHBondContact O-N 3.14Å
422	N	36.4	Very low	53.4	Low	126 Å²	126	79.2 Å²	79.2	67%	0.674	45%	0.448	S	S	*	.			trans	34.8	53.4	148.3	-149	13.4	0	0	0	116.4	S420 H424	S420-N422 PolarHBondContact O-N 3.46Å; N422-H424 VanDerWaalsContact C-N 3.28Å; N422-H424 PolarHBondContact ND2-NE2 3.05Å; N422-H424 VanDerWaalsContact ND2-NE2 3.13Å; N422-H424 PolarHBondContact O-CD2 2.79Å; N422-H424 PolarHBondContact O-N 2.78Å; N422-H424 PolarHBondContact OD1-CE1 3.35Å; N422-H424 VanDerWaalsContact OD1-CE1 3.24Å; N422-H424 PolarHBondContact OD1-NE2 3.24Å; N422-H424 VanDerWaalsContact OD1-NE2 3.11Å
423	M	41.8	Very low	56	Low	120 Å²	120	74.1 Å²	74.1	59%	0.591	42%	0.424	S	S	*	.			trans	-77.7	69.9	-169.4	-80.8	-59.6	160	0	0	112.8	P110 I421 S425	P110-M423 HydrophobicContact CB-CG 4.43Å; P110-M423 HydrophobicContact CB-SD 3.59Å; P110-M423 VanDerWaalsContact CB-SD 3.59Å; P110-M423 HydrophobicContact CG-CB 3.76Å; P110-M423 HydrophobicContact CG-CG 4.03Å; P110-M423 HydrophobicContact CG-SD 3.76Å; I421-M423 VanDerWaalsContact C-N 3.32Å; I421-M423 HydrophobicContact CB-CE 4.29Å; I421-M423 HydrophobicContact CG2-CE 4.23Å; I421-M423 WeakPolarHBondContact O-CG 3.46Å; I421-M423 PolarHBondContact O-N 3.14Å; M423-S425 PolarHBondContact O-N 2.89Å
424	H	56	Low	58.5	Low	82 Å²	82	70.3 Å²	70.3	38%	0.38	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-55.3	118.2	176.4	-63.8	-66.1	0	0	0	111.1	R393 N422 L426	R393-H424 HydrophobicContact CG-CB 4.07Å; N422-H424 VanDerWaalsContact C-N 3.28Å; N422-H424 PolarHBondContact ND2-NE2 3.05Å; N422-H424 VanDerWaalsContact ND2-NE2 3.13Å; N422-H424 PolarHBondContact O-CD2 2.79Å; N422-H424 PolarHBondContact O-N 2.78Å; N422-H424 PolarHBondContact OD1-CE1 3.35Å; N422-H424 VanDerWaalsContact OD1-CE1 3.24Å; N422-H424 PolarHBondContact OD1-NE2 3.24Å; N422-H424 VanDerWaalsContact OD1-NE2 3.11Å; H424-L426 PolarHBondContact O-N 3.09Å
425	S	67.2	Low	60.8	Low	17 Å²	17	67 Å²	67	12%	0.119	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-65.5	119.5	177	-51.7	0	0	0	0	110.1	P394 S400 M423	P394-S425 WeakPolarHBondContact CD-O 3.24Å; S400-S425 WeakPolarHBondContact CB-OG 3.24Å; S400-S425 WeakPolarHBondContact OG-CB 3.48Å; S400-S425 PolarHBondContact OG-OG 3.01Å; M423-S425 PolarHBondContact O-N 2.89Å
426	L	84.7	Confident	63.4	Low	47 Å²	47	62.6 Å²	62.6	25%	0.246	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	148	179	-63.1	177.2	0	0	0	110	L108 V171 I391 T392 R393 H424	L108-L426 HydrophobicContact CB-CB 4.14Å; L108-L426 PolarHBondContact N-O 2.81Å; V171-L426 HydrophobicContact CG2-CD2 4.05Å; I391-L426 HydrophobicContact CG2-CB 4.02Å; I391-L426 HydrophobicContact CG2-CD1 4.08Å; I391-L426 HydrophobicContact CG2-CG 4.48Å; T392-L426 WeakPolarHBondContact O-CA 3.26Å; R393-L426 HydrophobicContact CB-CD2 3.89Å; R393-L426 HydrophobicContact CG-CD2 4.22Å; H424-L426 PolarHBondContact O-N 3.09Å
427	L	88.7	Confident	66.3	Low	1 Å²	1	57.6 Å²	57.6	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.6	178.2	-173.8	74.4	0	0	0	109	A105 E106 W107 V158 L160 F168 T392 I429	A105-L427 HydrophobicContact CB-CD1 3.74Å; A105-L427 HydrophobicContact CB-CD2 4.13Å; A105-L427 HydrophobicContact CB-CG 3.83Å; E106-L427 WeakPolarHBondContact O-CA 3.19Å; W107-L427 HydrophobicContact CD2-CD1 3.95Å; W107-L427 HydrophobicContact CE3-CB 4.39Å; W107-L427 HydrophobicContact CE3-CD1 4.14Å; W107-L427 HydrophobicContact CG-CD1 4.34Å; W107-L427 HydrophobicContact CZ3-CB 4.37Å; V158-L427 HydrophobicContact CG2-CD1 3.85Å; L160-L427 HydrophobicContact CD1-CD2 3.89Å; F168-L427 HydrophobicContact CE1-CD2 3.78Å; T392-L427 PolarHBondContact N-O 2.66Å; T392-L427 PolarHBondContact O-N 3.49Å; T392-L427 PolarHBondContact OG1-O 3.16Å; L427-I429 HydrophobicContact CD2-CG1 4.44Å
428	Q	91.1	Very high	69.3	Low	63 Å²	63	52.1 Å²	52.1	29%	0.294	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	111.9	174.3	177.4	171.1	-30.4	0	0	109.4	A105 E106 L108 L390 I391	A105-Q428 CarbonylContact C-O 3.52Å; A105-Q428 WeakPolarHBondContact CA-O 3.22Å; A105-Q428 WeakPolarHBondContact CB-O 3.29Å; E106-Q428 PolarHBondContact N-O 2.75Å; E106-Q428 PolarHBondContact O-N 3.29Å; L108-Q428 HydrophobicContact CD1-CB 3.97Å; L108-Q428 HydrophobicContact CD2-CB 4.48Å; L108-Q428 HydrophobicContact CG-CB 4.03Å; L390-Q428 CarbonylContact O-C 3.58Å; L390-Q428 VanDerWaalsContact O-CA 3.31Å; L390-Q428 WeakPolarHBondContact O-CA 3.3Å; I391-Q428 HydrophobicContact CG1-CB 4.49Å; I391-Q428 HydrophobicContact CG1-CG 4.43Å
429	I	90.3	Very high	72.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.1	175.6	-55.7	169.3	0	0	0	107.8	V103 A105 I379 L382 L388 P389 L390 T392 L427	V103-I429 HydrophobicContact CG1-CG2 3.41Å; V103-I429 VanDerWaalsContact CG1-CG2 3.41Å; A105-I429 HydrophobicContact CB-CB 4.45Å; A105-I429 HydrophobicContact CB-CG1 4.04Å; I379-I429 HydrophobicContact CD1-CD1 3.84Å; L382-I429 HydrophobicContact CD1-CD1 3.97Å; L388-I429 HydrophobicContact CD1-CG2 4.21Å; L388-I429 HydrophobicContact CD2-CB 4.28Å; L388-I429 HydrophobicContact CD2-CG2 3.68Å; P389-I429 CarbonylContact C-O 3.6Å; P389-I429 WeakPolarHBondContact CA-O 3.39Å; P389-I429 WeakPolarHBondContact CB-O 3.37Å; L390-I429 PolarHBondContact N-O 3.43Å; L390-I429 PolarHBondContact O-N 3.29Å; T392-I429 HydrophobicContact CG2-CD1 4.01Å; L427-I429 HydrophobicContact CD2-CG1 4.44Å
430	F	86.9	Confident	75.1	Confident	62 Å²	62	40 Å²	40	27%	0.272	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	-27	-171.9	59.7	-97.9	0	0	0	116.3	Q104 E106 P389	Q104-F430 HydrophobicContact CB-CD2 4.47Å; Q104-F430 HydrophobicContact CB-CE1 4.49Å; Q104-F430 HydrophobicContact CB-CE2 3.85Å; Q104-F430 HydrophobicContact CB-CZ 3.88Å; Q104-F430 VanDerWaalsContact CD-CE2 3.48Å; Q104-F430 VanDerWaalsContact CD-CZ 3.45Å; Q104-F430 HydrophobicContact CG-CE1 4.26Å; Q104-F430 HydrophobicContact CG-CE2 3.8Å; Q104-F430 HydrophobicContact CG-CZ 3.47Å; Q104-F430 VanDerWaalsContact CG-CZ 3.47Å; Q104-F430 PolarHBondContact O-N 2.89Å; Q104-F430 VanDerWaalsContact O-N 3.08Å; E106-F430 HydrophobicContact CB-CE1 4.14Å; P389-F430 HydrophobicContact CB-CB 4.21Å
431	S	85.3	Confident	78	Confident	11 Å²	11	36.6 Å²	36.6	8%	0.077	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155.5	171.4	62.7	0	0	0	0	111.8	Q104 L388 H433	Q104-S431 WeakPolarHBondContact CB-OG 3.23Å; Q104-S431 PolarHBondContact N-O 3.03Å; Q104-S431 PolarHBondContact OE1-OG 2.81Å; L388-S431 VanDerWaalsContact CD1-C 3.45Å; S431-H433 PolarHBondContact OG-NE2 3.48Å; S431-H433 VanDerWaalsContact OG-NE2 3.07Å
432	C	87.1	Confident	80.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.7	160.1	46.3	0	0	0	0	111.3	T101 L102 V103 L383 L388 S526	T101-C432 HydrophobicContact CG2-CB 3.71Å; L102-C432 CarbonylContact O-C 3.59Å; L102-C432 VanDerWaalsContact O-CA 3.27Å; L102-C432 WeakPolarHBondContact O-CA 3.35Å; V103-C432 HydrophobicContact CG2-CB 4.39Å; L383-C432 HydrophobicContact CD2-CB 4.34Å; L388-C432 HydrophobicContact CD1-CB 4.41Å; C432-S526 PolarHBondContact N-O 3.21Å; C432-S526 PolarHBondContact O-N 2.97Å; C432-S526 PolarHBondContact O-OG 3.39Å; C432-S526 VanDerWaalsContact O-OG 3.13Å; C432-S526 PolarHBondContact SG-O 3.16Å; C432-S526 VanDerWaalsContact SG-O 3.34Å; C432-S526 PolarHBondContact SG-OG 2.88Å
433	H	85.4	Confident	82.9	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.8	-175.6	-50.2	-100	0	0	0	107.6	T101 L102 S431 L519 E520	T101-H433 CarbonylContact C-O 3.54Å; T101-H433 WeakPolarHBondContact CA-O 3.46Å; L102-H433 PolarHBondContact N-O 3.06Å; L102-H433 PolarHBondContact O-N 3.06Å; S431-H433 PolarHBondContact OG-NE2 3.48Å; S431-H433 VanDerWaalsContact OG-NE2 3.07Å; H433-L519 HydrophobicContact CB-CB 3.93Å; H433-E520 IonicContact CE1-OE1 3.98Å
434	H	83.6	Confident	84.9	Confident	39 Å²	39	23.9 Å²	23.9	18%	0.181	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	152.6	-172.8	-46.9	-61	0	0	0	111	T101 T523 S526	T101-H434 WeakPolarHBondContact CG2-ND1 3.5Å; T101-H434 PolarHBondContact OG1-ND1 3.15Å; H434-T523 HydrophobicContact CB-CG2 4.45Å; H434-T523 PolarHBondContact N-OG1 3.37Å; H434-T523 WeakPolarHBondContact O-CG2 3.33Å; H434-T523 PolarHBondContact O-OG1 2.92Å; H434-S526 PolarHBondContact NE2-OG 3.08Å
435	G	80.5	Confident	86.2	Confident	18 Å²	18	21.9 Å²	21.9	19%	0.186	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.7	-169.5	171.1	0	0	0	0	0	113.5	G99 I100	G99-G435 CarbonylContact C-O 3.56Å; G99-G435 PolarHBondContact N-O 3.18Å; I100-G435 WeakPolarHBondContact CG2-O 3.42Å; I100-G435 PolarHBondContact N-O 2.89Å; I100-G435 PolarHBondContact O-N 2.73Å; I100-G435 VanDerWaalsContact O-N 3.13Å
436	D	85	Confident	87	Confident	45 Å²	45	21.1 Å²	21.1	24%	0.241	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.3	178.8	-58.3	-26.6	0	0	0	109.5	V53 P98 G99 T469	V53-D436 WeakPolarHBondContact CG1-OD2 3.5Å; P98-D436 WeakPolarHBondContact CA-OD1 3.48Å; P98-D436 HydrophobicContact CB-CB 4.49Å; P98-D436 VanDerWaalsContact CB-OD1 3.27Å; P98-D436 WeakPolarHBondContact CB-OD1 3.28Å; G99-D436 PolarHBondContact N-OD1 2.89Å; D436-T469 HydrophobicContact CB-CG2 4.36Å
437	L	88.7	Confident	86.5	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133	175	-66.3	-176.2	0	0	0	110.8	V97 I100 L102 F439 V466 T468 I515	V97-L437 PolarHBondContact N-O 3.29Å; V97-L437 PolarHBondContact O-N 3.36Å; V97-L437 VanDerWaalsContact O-N 3.1Å; I100-L437 HydrophobicContact CG2-CB 3.93Å; I100-L437 HydrophobicContact CG2-CD1 3.75Å; I100-L437 HydrophobicContact CG2-CG 3.52Å; L102-L437 HydrophobicContact CD2-CD1 4.24Å; L437-F439 HydrophobicContact CB-CE2 3.68Å; L437-F439 HydrophobicContact CB-CZ 4.04Å; L437-F439 HydrophobicContact CD1-CZ 4.31Å; L437-V466 HydrophobicContact CB-CG1 4.43Å; L437-V466 HydrophobicContact CD1-CG1 4.19Å; L437-V466 HydrophobicContact CD2-CG1 4.25Å; L437-T468 HydrophobicContact CD2-CG2 4.09Å; L437-I515 HydrophobicContact CD2-CG2 3.7Å
438	I	90.4	Very high	85.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.2	-179	-61.9	145.5	0	0	0	107.1	I49 M94 I96 L440 V467 T469 L472	I49-I438 HydrophobicContact CD1-CD1 3.71Å; I49-I438 HydrophobicContact CD1-CG1 4.26Å; I49-I438 HydrophobicContact CD1-CG2 4.47Å; I49-I438 HydrophobicContact CG1-CD1 3.55Å; M94-I438 HydrophobicContact CG-CG2 4.3Å; I96-I438 HydrophobicContact CG1-CG1 4.22Å; I96-I438 HydrophobicContact CG1-CG2 4.47Å; I96-I438 HydrophobicContact CG2-CG1 4.2Å; I438-L440 HydrophobicContact CG2-CG 4.31Å; I438-V467 HydrophobicContact CB-CG2 4.06Å; I438-V467 HydrophobicContact CG2-CG2 4.18Å; I438-V467 PolarHBondContact N-O 3.02Å; I438-V467 WeakPolarHBondContact O-CG2 3.32Å; I438-V467 PolarHBondContact O-N 3.07Å; I438-T469 HydrophobicContact CD1-CG2 4.05Å; I438-L472 HydrophobicContact CB-CD1 4.34Å; I438-L472 HydrophobicContact CD1-CD1 4.03Å; I438-L472 HydrophobicContact CG2-CD1 3.85Å
439	F	92.4	Very high	83.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.3	-178.4	-59.2	-100.7	0	0	0	108.4	M94 K95 V97 L437 F464 F465 V466 H495 V499 F502 L503	M94-F439 WeakPolarHBondContact CA-O 3.44Å; K95-F439 HydrophobicContact CB-CB 4.23Å; K95-F439 PolarHBondContact N-O 3.15Å; K95-F439 PolarHBondContact O-N 3.43Å; V97-F439 HydrophobicContact CB-CE2 4.29Å; V97-F439 HydrophobicContact CG2-CD2 4.29Å; V97-F439 HydrophobicContact CG2-CE2 4.06Å; L437-F439 HydrophobicContact CB-CE2 3.68Å; L437-F439 HydrophobicContact CB-CZ 4.04Å; L437-F439 HydrophobicContact CD1-CZ 4.31Å; F439-F464 AromaticContact CD1-CD2 3.85Å; F439-F464 HydrophobicContact CD1-CD2 3.85Å; F439-F464 AromaticContact CD1-CE2 3.79Å; F439-F464 HydrophobicContact CD1-CE2 3.79Å; F439-F464 HydrophobicContact CE1-CE2 4.17Å; F439-F465 WeakPolarHBondContact CA-O 3.45Å; F439-V466 HydrophobicContact CD1-CB 4.43Å; F439-V466 HydrophobicContact CD1-CG1 4.22Å; F439-V466 HydrophobicContact CD1-CG2 3.73Å; F439-V466 HydrophobicContact CE1-CB 4.29Å; F439-V466 HydrophobicContact CE1-CG1 3.77Å; F439-V466 HydrophobicContact CE1-CG2 3.61Å; F439-V466 HydrophobicContact CZ-CG1 4.04Å; F439-H495 PolarHBondContact O-CE1 3.19Å; F439-V499 HydrophobicContact CB-CG1 4.35Å; F439-V499 HydrophobicContact CB-CG2 3.43Å; F439-V499 VanDerWaalsContact CB-CG2 3.43Å; F439-V499 HydrophobicContact CD1-CB 4.36Å; F439-V499 HydrophobicContact CD1-CG1 3.93Å; F439-V499 HydrophobicContact CD1-CG2 3.77Å; F439-V499 HydrophobicContact CD2-CG1 3.51Å; F439-V499 HydrophobicContact CD2-CG2 4.23Å; F439-V499 HydrophobicContact CE1-CG1 4.1Å; F439-V499 HydrophobicContact CE2-CG1 3.69Å; F439-V499 HydrophobicContact CG-CB 4.24Å; F439-V499 HydrophobicContact CG-CG1 3.66Å; F439-V499 HydrophobicContact CG-CG2 3.55Å; F439-V499 HydrophobicContact CZ-CG1 3.99Å; F439-F502 AromaticContact CE1-CD1 3.51Å; F439-F502 HydrophobicContact CE1-CD1 3.51Å; F439-F502 AromaticContact CE1-CE1 3.72Å; F439-F502 HydrophobicContact CE1-CE1 3.72Å; F439-F502 HydrophobicContact CE1-CG 4.21Å; F439-F502 AromaticContact CZ-CD1 3.96Å; F439-F502 HydrophobicContact CZ-CD1 3.96Å; F439-F502 HydrophobicContact CZ-CE1 4.09Å; F439-L503 HydrophobicContact CZ-CD2 3.91Å; F439-L503 HydrophobicContact CZ-CG 4.19Å
440	L	92	Very high	81.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128	-177.4	-67.9	173	0	0	0	110.5	I75 L86 A93 M94 I438 F464 F465 V467 L472	I75-L440 HydrophobicContact CD1-CD1 3.96Å; I75-L440 HydrophobicContact CD1-CD2 4.24Å; L86-L440 HydrophobicContact CD1-CD1 3.86Å; L86-L440 HydrophobicContact CD2-CD1 4Å; A93-L440 WeakPolarHBondContact O-CA 3.33Å; M94-L440 HydrophobicContact CB-CD2 3.73Å; M94-L440 HydrophobicContact CG-CD2 3.67Å; M94-L440 HydrophobicContact SD-CD2 4.43Å; I438-L440 HydrophobicContact CG2-CG 4.31Å; L440-F464 CarbonylContact O-C 3.48Å; L440-F464 VanDerWaalsContact O-CA 3.3Å; L440-F464 WeakPolarHBondContact O-CA 3.48Å; L440-F464 WeakPolarHBondContact O-CB 3.5Å; L440-F465 PolarHBondContact N-O 2.87Å; L440-F465 PolarHBondContact O-N 2.86Å; L440-V467 HydrophobicContact CD1-CG2 4.11Å; L440-L472 HydrophobicContact CD1-CD1 4.3Å; L440-L472 HydrophobicContact CD1-CD2 4.32Å
441	E	90.4	Very high	79.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.1	175.2	-159.9	-176.8	153.8	0	0	111.1	L92 A93 L443 D445 C446 S462 F464 H495 R498	L92-E441 CarbonylContact C-O 3.54Å; L92-E441 WeakPolarHBondContact CA-O 3.43Å; L92-E441 WeakPolarHBondContact CD2-O 3.38Å; A93-E441 PolarHBondContact N-O 3.13Å; A93-E441 PolarHBondContact O-N 3.3Å; E441-L443 PolarHBondContact O-N 2.83Å; E441-D445 HydrophobicContact CG-CB 4.1Å; E441-D445 WeakPolarHBondContact OE1-CB 3.3Å; E441-C446 PolarHBondContact OE1-N 3.32Å; E441-S462 PolarHBondContact OE1-OG 2.98Å; E441-F464 HydrophobicContact CB-CB 3.85Å; E441-F464 HydrophobicContact CG-CB 4.04Å; E441-H495 VanDerWaalsContact CB-CD2 3.48Å; E441-H495 WeakPolarHBondContact CB-CD2 3.3Å; E441-H495 IonicContact OE2-CD2 3.26Å; E441-H495 PolarHBondContact OE2-CD2 3.16Å; E441-R498 IonicContact OE1-CZ 3.69Å; E441-R498 IonicContact OE1-NH1 3.25Å; E441-R498 PolarHBondContact OE1-NH1 3.06Å; E441-R498 IonicContact OE1-NH2 3.72Å; E441-R498 IonicContact OE2-CZ 2.76Å; E441-R498 IonicContact OE2-NH1 2.74Å; E441-R498 PolarHBondContact OE2-NH1 3.38Å
442	P	89.2	Confident	77.1	Confident	11 Å²	11	34.6 Å²	34.6	7%	0.071	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	135.8	165.6	-26.6	36.5	0	0	0	111.6	S444 D445 C446	P442-S444 VanDerWaalsContact CB-OG 3.26Å; P442-S444 WeakPolarHBondContact CB-OG 3.11Å; P442-S444 PolarHBondContact O-N 3.48Å; P442-D445 HydrophobicContact CB-CB 4.39Å; P442-D445 PolarHBondContact O-N 3.24Å; P442-C446 PolarHBondContact O-SG 2.81Å; P442-C446 VanDerWaalsContact O-SG 3.32Å
443	L	85.2	Confident	74.7	Confident	21 Å²	21	42.8 Å²	42.8	11%	0.11	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.2	179.3	-165.5	71	0	0	0	112.3	F14 L72 A91 E441 D445 Y488 Q491 L492	F14-L443 HydrophobicContact CE1-CD2 3.78Å; F14-L443 HydrophobicContact CZ-CD2 3.92Å; L72-L443 HydrophobicContact CD1-CD1 3.99Å; L72-L443 HydrophobicContact CD1-CD2 3.9Å; L72-L443 HydrophobicContact CD1-CG 4.45Å; A91-L443 HydrophobicContact CB-CB 4.39Å; A91-L443 HydrophobicContact CB-CD2 4.35Å; A91-L443 PolarHBondContact O-N 2.92Å; E441-L443 PolarHBondContact O-N 2.83Å; L443-D445 VanDerWaalsContact C-N 3.28Å; L443-D445 PolarHBondContact O-N 3.14Å; L443-Y488 HydrophobicContact CD2-CD1 3.91Å; L443-Y488 HydrophobicContact CD2-CE1 4.37Å; L443-Y488 HydrophobicContact CD2-CG 4.06Å; L443-Q491 HydrophobicContact CD1-CB 3.67Å; L443-Q491 HydrophobicContact CD1-CG 4.29Å; L443-Q491 HydrophobicContact CG-CB 4.45Å; L443-L492 HydrophobicContact CD1-CD2 4.5Å
444	S	83	Confident	72.1	Confident	81 Å²	81	49 Å²	49	57%	0.566	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.8	171.3	46.9	0	0	0	0	113.7	P442 T447	P442-S444 VanDerWaalsContact CB-OG 3.26Å; P442-S444 WeakPolarHBondContact CB-OG 3.11Å; P442-S444 PolarHBondContact O-N 3.48Å; S444-T447 VanDerWaalsContact O-CG2 3.27Å; S444-T447 WeakPolarHBondContact O-CG2 2.99Å
445	D	84	Confident	69.9	Low	40 Å²	40	53.3 Å²	53.3	21%	0.214	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-17.9	-168.8	-69.9	37.5	0	0	0	111.4	E441 P442 L443 T447	E441-D445 HydrophobicContact CG-CB 4.1Å; E441-D445 WeakPolarHBondContact OE1-CB 3.3Å; P442-D445 HydrophobicContact CB-CB 4.39Å; P442-D445 PolarHBondContact O-N 3.24Å; L443-D445 VanDerWaalsContact C-N 3.28Å; L443-D445 PolarHBondContact O-N 3.14Å; D445-T447 PolarHBondContact O-N 2.9Å
446	C	83	Confident	67.8	Low	1 Å²	1	56.9 Å²	56.9	1%	0.007	32%	0.318	C	S	.	.			trans	-72	51.2	-180	-62.7	0	0	0	0	113.2	E441 P442 Q491 I494	E441-C446 PolarHBondContact OE1-N 3.32Å; P442-C446 PolarHBondContact O-SG 2.81Å; P442-C446 VanDerWaalsContact O-SG 3.32Å; C446-Q491 HydrophobicContact CB-CB 3.82Å; C446-Q491 HydrophobicContact CB-CG 4.28Å; C446-I494 WeakPolarHBondContact O-CD1 3.36Å
447	T	74.8	Confident	65.5	Low	61 Å²	61	61.4 Å²	61.4	37%	0.374	34%	0.342	S	S	.	.			trans	-108.2	165.4	-171.1	59	0	0	0	0	113.6	S444 D445 S449	S444-T447 VanDerWaalsContact O-CG2 3.27Å; S444-T447 WeakPolarHBondContact O-CG2 2.99Å; D445-T447 PolarHBondContact O-N 2.9Å; T447-S449 PolarHBondContact OG1-OG 3.43Å
448	K	64.2	Low	63.2	Low	94 Å²	94	70.3 Å²	70.3	41%	0.409	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-78.3	-15.9	-176	-66.7	179.9	-174.6	165.1	0	115.1	I450 Y451 Q452 I494	K448-I450 PolarHBondContact O-N 3.14Å; K448-Y451 PolarHBondContact O-N 3.14Å; K448-Q452 PolarHBondContact O-N 2.77Å; K448-I494 HydrophobicContact CG-CD1 4.21Å
449	S	49.9	Very low	60.8	Low	64 Å²	64	73.4 Å²	73.4	45%	0.448	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-58.8	-20.6	-170.3	49.7	0	0	0	0	114.1	T447 Y451	T447-S449 PolarHBondContact OG1-OG 3.43Å; S449-Y451 VanDerWaalsContact C-N 3.25Å; S449-Y451 PolarHBondContact O-N 3.13Å
450	I	48.3	Very low	58.6	Low	77 Å²	77	79.4 Å²	79.4	40%	0.395	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-69.4	-21	175	-57.1	172.4	0	0	0	112.2	K448	K448-I450 PolarHBondContact O-N 3.14Å
451	Y	43.8	Very low	56.7	Low	83 Å²	83	85.6 Å²	85.6	33%	0.325	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-18.8	-172.6	-59	-66.7	0	0	0	115.3	K448 S449 F497 R498 F546	K448-Y451 PolarHBondContact O-N 3.14Å; S449-Y451 VanDerWaalsContact C-N 3.25Å; S449-Y451 PolarHBondContact O-N 3.13Å; Y451-F497 AromaticContact CE1-CE1 3.92Å; Y451-F497 HydrophobicContact CE1-CE1 3.92Å; Y451-F497 HydrophobicContact CE2-CD1 4.39Å; Y451-F497 HydrophobicContact CE2-CE1 4.08Å; Y451-F497 AromaticContact CZ-CE1 3.56Å; Y451-F497 WeakPolarHBondContact OH-CE1 3.33Å; Y451-R498 WeakPolarHBondContact OH-CG 3.48Å; Y451-F546 HydrophobicContact CD2-CD1 4.32Å
452	Q	37.8	Very low	55.2	Low	89 Å²	89	86.6 Å²	86.6	42%	0.416	48%	0.48	S	S	.	.	S	Bend	trans	-86.5	117.9	164.6	-76.8	174.1	-106.7	0	0	107.9	K448 E454	K448-Q452 PolarHBondContact O-N 2.77Å; Q452-E454 HydrophobicContact CB-CG 4.44Å; Q452-E454 PolarHBondContact NE2-OE1 3.34Å; Q452-E454 PolarHBondContact O-N 3.48Å
453	N	36.4	Very low	54.3	Low	172 Å²	172	94.1 Å²	94.1	92%	0.92	51%	0.507	S	S	*	.			trans	-78	38.7	-176.5	-154.6	35.6	0	0	0	112.1
454	E	31.4	Very low	54.1	Low	131 Å²	131	95 Å²	95	61%	0.612	51%	0.51	S	S	*	.			trans	-86.2	111.3	-179	-75.3	163.6	-142.7	0	0	108.4	Q452 S456	Q452-E454 HydrophobicContact CB-CG 4.44Å; Q452-E454 PolarHBondContact NE2-OE1 3.34Å; Q452-E454 PolarHBondContact O-N 3.48Å; E454-S456 PolarHBondContact O-N 2.92Å
455	S	38.2	Very low	54.2	Low	129 Å²	129	95.5 Å²	95.5	90%	0.902	50%	0.502	S	S	*	.	S	Bend	trans	-78.2	41.8	-163.5	60.5	0	0	0	0	114.6
456	S	34.8	Very low	54.4	Low	93 Å²	93	94.9 Å²	94.9	65%	0.65	50%	0.5	S	S	*	.			trans	-147.5	61	-172.7	63.7	0	0	0	0	113.2	E454	E454-S456 PolarHBondContact O-N 2.92Å
457	N	37.4	Very low	54.6	Low	140 Å²	140	95.5 Å²	95.5	75%	0.749	50%	0.504	S	S	*	.	S	Bend	trans	-154	132.3	153.2	-97.2	-54.1	0	0	0	109.6	G459	N457-G459 PolarHBondContact O-N 2.89Å; N457-G459 VanDerWaalsContact O-N 3.1Å
458	E	39.9	Very low	55.2	Low	190 Å²	190	92.8 Å²	92.8	89%	0.888	49%	0.487	S	S	*	.			trans	-73.4	103.2	-176.7	-69.4	-177	119.5	0	0	111.7	I460	E458-I460 PolarHBondContact O-N 2.78Å
459	G	40.9	Very low	56.1	Low	65 Å²	65	89.6 Å²	89.6	67%	0.67	48%	0.475	S	S	*	.			trans	58.6	19.9	138.4	0	0	0	0	0	118.6	N457 K461	N457-G459 PolarHBondContact O-N 2.89Å; N457-G459 VanDerWaalsContact O-N 3.1Å; G459-K461 PolarHBondContact O-N 2.92Å
460	I	45.5	Very low	57.7	Low	125 Å²	125	89.7 Å²	89.7	64%	0.641	47%	0.471	S	S	*	.			trans	-64.7	89	171.6	-55	-179	0	0	0	107.8	E458 S462	E458-I460 PolarHBondContact O-N 2.78Å; I460-S462 PolarHBondContact O-N 2.8Å
461	K	51.7	Low	59.3	Low	131 Å²	131	89.5 Å²	89.5	57%	0.57	47%	0.469	S	S	*	.			trans	-71.3	68.4	175.4	-70.7	177.1	-178.5	179	0	108.7	G459 R463	G459-K461 PolarHBondContact O-N 2.92Å; K461-R463 WeakPolarHBondContact O-CG 3.29Å; K461-R463 PolarHBondContact O-N 2.88Å
462	S	59.4	Low	61.4	Low	21 Å²	21	85.7 Å²	85.7	15%	0.147	45%	0.454	C	S	.	.			trans	-54.1	123.6	-179.9	161.9	0	0	0	0	109.9	E441 I460 R498	E441-S462 PolarHBondContact OE1-OG 2.98Å; I460-S462 PolarHBondContact O-N 2.8Å; S462-R498 PolarHBondContact O-NH2 2.73Å; S462-R498 VanDerWaalsContact OG-CZ 3.3Å; S462-R498 PolarHBondContact OG-NH1 3.42Å; S462-R498 PolarHBondContact OG-NH2 2.85Å
463	R	70.1	Confident	63.7	Low	168 Å²	168	84.7 Å²	84.7	63%	0.634	45%	0.452	S	S	*	.			trans	-126.5	116	-177.5	-75.7	161.6	175.6	-178.9	-1.6	107.7	K461	K461-R463 WeakPolarHBondContact O-CG 3.29Å; K461-R463 PolarHBondContact O-N 2.88Å
464	F	81.6	Confident	66.1	Low	40 Å²	40	80.6 Å²	80.6	18%	0.175	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-81.1	148.7	162.6	56.2	-98.3	0	0	0	109.5	F439 L440 E441 V466 R498 F502	F439-F464 AromaticContact CD1-CD2 3.85Å; F439-F464 HydrophobicContact CD1-CD2 3.85Å; F439-F464 AromaticContact CD1-CE2 3.79Å; F439-F464 HydrophobicContact CD1-CE2 3.79Å; F439-F464 HydrophobicContact CE1-CE2 4.17Å; L440-F464 CarbonylContact O-C 3.48Å; L440-F464 VanDerWaalsContact O-CA 3.3Å; L440-F464 WeakPolarHBondContact O-CA 3.48Å; L440-F464 WeakPolarHBondContact O-CB 3.5Å; E441-F464 HydrophobicContact CB-CB 3.85Å; E441-F464 HydrophobicContact CG-CB 4.04Å; F464-V466 HydrophobicContact CD2-CG2 3.91Å; F464-V466 HydrophobicContact CE2-CG2 3.7Å; F464-R498 HydrophobicContact CE1-CB 4.25Å; F464-F502 HydrophobicContact CE2-CB 4.32Å; F464-F502 AromaticContact CE2-CD2 3.84Å; F464-F502 HydrophobicContact CE2-CD2 3.84Å; F464-F502 HydrophobicContact CE2-CE2 4.35Å; F464-F502 HydrophobicContact CE2-CG 4.04Å; F464-F502 HydrophobicContact CZ-CB 3.77Å; F464-F502 AromaticContact CZ-CD2 3.69Å; F464-F502 HydrophobicContact CZ-CD2 3.69Å; F464-F502 AromaticContact CZ-CG 3.89Å; F464-F502 HydrophobicContact CZ-CG 3.89Å
465	F	85.7	Confident	68.8	Low	91 Å²	91	75.1 Å²	75.1	40%	0.399	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.3	174.2	-57.4	-84.8	0	0	0	109.5	L86 F439 L440 V467	L86-F465 HydrophobicContact CD2-CD2 4.48Å; F439-F465 WeakPolarHBondContact CA-O 3.45Å; L440-F465 PolarHBondContact N-O 2.87Å; L440-F465 PolarHBondContact O-N 2.86Å; F465-V467 HydrophobicContact CB-CG1 4.28Å
466	V	87.9	Confident	71.3	Confident	28 Å²	28	70.2 Å²	70.2	17%	0.17	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.6	169.4	-168.6	0	0	0	0	107.5	L437 F439 F464 F502 I515	L437-V466 HydrophobicContact CB-CG1 4.43Å; L437-V466 HydrophobicContact CD1-CG1 4.19Å; L437-V466 HydrophobicContact CD2-CG1 4.25Å; F439-V466 HydrophobicContact CD1-CB 4.43Å; F439-V466 HydrophobicContact CD1-CG1 4.22Å; F439-V466 HydrophobicContact CD1-CG2 3.73Å; F439-V466 HydrophobicContact CE1-CB 4.29Å; F439-V466 HydrophobicContact CE1-CG1 3.77Å; F439-V466 HydrophobicContact CE1-CG2 3.61Å; F439-V466 HydrophobicContact CZ-CG1 4.04Å; F464-V466 HydrophobicContact CD2-CG2 3.91Å; F464-V466 HydrophobicContact CE2-CG2 3.7Å; V466-F502 HydrophobicContact CG2-CE1 4.22Å; V466-F502 HydrophobicContact CG2-CE2 4.17Å; V466-F502 HydrophobicContact CG2-CZ 3.87Å; V466-I515 HydrophobicContact CB-CD1 3.88Å; V466-I515 HydrophobicContact CG1-CD1 3.75Å
467	V	87.3	Confident	74	Confident	14 Å²	14	65.8 Å²	65.8	9%	0.085	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	162.4	-174.3	-61.4	0	0	0	0	110.8	I438 L440 F465 M471 L472	I438-V467 HydrophobicContact CB-CG2 4.06Å; I438-V467 HydrophobicContact CG2-CG2 4.18Å; I438-V467 PolarHBondContact N-O 3.02Å; I438-V467 WeakPolarHBondContact O-CG2 3.32Å; I438-V467 PolarHBondContact O-N 3.07Å; L440-V467 HydrophobicContact CD1-CG2 4.11Å; F465-V467 HydrophobicContact CB-CG1 4.28Å; V467-M471 HydrophobicContact CB-CB 4.38Å; V467-M471 HydrophobicContact CB-CE 4.44Å; V467-M471 HydrophobicContact CB-SD 3.55Å; V467-M471 VanDerWaalsContact CB-SD 3.55Å; V467-M471 HydrophobicContact CG1-CE 3.97Å; V467-M471 HydrophobicContact CG1-SD 3.72Å; V467-L472 HydrophobicContact CG2-CD1 3.62Å; V467-L472 HydrophobicContact CG2-CG 4.15Å
468	T	86.1	Confident	76.5	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.018	30%	0.3	C	S	.	.			trans	-104.3	171.7	174.7	59.4	0	0	0	0	111.6	L437 D470 M471 H518 L519	L437-T468 HydrophobicContact CD2-CG2 4.09Å; T468-D470 PolarHBondContact O-N 3.04Å; T468-M471 PolarHBondContact O-N 3.32Å; T468-H518 WeakPolarHBondContact CB-NE2 3.48Å; T468-H518 VanDerWaalsContact CG2-CD2 3.47Å; T468-H518 WeakPolarHBondContact CG2-CD2 3.33Å; T468-H518 PolarHBondContact OG1-CD2 3.48Å; T468-H518 PolarHBondContact OG1-NE2 2.82Å; T468-L519 HydrophobicContact CG2-CD2 4.19Å
469	T	84.4	Confident	79	Confident	27 Å²	27	51 Å²	51	17%	0.166	26%	0.261	C	S	.	.	H	α-helix	trans	-50.8	-42	176.8	45	0	0	0	0	112.6	V53 D436 I438 M471 L472 L473	V53-T469 HydrophobicContact CG2-CG2 4.1Å; D436-T469 HydrophobicContact CB-CG2 4.36Å; I438-T469 HydrophobicContact CD1-CG2 4.05Å; T469-M471 PolarHBondContact O-N 3Å; T469-L472 CarbonylContact O-C 3.4Å; T469-L472 WeakPolarHBondContact O-CA 3.37Å; T469-L472 PolarHBondContact O-N 3.02Å; T469-L473 PolarHBondContact O-N 2.81Å; T469-L473 VanDerWaalsContact O-N 3.13Å
470	D	83.4	Confident	81.3	Confident	66 Å²	66	48.1 Å²	48.1	35%	0.353	23%	0.231	S	C	.	.	H	α-helix	trans	-73.1	-33.2	-167.2	-71.2	26.2	0	0	0	112.4	T468 L472 L473 H518	T468-D470 PolarHBondContact O-N 3.04Å; D470-L472 PolarHBondContact O-N 2.61Å; D470-L473 HydrophobicContact CB-CD1 4.18Å; D470-L473 PolarHBondContact O-N 3.15Å; D470-H518 IonicContact OD2-CE1 2.92Å
471	M	82.4	Confident	83.3	Confident	73 Å²	73	43.1 Å²	43.1	36%	0.36	21%	0.205	S	C	.	.	H	α-helix	trans	-59.8	-24.7	169.8	-55.8	-178.4	79.4	0	0	111.9	V467 T468 T469 Y514	V467-M471 HydrophobicContact CB-CB 4.38Å; V467-M471 HydrophobicContact CB-CE 4.44Å; V467-M471 HydrophobicContact CB-SD 3.55Å; V467-M471 VanDerWaalsContact CB-SD 3.55Å; V467-M471 HydrophobicContact CG1-CE 3.97Å; V467-M471 HydrophobicContact CG1-SD 3.72Å; T468-M471 PolarHBondContact O-N 3.32Å; T469-M471 PolarHBondContact O-N 3Å; M471-Y514 HydrophobicContact CE-CE1 3.81Å; M471-Y514 HydrophobicContact CG-CE1 4.48Å; M471-Y514 HydrophobicContact SD-CE1 3.68Å
472	L	86.6	Confident	84.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-108.3	-4	-171.8	-65.5	174.5	0	0	0	114.7	I49 L86 I438 L440 V467 T469 D470 H474 H475 F477	I49-L472 HydrophobicContact CB-CB 4.17Å; I49-L472 HydrophobicContact CD1-CD1 4.18Å; I49-L472 HydrophobicContact CG1-CB 4.16Å; I49-L472 HydrophobicContact CG1-CD1 4.22Å; I49-L472 HydrophobicContact CG2-CB 4.17Å; L86-L472 HydrophobicContact CD1-CD2 3.89Å; I438-L472 HydrophobicContact CB-CD1 4.34Å; I438-L472 HydrophobicContact CD1-CD1 4.03Å; I438-L472 HydrophobicContact CG2-CD1 3.85Å; L440-L472 HydrophobicContact CD1-CD1 4.3Å; L440-L472 HydrophobicContact CD1-CD2 4.32Å; V467-L472 HydrophobicContact CG2-CD1 3.62Å; V467-L472 HydrophobicContact CG2-CG 4.15Å; T469-L472 CarbonylContact O-C 3.4Å; T469-L472 WeakPolarHBondContact O-CA 3.37Å; T469-L472 PolarHBondContact O-N 3.02Å; D470-L472 PolarHBondContact O-N 2.61Å; L472-H474 PolarHBondContact O-N 2.9Å; L472-H475 WeakPolarHBondContact O-CB 3.33Å; L472-H475 PolarHBondContact O-N 3.44Å; L472-F477 HydrophobicContact CB-CE2 4.44Å; L472-F477 HydrophobicContact CB-CZ 4.07Å; L472-F477 HydrophobicContact CD1-CZ 3.98Å; L472-F477 HydrophobicContact CD2-CZ 4.13Å; L472-F477 HydrophobicContact CG-CZ 4.27Å
473	L	85.3	Confident	85.9	Confident	69 Å²	69	46 Å²	46	36%	0.361	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-28.4	176	-71.2	167.5	0	0	0	114.4	R78 T469 D470 H475	R78-L473 PolarHBondContact NH1-O 2.66Å; T469-L473 PolarHBondContact O-N 2.81Å; T469-L473 VanDerWaalsContact O-N 3.13Å; D470-L473 HydrophobicContact CB-CD1 4.18Å; D470-L473 PolarHBondContact O-N 3.15Å; L473-H475 VanDerWaalsContact C-N 3.3Å; L473-H475 PolarHBondContact O-N 2.87Å
474	H	86.9	Confident	86.6	Confident	86 Å²	86	38.6 Å²	38.6	40%	0.398	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	16.3	179.7	-61.5	100.7	0	0	0	113.9	R78 K79 L472	R78-H474 VanDerWaalsContact CB-O 3.24Å; R78-H474 WeakPolarHBondContact CB-O 3.31Å; R78-H474 WeakPolarHBondContact CG-O 3.33Å; R78-H474 PolarHBondContact N-O 2.93Å; K79-H474 HydrophobicContact CD-CB 4.47Å; K79-H474 WeakPolarHBondContact CE-CD2 3.46Å; K79-H474 WeakPolarHBondContact CE-NE2 3.24Å; K79-H474 HydrophobicContact CG-CB 4.42Å; L472-H474 PolarHBondContact O-N 2.9Å
475	H	89.4	Confident	86.8	Confident	15 Å²	15	38.3 Å²	38.3	7%	0.069	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.5	-177.9	-59.8	92	0	0	0	112	I75 E76 C77 L472 L473 F477	I75-H475 HydrophobicContact CG2-CB 4Å; I75-H475 VanDerWaalsContact CG2-CD2 3.47Å; I75-H475 WeakPolarHBondContact CG2-CD2 3.2Å; E76-H475 CarbonylContact O-C 3.51Å; E76-H475 VanDerWaalsContact O-CA 3.28Å; E76-H475 WeakPolarHBondContact O-CA 3.35Å; C77-H475 PolarHBondContact SG-NE2 3.42Å; C77-H475 VanDerWaalsContact SG-NE2 3.42Å; L472-H475 WeakPolarHBondContact O-CB 3.33Å; L472-H475 PolarHBondContact O-N 3.44Å; L473-H475 VanDerWaalsContact C-N 3.3Å; L473-H475 PolarHBondContact O-N 2.87Å; H475-F477 HydrophobicContact CB-CE2 3.99Å; H475-F477 HydrophobicContact CB-CZ 4.26Å
476	N	90.1	Very high	86.6	Confident	26 Å²	26	40 Å²	40	14%	0.139	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	154.5	159.6	-54.1	-43.2	0	0	0	109.2	R46 F47 E76 R78	R46-N476 HydrophobicContact CB-CB 4.08Å; R46-N476 HydrophobicContact CG-CB 4.17Å; F47-N476 WeakPolarHBondContact O-CA 3.39Å; E76-N476 HydrophobicContact CB-CB 4.22Å; E76-N476 PolarHBondContact N-O 3.39Å; E76-N476 PolarHBondContact O-N 3.03Å; E76-N476 PolarHBondContact OE2-ND2 2.98Å; R78-N476 VanDerWaalsContact CZ-OD1 3.28Å; R78-N476 PolarHBondContact NE-OD1 3.18Å; R78-N476 PolarHBondContact NH2-OD1 3.21Å
477	F	92.2	Very high	86.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.2	177	-63.2	-100	0	0	0	109	F47 I49 L52 V73 Q74 I75 M94 L472 H475	F47-F477 PolarHBondContact N-O 3.43Å; F47-F477 PolarHBondContact O-N 2.98Å; I49-F477 HydrophobicContact CB-CE2 3.87Å; I49-F477 HydrophobicContact CB-CZ 4.39Å; I49-F477 HydrophobicContact CD1-CE1 4.46Å; I49-F477 HydrophobicContact CD1-CE2 4.2Å; I49-F477 HydrophobicContact CD1-CZ 4.03Å; L52-F477 HydrophobicContact CD1-CB 3.54Å; L52-F477 HydrophobicContact CD1-CD1 4.02Å; L52-F477 HydrophobicContact CD1-CD2 3.87Å; L52-F477 HydrophobicContact CD1-CG 3.52Å; V73-F477 HydrophobicContact CG2-CD1 4.36Å; Q74-F477 WeakPolarHBondContact O-CA 3.42Å; I75-F477 HydrophobicContact CD1-CD1 4.19Å; I75-F477 HydrophobicContact CD1-CE1 3.54Å; I75-F477 HydrophobicContact CD1-CZ 4.22Å; I75-F477 HydrophobicContact CG1-CD1 3.8Å; I75-F477 HydrophobicContact CG1-CE1 3.65Å; I75-F477 HydrophobicContact CG1-CZ 4.43Å; M94-F477 HydrophobicContact SD-CD1 3.9Å; M94-F477 HydrophobicContact SD-CE1 3.97Å; L472-F477 HydrophobicContact CB-CE2 4.44Å; L472-F477 HydrophobicContact CB-CZ 4.07Å; L472-F477 HydrophobicContact CD1-CZ 3.98Å; L472-F477 HydrophobicContact CD2-CZ 4.13Å; L472-F477 HydrophobicContact CG-CZ 4.27Å; H475-F477 HydrophobicContact CB-CE2 3.99Å; H475-F477 HydrophobicContact CB-CZ 4.26Å
478	L	90.4	Very high	86.4	Confident	9 Å²	9	43.9 Å²	43.9	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.2	163.7	-53.5	-176.3	0	0	0	107.3	W16 R46 V73 Q74	W16-L478 HydrophobicContact CB-CB 4.43Å; W16-L478 HydrophobicContact CD2-CB 4.01Å; W16-L478 HydrophobicContact CE3-CB 3.99Å; W16-L478 HydrophobicContact CG-CB 4.17Å; W16-L478 HydrophobicContact CG-CD1 4.37Å; R46-L478 HydrophobicContact CG-CD2 3.67Å; V73-L478 CarbonylContact C-O 3.56Å; V73-L478 WeakPolarHBondContact CA-O 3.38Å; V73-L478 WeakPolarHBondContact CB-O 3.42Å; Q74-L478 HydrophobicContact CB-CB 4.35Å; Q74-L478 PolarHBondContact N-O 2.9Å; Q74-L478 PolarHBondContact O-N 2.89Å
479	V	90.6	Very high	86.3	Confident	12 Å²	12	48 Å²	48	7%	0.073	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.3	179	-179	0	0	0	0	109.1	I17 F47 L52 V73	I17-V479 HydrophobicContact CD1-CB 4.22Å; I17-V479 HydrophobicContact CD1-CG1 4.08Å; I17-V479 WeakPolarHBondContact CG1-O 3.35Å; I17-V479 PolarHBondContact N-O 3.46Å; F47-V479 HydrophobicContact CD2-CB 4.32Å; F47-V479 HydrophobicContact CD2-CG2 3.67Å; F47-V479 HydrophobicContact CE2-CB 4.12Å; F47-V479 HydrophobicContact CE2-CG2 3.93Å; L52-V479 HydrophobicContact CD2-CG2 3.74Å; V73-V479 HydrophobicContact CG1-CG2 4.19Å
480	A	90	Very high	86.1	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.025	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-70	153.4	-179.6	0	0	0	0	0	111.7	W16 L72 T484	W16-A480 HydrophobicContact CE3-CB 3.95Å; W16-A480 HydrophobicContact CZ3-CB 3.77Å; L72-A480 HydrophobicContact CB-CB 3.8Å; L72-A480 HydrophobicContact CD2-CB 3.8Å; L72-A480 HydrophobicContact CG-CB 3.88Å; L72-A480 PolarHBondContact O-N 2.92Å; A480-T484 HydrophobicContact CB-CG2 4.15Å
481	D	87.6	Confident	86.2	Confident	20 Å²	20	48.7 Å²	48.7	11%	0.107	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-75	165.7	176.7	83.7	-10.6	0	0	0	112.7	K15 I17 Q483 T484 C485	K15-D481 WeakPolarHBondContact CD-OD2 3.43Å; K15-D481 WeakPolarHBondContact CE-OD2 3.38Å; K15-D481 IonicContact NZ-OD2 3.37Å; K15-D481 PolarHBondContact NZ-OD2 2.78Å; K15-D481 PolarHBondContact O-N 2.96Å; I17-D481 HydrophobicContact CG1-CB 4.23Å; D481-Q483 PolarHBondContact O-N 3.48Å; D481-Q483 VanDerWaalsContact O-N 3.15Å; D481-Q483 PolarHBondContact OD1-N 3Å; D481-T484 PolarHBondContact O-N 3.21Å; D481-T484 VanDerWaalsContact OD1-CB 3.31Å; D481-T484 WeakPolarHBondContact OD1-CB 3.32Å; D481-T484 PolarHBondContact OD1-N 3.43Å; D481-T484 PolarHBondContact OD1-OG1 3.46Å; D481-C485 PolarHBondContact O-N 3.14Å; D481-C485 PolarHBondContact O-SG 2.66Å
482	S	83	Confident	86.4	Confident	83 Å²	83	45.3 Å²	45.3	58%	0.58	24%	0.241	S	C	*	.	H	α-helix	trans	-63.5	-23	-175.8	-172.7	0	0	0	0	113.7	Q486	S482-Q486 VanDerWaalsContact O-CG 3.24Å; S482-Q486 WeakPolarHBondContact O-CG 3.31Å; S482-Q486 PolarHBondContact O-N 3.49Å
483	Q	82.9	Confident	86.2	Confident	129 Å²	129	45.8 Å²	45.8	60%	0.603	24%	0.243	S	C	*	.	H	α-helix	trans	-75.5	-45.8	177.5	-67	176.6	-29	0	0	110	K15 D481 Q486 A487	K15-Q483 VanDerWaalsContact NZ-OE1 3.1Å; D481-Q483 PolarHBondContact O-N 3.48Å; D481-Q483 VanDerWaalsContact O-N 3.15Å; D481-Q483 PolarHBondContact OD1-N 3Å; Q483-Q486 PolarHBondContact O-N 3.22Å; Q483-A487 PolarHBondContact O-N 3.09Å; Q483-A487 VanDerWaalsContact O-N 3.17Å
484	T	85.2	Confident	86	Confident	13 Å²	13	42.6 Å²	42.6	8%	0.08	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-41.8	175	-49.1	0	0	0	0	111.1	F14 K15 L72 A480 D481 Q486 A487 Y488	F14-T484 HydrophobicContact CB-CG2 4.36Å; F14-T484 HydrophobicContact CD1-CG2 4.02Å; K15-T484 WeakPolarHBondContact CB-OG1 3.43Å; K15-T484 PolarHBondContact N-OG1 2.94Å; K15-T484 PolarHBondContact O-OG1 3.13Å; L72-T484 HydrophobicContact CD2-CG2 3.75Å; A480-T484 HydrophobicContact CB-CG2 4.15Å; D481-T484 PolarHBondContact O-N 3.21Å; D481-T484 VanDerWaalsContact OD1-CB 3.31Å; D481-T484 WeakPolarHBondContact OD1-CB 3.32Å; D481-T484 PolarHBondContact OD1-N 3.43Å; D481-T484 PolarHBondContact OD1-OG1 3.46Å; T484-Q486 VanDerWaalsContact C-N 3.28Å; T484-Q486 PolarHBondContact O-N 3.24Å; T484-A487 PolarHBondContact O-N 3.08Å; T484-Y488 HydrophobicContact CG2-CD2 4.06Å; T484-Y488 HydrophobicContact CG2-CE2 4.04Å; T484-Y488 VanDerWaalsContact O-CD2 3.31Å; T484-Y488 WeakPolarHBondContact O-CD2 3.44Å; T484-Y488 PolarHBondContact O-N 3.31Å
485	C	84.7	Confident	86	Confident	34 Å²	34	38.5 Å²	38.5	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-32.6	175.5	-71.3	0	0	0	0	113.4	D481 Q489 L492	D481-C485 PolarHBondContact O-N 3.14Å; D481-C485 PolarHBondContact O-SG 2.66Å; C485-Q489 WeakPolarHBondContact O-CA 3.24Å; C485-Q489 PolarHBondContact O-N 3.34Å; C485-Q489 VanDerWaalsContact O-N 3.11Å; C485-L492 HydrophobicContact CB-CD1 4.45Å
486	Q	81.8	Confident	85.6	Confident	126 Å²	126	37.8 Å²	37.8	59%	0.589	20%	0.204	S	C	*	.	H	α-helix	trans	-69.9	-39.6	174	-76	166.8	2.3	0	0	111.8	S482 Q483 T484 Y488 Q489	S482-Q486 VanDerWaalsContact O-CG 3.24Å; S482-Q486 WeakPolarHBondContact O-CG 3.31Å; S482-Q486 PolarHBondContact O-N 3.49Å; Q483-Q486 PolarHBondContact O-N 3.22Å; T484-Q486 VanDerWaalsContact C-N 3.28Å; T484-Q486 PolarHBondContact O-N 3.24Å; Q486-Y488 VanDerWaalsContact C-N 3.28Å; Q486-Y488 PolarHBondContact O-N 2.98Å; Q486-Q489 WeakPolarHBondContact O-CB 3.18Å; Q486-Q489 PolarHBondContact O-N 3.08Å
487	A	85	Confident	84.9	Confident	72 Å²	72	37.1 Å²	37.1	60%	0.595	20%	0.2	S	C	*	.	H	α-helix	trans	-61.2	-34	176.9	0	0	0	0	0	113.3	Q483 T484	Q483-A487 PolarHBondContact O-N 3.09Å; Q483-A487 VanDerWaalsContact O-N 3.17Å; T484-A487 PolarHBondContact O-N 3.08Å
488	Y	86.1	Confident	84.3	Confident	52 Å²	52	38.2 Å²	38.2	20%	0.204	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	18.3	178.9	-59.4	-71.1	0	0	0	114	P12 F14 L72 L443 T484 Q486 Q490 Q491 L492	P12-Y488 WeakPolarHBondContact CB-OH 3.39Å; F14-Y488 HydrophobicContact CD1-CD2 4.27Å; F14-Y488 AromaticContact CD1-CE2 3.77Å; F14-Y488 HydrophobicContact CD1-CE2 3.77Å; F14-Y488 HydrophobicContact CE1-CD2 4.02Å; F14-Y488 HydrophobicContact CE1-CE1 4.43Å; F14-Y488 AromaticContact CE1-CE2 3.55Å; F14-Y488 HydrophobicContact CE1-CE2 3.55Å; F14-Y488 AromaticContact CE1-CZ 3.81Å; L72-Y488 HydrophobicContact CD2-CD2 3.78Å; L72-Y488 HydrophobicContact CD2-CG 4.41Å; L443-Y488 HydrophobicContact CD2-CD1 3.91Å; L443-Y488 HydrophobicContact CD2-CE1 4.37Å; L443-Y488 HydrophobicContact CD2-CG 4.06Å; T484-Y488 HydrophobicContact CG2-CD2 4.06Å; T484-Y488 HydrophobicContact CG2-CE2 4.04Å; T484-Y488 VanDerWaalsContact O-CD2 3.31Å; T484-Y488 WeakPolarHBondContact O-CD2 3.44Å; T484-Y488 PolarHBondContact O-N 3.31Å; Q486-Y488 VanDerWaalsContact C-N 3.28Å; Q486-Y488 PolarHBondContact O-N 2.98Å; Y488-Q490 PolarHBondContact O-N 3.02Å; Y488-Q491 PolarHBondContact O-N 3.25Å; Y488-Q491 VanDerWaalsContact O-N 3.14Å; Y488-Q491 PolarHBondContact O-OE1 3.49Å; Y488-L492 WeakPolarHBondContact O-CG 3.43Å; Y488-L492 PolarHBondContact O-N 2.92Å; Y488-L492 VanDerWaalsContact O-N 3.13Å
489	Q	83.9	Confident	84	Confident	91 Å²	91	37.8 Å²	37.8	43%	0.425	20%	0.201	S	C	.	.	H	α-helix	trans	-54.5	-39.9	-175.1	179.1	177.4	-22	0	0	112.5	C485 Q486 Q491 L492 E493	C485-Q489 WeakPolarHBondContact O-CA 3.24Å; C485-Q489 PolarHBondContact O-N 3.34Å; C485-Q489 VanDerWaalsContact O-N 3.11Å; Q486-Q489 WeakPolarHBondContact O-CB 3.18Å; Q486-Q489 PolarHBondContact O-N 3.08Å; Q489-Q491 PolarHBondContact O-N 3.36Å; Q489-L492 PolarHBondContact O-N 2.95Å; Q489-E493 HydrophobicContact CG-CG 4.25Å; Q489-E493 WeakPolarHBondContact CG-OE1 3.42Å; Q489-E493 PolarHBondContact NE2-OE1 3.27Å; Q489-E493 WeakPolarHBondContact O-CB 3.11Å; Q489-E493 VanDerWaalsContact O-CG 3.24Å; Q489-E493 WeakPolarHBondContact O-CG 3.35Å; Q489-E493 PolarHBondContact O-N 3.28Å
490	Q	81.2	Confident	83.2	Confident	50 Å²	50	37.2 Å²	37.2	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-45.9	179.3	170.5	123.7	94	0	0	112.4	Y488 E493 I494	Y488-Q490 PolarHBondContact O-N 3.02Å; Q490-E493 PolarHBondContact O-N 3.01Å; Q490-I494 HydrophobicContact CG-CD1 4.2Å; Q490-I494 VanDerWaalsContact O-CG1 3.3Å; Q490-I494 WeakPolarHBondContact O-CG1 3.24Å; Q490-I494 PolarHBondContact O-N 2.96Å
491	Q	85.2	Confident	82.4	Confident	56 Å²	56	41.5 Å²	41.5	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-67	-41.1	179.1	-66.9	83.7	-15.5	0	0	110.8	L443 C446 Y488 Q489 E493 I494 H495	L443-Q491 HydrophobicContact CD1-CB 3.67Å; L443-Q491 HydrophobicContact CD1-CG 4.29Å; L443-Q491 HydrophobicContact CG-CB 4.45Å; C446-Q491 HydrophobicContact CB-CB 3.82Å; C446-Q491 HydrophobicContact CB-CG 4.28Å; Y488-Q491 PolarHBondContact O-N 3.25Å; Y488-Q491 VanDerWaalsContact O-N 3.14Å; Y488-Q491 PolarHBondContact O-OE1 3.49Å; Q489-Q491 PolarHBondContact O-N 3.36Å; Q491-E493 VanDerWaalsContact C-N 3.33Å; Q491-E493 PolarHBondContact O-N 3.46Å; Q491-I494 PolarHBondContact O-N 2.81Å; Q491-H495 PolarHBondContact O-N 3.32Å
492	L	87	Confident	82.1	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-69	-29.9	179	-61.7	170.8	0	0	0	112.8	S70 L72 A93 L443 C485 Y488 Q489 A496	S70-L492 VanDerWaalsContact CB-O 3.32Å; S70-L492 WeakPolarHBondContact CB-O 3.16Å; S70-L492 PolarHBondContact N-O 2.74Å; S70-L492 VanDerWaalsContact N-O 3.14Å; S70-L492 PolarHBondContact OG-O 2.74Å; L72-L492 HydrophobicContact CB-CD1 4.12Å; L72-L492 HydrophobicContact CB-CD2 4.06Å; A93-L492 HydrophobicContact CB-CD2 4.04Å; L443-L492 HydrophobicContact CD1-CD2 4.5Å; C485-L492 HydrophobicContact CB-CD1 4.45Å; Y488-L492 WeakPolarHBondContact O-CG 3.43Å; Y488-L492 PolarHBondContact O-N 2.92Å; Y488-L492 VanDerWaalsContact O-N 3.13Å; Q489-L492 PolarHBondContact O-N 2.95Å; L492-A496 WeakPolarHBondContact O-CB 3.48Å; L492-A496 PolarHBondContact O-N 3.41Å
493	E	82.2	Confident	82.1	Confident	13 Å²	13	38 Å²	38	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-46.5	168	-76	169.1	173.6	0	0	111.5	Q489 Q490 Q491 H495 A496 F497 P541 T543 R545	Q489-E493 HydrophobicContact CG-CG 4.25Å; Q489-E493 WeakPolarHBondContact CG-OE1 3.42Å; Q489-E493 PolarHBondContact NE2-OE1 3.27Å; Q489-E493 WeakPolarHBondContact O-CB 3.11Å; Q489-E493 VanDerWaalsContact O-CG 3.24Å; Q489-E493 WeakPolarHBondContact O-CG 3.35Å; Q489-E493 PolarHBondContact O-N 3.28Å; Q490-E493 PolarHBondContact O-N 3.01Å; Q491-E493 VanDerWaalsContact C-N 3.33Å; Q491-E493 PolarHBondContact O-N 3.46Å; E493-H495 PolarHBondContact O-N 3.01Å; E493-A496 PolarHBondContact O-N 2.74Å; E493-F497 VanDerWaalsContact O-CB 3.23Å; E493-F497 WeakPolarHBondContact O-CB 3.44Å; E493-F497 PolarHBondContact O-N 2.96Å; E493-P541 HydrophobicContact CB-CG 4.47Å; E493-P541 HydrophobicContact CG-CG 4.05Å; E493-T543 HydrophobicContact CG-CG2 4.48Å; E493-R545 IonicContact OE2-NH1 3.43Å
494	I	81.5	Confident	81.6	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-58.2	-46.6	177.4	-70	164.2	0	0	0	111.1	C446 K448 Q490 Q491 F497 R498 F546	C446-I494 WeakPolarHBondContact O-CD1 3.36Å; K448-I494 HydrophobicContact CG-CD1 4.21Å; Q490-I494 HydrophobicContact CG-CD1 4.2Å; Q490-I494 VanDerWaalsContact O-CG1 3.3Å; Q490-I494 WeakPolarHBondContact O-CG1 3.24Å; Q490-I494 PolarHBondContact O-N 2.96Å; Q491-I494 PolarHBondContact O-N 2.81Å; I494-F497 WeakPolarHBondContact O-CB 3.16Å; I494-F497 PolarHBondContact O-N 3.16Å; I494-R498 WeakPolarHBondContact O-CG 3.26Å; I494-R498 PolarHBondContact O-N 3.14Å; I494-F546 HydrophobicContact CD1-CZ 4.45Å; I494-F546 HydrophobicContact CG1-CE1 3.75Å; I494-F546 HydrophobicContact CG1-CZ 3.51Å
495	H	85.4	Confident	81	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-45.9	176.8	178.3	-112.3	0	0	0	112	S70 A93 F439 E441 Q491 E493 F497 R498 V499	S70-H495 PolarHBondContact OG-ND1 3.26Å; A93-H495 HydrophobicContact CB-CB 3.75Å; A93-H495 PolarHBondContact O-CE1 3.17Å; F439-H495 PolarHBondContact O-CE1 3.19Å; E441-H495 VanDerWaalsContact CB-CD2 3.48Å; E441-H495 WeakPolarHBondContact CB-CD2 3.3Å; E441-H495 IonicContact OE2-CD2 3.26Å; E441-H495 PolarHBondContact OE2-CD2 3.16Å; Q491-H495 PolarHBondContact O-N 3.32Å; E493-H495 PolarHBondContact O-N 3.01Å; H495-F497 VanDerWaalsContact C-N 3.3Å; H495-F497 PolarHBondContact O-N 2.98Å; H495-R498 PolarHBondContact O-N 3.44Å; H495-R498 VanDerWaalsContact O-N 3.16Å; H495-V499 WeakPolarHBondContact O-CG2 3.46Å; H495-V499 PolarHBondContact O-N 3.34Å
496	A	81.9	Confident	80.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-39.4	179.3	0	0	0	0	0	112.2	S70 L492 E493 S500	S70-A496 PolarHBondContact OG-N 2.91Å; L492-A496 WeakPolarHBondContact O-CB 3.48Å; L492-A496 PolarHBondContact O-N 3.41Å; E493-A496 PolarHBondContact O-N 2.74Å; A496-S500 PolarHBondContact O-N 3.1Å
497	F	74.4	Confident	80.7	Confident	12 Å²	12	27.5 Å²	27.5	5%	0.053	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-47.6	173.4	177.6	-82.3	0	0	0	111.6	Y451 E493 I494 H495 S500 H501 F546 I551	Y451-F497 AromaticContact CE1-CE1 3.92Å; Y451-F497 HydrophobicContact CE1-CE1 3.92Å; Y451-F497 HydrophobicContact CE2-CD1 4.39Å; Y451-F497 HydrophobicContact CE2-CE1 4.08Å; Y451-F497 AromaticContact CZ-CE1 3.56Å; Y451-F497 WeakPolarHBondContact OH-CE1 3.33Å; E493-F497 VanDerWaalsContact O-CB 3.23Å; E493-F497 WeakPolarHBondContact O-CB 3.44Å; E493-F497 PolarHBondContact O-N 2.96Å; I494-F497 WeakPolarHBondContact O-CB 3.16Å; I494-F497 PolarHBondContact O-N 3.16Å; H495-F497 VanDerWaalsContact C-N 3.3Å; H495-F497 PolarHBondContact O-N 2.98Å; F497-S500 WeakPolarHBondContact O-CB 3.36Å; F497-S500 PolarHBondContact O-N 3.2Å; F497-S500 VanDerWaalsContact O-N 3.16Å; F497-S500 PolarHBondContact O-OG 3.07Å; F497-H501 PolarHBondContact O-N 3.06Å; F497-F546 HydrophobicContact CD2-CB 4.17Å; F497-F546 AromaticContact CD2-CD2 3.84Å; F497-F546 HydrophobicContact CD2-CD2 3.84Å; F497-F546 HydrophobicContact CD2-CG 4.05Å; F497-F546 HydrophobicContact CE2-CB 3.36Å; F497-F546 AromaticContact CE2-CD2 3.92Å; F497-F546 HydrophobicContact CE2-CD2 3.92Å; F497-F546 AromaticContact CE2-CG 3.72Å; F497-F546 HydrophobicContact CE2-CG 3.72Å; F497-F546 HydrophobicContact CG-CD2 4.49Å; F497-F546 HydrophobicContact CZ-CB 3.62Å; F497-F546 HydrophobicContact CZ-CG 4.05Å; F497-I551 HydrophobicContact CD2-CG1 4.38Å; F497-I551 HydrophobicContact CE1-CD1 4.35Å; F497-I551 HydrophobicContact CE1-CG1 4.38Å; F497-I551 HydrophobicContact CE2-CB 4.49Å; F497-I551 HydrophobicContact CE2-CD1 3.6Å; F497-I551 HydrophobicContact CE2-CG1 3.53Å; F497-I551 HydrophobicContact CE2-CG2 4.49Å; F497-I551 HydrophobicContact CZ-CD1 3.31Å; F497-I551 HydrophobicContact CZ-CG1 3.55Å
498	R	80.6	Confident	80.6	Confident	22 Å²	22	26.4 Å²	26.4	8%	0.083	13%	0.133	C	C	.	.	H	α-helix	trans	-66.7	-38.4	179.4	-74.7	173.2	64.5	-166	7.9	113.3	E441 Y451 S462 F464 I494 H495 S500 H501 F502	E441-R498 IonicContact OE1-CZ 3.69Å; E441-R498 IonicContact OE1-NH1 3.25Å; E441-R498 PolarHBondContact OE1-NH1 3.06Å; E441-R498 IonicContact OE1-NH2 3.72Å; E441-R498 IonicContact OE2-CZ 2.76Å; E441-R498 IonicContact OE2-NH1 2.74Å; E441-R498 PolarHBondContact OE2-NH1 3.38Å; Y451-R498 WeakPolarHBondContact OH-CG 3.48Å; S462-R498 PolarHBondContact O-NH2 2.73Å; S462-R498 VanDerWaalsContact OG-CZ 3.3Å; S462-R498 PolarHBondContact OG-NH1 3.42Å; S462-R498 PolarHBondContact OG-NH2 2.85Å; F464-R498 HydrophobicContact CE1-CB 4.25Å; I494-R498 WeakPolarHBondContact O-CG 3.26Å; I494-R498 PolarHBondContact O-N 3.14Å; H495-R498 PolarHBondContact O-N 3.44Å; H495-R498 VanDerWaalsContact O-N 3.16Å; R498-S500 VanDerWaalsContact C-N 3.31Å; R498-S500 PolarHBondContact O-N 2.87Å; R498-H501 PolarHBondContact O-N 2.81Å; R498-F502 WeakPolarHBondContact O-CB 3.37Å; R498-F502 PolarHBondContact O-N 3.06Å
499	V	82.7	Confident	80.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-42.2	170.6	172.7	0	0	0	0	110.8	K95 V97 F439 H495 F502 L503	K95-V499 HydrophobicContact CB-CG2 4.14Å; K95-V499 HydrophobicContact CG-CB 4.17Å; K95-V499 HydrophobicContact CG-CG1 3.87Å; K95-V499 HydrophobicContact CG-CG2 4.16Å; V97-V499 HydrophobicContact CG2-CG1 4.2Å; F439-V499 HydrophobicContact CB-CG1 4.35Å; F439-V499 HydrophobicContact CB-CG2 3.43Å; F439-V499 VanDerWaalsContact CB-CG2 3.43Å; F439-V499 HydrophobicContact CD1-CB 4.36Å; F439-V499 HydrophobicContact CD1-CG1 3.93Å; F439-V499 HydrophobicContact CD1-CG2 3.77Å; F439-V499 HydrophobicContact CD2-CG1 3.51Å; F439-V499 HydrophobicContact CD2-CG2 4.23Å; F439-V499 HydrophobicContact CE1-CG1 4.1Å; F439-V499 HydrophobicContact CE2-CG1 3.69Å; F439-V499 HydrophobicContact CG-CB 4.24Å; F439-V499 HydrophobicContact CG-CG1 3.66Å; F439-V499 HydrophobicContact CG-CG2 3.55Å; F439-V499 HydrophobicContact CZ-CG1 3.99Å; H495-V499 WeakPolarHBondContact O-CG2 3.46Å; H495-V499 PolarHBondContact O-N 3.34Å; V499-F502 PolarHBondContact O-N 3.28Å; V499-L503 HydrophobicContact CG1-CD1 4.06Å; V499-L503 WeakPolarHBondContact O-CG 3.44Å; V499-L503 PolarHBondContact O-N 2.8Å
500	S	74.2	Confident	80.2	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-41.2	176.5	83.1	0	0	0	0	112.6	A496 F497 R498 L503 A504 L539	A496-S500 PolarHBondContact O-N 3.1Å; F497-S500 WeakPolarHBondContact O-CB 3.36Å; F497-S500 PolarHBondContact O-N 3.2Å; F497-S500 VanDerWaalsContact O-N 3.16Å; F497-S500 PolarHBondContact O-OG 3.07Å; R498-S500 VanDerWaalsContact C-N 3.31Å; R498-S500 PolarHBondContact O-N 2.87Å; S500-L503 PolarHBondContact O-N 3.03Å; S500-A504 WeakPolarHBondContact O-CB 3.17Å; S500-A504 PolarHBondContact O-N 3.06Å; S500-L539 PolarHBondContact OG-O 3.23Å
501	H	73.2	Confident	80.1	Confident	93 Å²	93	26.5 Å²	26.5	43%	0.431	15%	0.152	S	C	.	.	H	α-helix	trans	-63.4	-41.9	175.1	-175.3	-79.8	0	0	0	112	F497 R498 A504 A505	F497-H501 PolarHBondContact O-N 3.06Å; R498-H501 PolarHBondContact O-N 2.81Å; H501-A504 PolarHBondContact O-N 3.16Å; H501-A505 WeakPolarHBondContact O-CB 3.27Å; H501-A505 PolarHBondContact O-N 3.26Å
502	F	82.4	Confident	80	Confident	29 Å²	29	24.4 Å²	24.4	13%	0.127	14%	0.143	C	C	.	.	H	α-helix	trans	-60.5	-44.4	174	175.6	-83.7	0	0	0	112	F439 F464 V466 R498 V499 A504 A505 H507 L512	F439-F502 AromaticContact CE1-CD1 3.51Å; F439-F502 HydrophobicContact CE1-CD1 3.51Å; F439-F502 AromaticContact CE1-CE1 3.72Å; F439-F502 HydrophobicContact CE1-CE1 3.72Å; F439-F502 HydrophobicContact CE1-CG 4.21Å; F439-F502 AromaticContact CZ-CD1 3.96Å; F439-F502 HydrophobicContact CZ-CD1 3.96Å; F439-F502 HydrophobicContact CZ-CE1 4.09Å; F464-F502 HydrophobicContact CE2-CB 4.32Å; F464-F502 AromaticContact CE2-CD2 3.84Å; F464-F502 HydrophobicContact CE2-CD2 3.84Å; F464-F502 HydrophobicContact CE2-CE2 4.35Å; F464-F502 HydrophobicContact CE2-CG 4.04Å; F464-F502 HydrophobicContact CZ-CB 3.77Å; F464-F502 AromaticContact CZ-CD2 3.69Å; F464-F502 HydrophobicContact CZ-CD2 3.69Å; F464-F502 AromaticContact CZ-CG 3.89Å; F464-F502 HydrophobicContact CZ-CG 3.89Å; V466-F502 HydrophobicContact CG2-CE1 4.22Å; V466-F502 HydrophobicContact CG2-CE2 4.17Å; V466-F502 HydrophobicContact CG2-CZ 3.87Å; R498-F502 WeakPolarHBondContact O-CB 3.37Å; R498-F502 PolarHBondContact O-N 3.06Å; V499-F502 PolarHBondContact O-N 3.28Å; F502-A504 VanDerWaalsContact C-N 3.34Å; F502-A504 PolarHBondContact O-N 3.41Å; F502-A505 PolarHBondContact O-N 2.87Å; F502-H507 AromaticContact CD2-CE1 3.35Å; F502-H507 WeakPolarHBondContact CD2-CE1 3.48Å; F502-H507 AromaticContact CD2-NE2 3.97Å; F502-H507 AromaticContact CE2-CE1 3.3Å; F502-H507 WeakPolarHBondContact CE2-CE1 3.27Å; F502-H507 AromaticContact CE2-ND1 3.77Å; F502-H507 AromaticContact CE2-NE2 3.91Å; F502-H507 AromaticContact CG-CE1 3.87Å; F502-H507 AromaticContact CZ-CE1 3.8Å; F502-H507 AromaticContact CZ-NE2 3.96Å; F502-H507 PolarHBondContact O-CE1 3.42Å; F502-H507 PolarHBondContact O-NE2 3.45Å; F502-L512 HydrophobicContact CE2-CD2 4.41Å; F502-L512 HydrophobicContact CZ-CD1 4.44Å; F502-L512 HydrophobicContact CZ-CD2 3.86Å
503	L	82.3	Confident	79.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.6	-32.1	178.8	-70.4	173	0	0	0	112.8	V66 V97 I100 T161 C163 F439 V499 S500	V66-L503 HydrophobicContact CG2-CD1 3.97Å; V97-L503 HydrophobicContact CB-CD1 4.4Å; V97-L503 HydrophobicContact CG1-CD1 3.97Å; V97-L503 HydrophobicContact CG2-CD1 4.05Å; I100-L503 HydrophobicContact CD1-CD2 3.97Å; I100-L503 HydrophobicContact CG1-CD2 4.02Å; T161-L503 HydrophobicContact CG2-CD2 4.07Å; T161-L503 WeakPolarHBondContact CG2-O 3.12Å; T161-L503 PolarHBondContact OG1-O 3.09Å; C163-L503 HydrophobicContact CB-CB 3.88Å; F439-L503 HydrophobicContact CZ-CD2 3.91Å; F439-L503 HydrophobicContact CZ-CG 4.19Å; V499-L503 HydrophobicContact CG1-CD1 4.06Å; V499-L503 WeakPolarHBondContact O-CG 3.44Å; V499-L503 PolarHBondContact O-N 2.8Å; S500-L503 PolarHBondContact O-N 3.03Å
504	A	72.7	Confident	80	Confident	14 Å²	14	33.9 Å²	33.9	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-72.4	-29	173.7	0	0	0	0	0	113.2	P165 S500 H501 F502 L539 A554	P165-A504 WeakPolarHBondContact CD-O 3.4Å; P165-A504 HydrophobicContact CG-CB 4.41Å; S500-A504 WeakPolarHBondContact O-CB 3.17Å; S500-A504 PolarHBondContact O-N 3.06Å; H501-A504 PolarHBondContact O-N 3.16Å; F502-A504 VanDerWaalsContact C-N 3.34Å; F502-A504 PolarHBondContact O-N 3.41Å; A504-L539 HydrophobicContact CB-CD1 4.08Å; A504-L539 HydrophobicContact CB-CD2 4.06Å; A504-A554 HydrophobicContact CB-CB 4.22Å
505	A	72.8	Confident	80.2	Confident	29 Å²	29	34.4 Å²	34.4	24%	0.24	19%	0.19	C	C	.	.	S	Bend	trans	-72	157.9	-177.7	0	0	0	0	0	113.5	H501 F502 H507	H501-A505 WeakPolarHBondContact O-CB 3.27Å; H501-A505 PolarHBondContact O-N 3.26Å; F502-A505 PolarHBondContact O-N 2.87Å; A505-H507 PolarHBondContact O-CD2 2.9Å; A505-H507 PolarHBondContact O-NE2 2.99Å
506	C	77.7	Confident	80.2	Confident	16 Å²	16	34.9 Å²	34.9	11%	0.108	19%	0.192	C	C	.	.			trans	-90	147.3	163.5	-180	0	0	0	0	108.9	L160 L398 W403	L160-C506 HydrophobicContact CD2-CB 3.71Å; L398-C506 HydrophobicContact CD2-CB 3.68Å; W403-C506 WeakPolarHBondContact CH2-O 3.41Å; W403-C506 HydrophobicContact CZ2-CB 3.75Å; W403-C506 VanDerWaalsContact CZ2-O 3.28Å; W403-C506 WeakPolarHBondContact CZ2-O 3.28Å
507	H	82.1	Confident	80.4	Confident	23 Å²	23	41 Å²	41	11%	0.106	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.6	-175.9	-60.8	-82	0	0	0	111.6	V158 V159 F502 A505 L512	V158-H507 CarbonylContact C-O 3.42Å; V158-H507 VanDerWaalsContact CA-O 3.24Å; V158-H507 WeakPolarHBondContact CA-O 3.39Å; V158-H507 WeakPolarHBondContact CB-O 3.46Å; V159-H507 HydrophobicContact CB-CB 4.4Å; V159-H507 PolarHBondContact N-O 2.98Å; V159-H507 PolarHBondContact O-N 2.74Å; F502-H507 AromaticContact CD2-CE1 3.35Å; F502-H507 WeakPolarHBondContact CD2-CE1 3.48Å; F502-H507 AromaticContact CD2-NE2 3.97Å; F502-H507 AromaticContact CE2-CE1 3.3Å; F502-H507 WeakPolarHBondContact CE2-CE1 3.27Å; F502-H507 AromaticContact CE2-ND1 3.77Å; F502-H507 AromaticContact CE2-NE2 3.91Å; F502-H507 AromaticContact CG-CE1 3.87Å; F502-H507 AromaticContact CZ-CE1 3.8Å; F502-H507 AromaticContact CZ-NE2 3.96Å; F502-H507 PolarHBondContact O-CE1 3.42Å; F502-H507 PolarHBondContact O-NE2 3.45Å; A505-H507 PolarHBondContact O-CD2 2.9Å; A505-H507 PolarHBondContact O-NE2 2.99Å; H507-L512 HydrophobicContact CB-CD1 3.65Å; H507-L512 HydrophobicContact CB-CG 4.1Å
508	P	82.3	Confident	80.8	Confident	50 Å²	50	41.8 Å²	41.8	33%	0.325	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	137.1	167.8	29.8	-32.5	0	0	0	109.2	W403 Q510 G511	W403-P508 HydrophobicContact CZ3-CB 4.2Å; P508-Q510 PolarHBondContact O-N 3.24Å; P508-Q510 VanDerWaalsContact O-N 3.17Å; P508-G511 PolarHBondContact O-N 2.65Å
509	V	82.4	Confident	80.9	Confident	18 Å²	18	41 Å²	41	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	-53	-39.8	176.6	160.1	0	0	0	0	111.4	Q104 S157 V159 G511 L512 T513 I516	Q104-V509 HydrophobicContact CG-CG2 3.75Å; S157-V509 WeakPolarHBondContact O-CB 3.43Å; S157-V509 WeakPolarHBondContact O-CG2 3.25Å; S157-V509 PolarHBondContact O-N 3.47Å; S157-V509 VanDerWaalsContact O-N 3.08Å; V159-V509 HydrophobicContact CG2-CB 4.45Å; V159-V509 HydrophobicContact CG2-CG2 3.7Å; V509-G511 PolarHBondContact O-N 3.45Å; V509-L512 CarbonylContact O-C 3.56Å; V509-L512 PolarHBondContact O-N 3.07Å; V509-T513 PolarHBondContact O-N 2.83Å; V509-T513 PolarHBondContact O-OG1 3.13Å; V509-T513 VanDerWaalsContact O-OG1 3.04Å; V509-I516 HydrophobicContact CB-CD1 4.41Å; V509-I516 HydrophobicContact CG1-CD1 3.93Å; V509-I516 HydrophobicContact CG2-CD1 4.28Å
510	Q	79.3	Confident	80.9	Confident	118 Å²	118	44.6 Å²	44.6	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-51.9	-42.2	178.6	-62.4	78.8	4.8	0	0	111.9	P508 L512 T513	P508-Q510 PolarHBondContact O-N 3.24Å; P508-Q510 VanDerWaalsContact O-N 3.17Å; Q510-L512 VanDerWaalsContact C-N 3.33Å; Q510-L512 PolarHBondContact O-N 2.85Å; Q510-T513 VanDerWaalsContact CA-OG1 3.29Å; Q510-T513 WeakPolarHBondContact CA-OG1 3.5Å; Q510-T513 PolarHBondContact O-OG1 3.02Å
511	G	78.9	Confident	81.1	Confident	58 Å²	58	49.4 Å²	49.4	60%	0.598	26%	0.263	S	S	*	.	H	α-helix	trans	-71.6	-21.9	-178.2	0	0	0	0	0	114.8	P508 V509	P508-G511 PolarHBondContact O-N 2.65Å; V509-G511 PolarHBondContact O-N 3.45Å
512	L	85	Confident	81.2	Confident	13 Å²	13	49.2 Å²	49.2	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-116.2	4.4	-179.4	-56.4	-177	0	0	0	113.7	V159 F502 H507 V509 Q510 Y514 I515 I516	V159-L512 HydrophobicContact CB-CD1 4.05Å; V159-L512 HydrophobicContact CG1-CD1 4.04Å; V159-L512 HydrophobicContact CG2-CB 4.49Å; V159-L512 HydrophobicContact CG2-CD1 4.31Å; F502-L512 HydrophobicContact CE2-CD2 4.41Å; F502-L512 HydrophobicContact CZ-CD1 4.44Å; F502-L512 HydrophobicContact CZ-CD2 3.86Å; H507-L512 HydrophobicContact CB-CD1 3.65Å; H507-L512 HydrophobicContact CB-CG 4.1Å; V509-L512 CarbonylContact O-C 3.56Å; V509-L512 PolarHBondContact O-N 3.07Å; Q510-L512 VanDerWaalsContact C-N 3.33Å; Q510-L512 PolarHBondContact O-N 2.85Å; L512-Y514 VanDerWaalsContact C-N 3.25Å; L512-Y514 PolarHBondContact O-N 2.66Å; L512-I515 HydrophobicContact CD2-CD1 4.18Å; L512-I515 WeakPolarHBondContact O-CA 3.3Å; L512-I515 WeakPolarHBondContact O-CB 3.5Å; L512-I515 PolarHBondContact O-N 3.13Å; L512-I516 HydrophobicContact CB-CD1 4.38Å; L512-I516 HydrophobicContact CB-CG1 4.33Å; L512-I516 WeakPolarHBondContact O-CG1 3.2Å; L512-I516 PolarHBondContact O-N 3.39Å
513	T	83.5	Confident	80.5	Confident	75 Å²	75	50.5 Å²	50.5	46%	0.46	27%	0.274	S	S	.	.	H	α-helix	trans	-43.1	-45.8	-173.9	-47.2	0	0	0	0	114.2	V509 Q510 K517	V509-T513 PolarHBondContact O-N 2.83Å; V509-T513 PolarHBondContact O-OG1 3.13Å; V509-T513 VanDerWaalsContact O-OG1 3.04Å; Q510-T513 VanDerWaalsContact CA-OG1 3.29Å; Q510-T513 WeakPolarHBondContact CA-OG1 3.5Å; Q510-T513 PolarHBondContact O-OG1 3.02Å; T513-K517 WeakPolarHBondContact O-CB 3.03Å; T513-K517 PolarHBondContact O-N 2.95Å
514	Y	84.2	Confident	79.6	Confident	140 Å²	140	57 Å²	57	55%	0.549	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-42.7	179.5	174.5	-95.2	0	0	0	112.7	M471 L512 H518	M471-Y514 HydrophobicContact CE-CE1 3.81Å; M471-Y514 HydrophobicContact CG-CE1 4.48Å; M471-Y514 HydrophobicContact SD-CE1 3.68Å; L512-Y514 VanDerWaalsContact C-N 3.25Å; L512-Y514 PolarHBondContact O-N 2.66Å; Y514-H518 VanDerWaalsContact O-CB 3.3Å; Y514-H518 WeakPolarHBondContact O-CB 3.45Å; Y514-H518 PolarHBondContact O-N 2.83Å
515	I	86.9	Confident	79	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.062	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-44.5	-179.4	-58.6	170.9	0	0	0	109.7	L102 L437 V466 L512 K517 H518 L519	L102-I515 HydrophobicContact CD1-CG2 3.78Å; L437-I515 HydrophobicContact CD2-CG2 3.7Å; V466-I515 HydrophobicContact CB-CD1 3.88Å; V466-I515 HydrophobicContact CG1-CD1 3.75Å; L512-I515 HydrophobicContact CD2-CD1 4.18Å; L512-I515 WeakPolarHBondContact O-CA 3.3Å; L512-I515 WeakPolarHBondContact O-CB 3.5Å; L512-I515 PolarHBondContact O-N 3.13Å; I515-K517 PolarHBondContact O-N 3.03Å; I515-H518 PolarHBondContact O-N 3.44Å; I515-L519 HydrophobicContact CG2-CD1 4.21Å; I515-L519 HydrophobicContact CG2-CG 4.38Å; I515-L519 WeakPolarHBondContact O-CG 3.48Å; I515-L519 PolarHBondContact O-N 3.33Å
516	I	85.6	Confident	78.7	Confident	10 Å²	10	58.5 Å²	58.5	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-55.8	-53.9	176.1	-57.4	166.5	0	0	0	109.7	V159 V509 L512 H518 L519 E520	V159-I516 HydrophobicContact CG2-CD1 3.58Å; V159-I516 HydrophobicContact CG2-CG1 4.25Å; V509-I516 HydrophobicContact CB-CD1 4.41Å; V509-I516 HydrophobicContact CG1-CD1 3.93Å; V509-I516 HydrophobicContact CG2-CD1 4.28Å; L512-I516 HydrophobicContact CB-CD1 4.38Å; L512-I516 HydrophobicContact CB-CG1 4.33Å; L512-I516 WeakPolarHBondContact O-CG1 3.2Å; L512-I516 PolarHBondContact O-N 3.39Å; I516-H518 PolarHBondContact O-N 2.68Å; I516-L519 PolarHBondContact O-N 3.09Å; I516-E520 WeakPolarHBondContact O-CB 3.31Å; I516-E520 PolarHBondContact O-N 3.05Å
517	K	84.8	Confident	78.1	Confident	129 Å²	129	62.7 Å²	62.7	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-58.8	-45.9	-179.5	178.6	173.7	177.8	178.5	0	111.9	T513 I515 L519 E520 D521	T513-K517 WeakPolarHBondContact O-CB 3.03Å; T513-K517 PolarHBondContact O-N 2.95Å; I515-K517 PolarHBondContact O-N 3.03Å; K517-L519 PolarHBondContact O-N 2.81Å; K517-E520 CarbonylContact O-C 3.49Å; K517-E520 WeakPolarHBondContact O-CB 3.27Å; K517-E520 PolarHBondContact O-N 3.19Å; K517-D521 VanDerWaalsContact O-CG 3.25Å; K517-D521 PolarHBondContact O-N 2.96Å
518	H	83.4	Confident	77.2	Confident	28 Å²	28	64.8 Å²	64.8	13%	0.13	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-34.5	-178.4	173.4	66.6	0	0	0	112.9	T468 D470 Y514 I515 I516 D521 I522	T468-H518 WeakPolarHBondContact CB-NE2 3.48Å; T468-H518 VanDerWaalsContact CG2-CD2 3.47Å; T468-H518 WeakPolarHBondContact CG2-CD2 3.33Å; T468-H518 PolarHBondContact OG1-CD2 3.48Å; T468-H518 PolarHBondContact OG1-NE2 2.82Å; D470-H518 IonicContact OD2-CE1 2.92Å; Y514-H518 VanDerWaalsContact O-CB 3.3Å; Y514-H518 WeakPolarHBondContact O-CB 3.45Å; Y514-H518 PolarHBondContact O-N 2.83Å; I515-H518 PolarHBondContact O-N 3.44Å; I516-H518 PolarHBondContact O-N 2.68Å; H518-D521 PolarHBondContact O-N 3.09Å; H518-I522 WeakPolarHBondContact CE1-CD1 3.38Å; H518-I522 WeakPolarHBondContact O-CG1 3.39Å; H518-I522 PolarHBondContact O-N 2.9Å
519	L	82.9	Confident	76.2	Confident	6 Å²	6	63 Å²	63	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-73.1	-29.9	172.1	-63.7	-174.4	0	0	0	112.3	L102 H433 T468 I515 I516 K517 T523	L102-L519 HydrophobicContact CD1-CD1 4.04Å; L102-L519 HydrophobicContact CG-CD1 4.31Å; H433-L519 HydrophobicContact CB-CB 3.93Å; T468-L519 HydrophobicContact CG2-CD2 4.19Å; I515-L519 HydrophobicContact CG2-CD1 4.21Å; I515-L519 HydrophobicContact CG2-CG 4.38Å; I515-L519 WeakPolarHBondContact O-CG 3.48Å; I515-L519 PolarHBondContact O-N 3.33Å; I516-L519 PolarHBondContact O-N 3.09Å; K517-L519 PolarHBondContact O-N 2.81Å; L519-T523 PolarHBondContact O-N 2.88Å; L519-T523 PolarHBondContact O-OG1 2.9Å
520	E	82.4	Confident	75.2	Confident	75 Å²	75	64.3 Å²	64.3	35%	0.35	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-42.4	169.4	-176.2	165	-131.6	0	0	112.4	H433 I516 K517 I522 H524 S525	H433-E520 IonicContact CE1-OE1 3.98Å; I516-E520 WeakPolarHBondContact O-CB 3.31Å; I516-E520 PolarHBondContact O-N 3.05Å; K517-E520 CarbonylContact O-C 3.49Å; K517-E520 WeakPolarHBondContact O-CB 3.27Å; K517-E520 PolarHBondContact O-N 3.19Å; E520-I522 VanDerWaalsContact C-N 3.27Å; E520-I522 PolarHBondContact O-N 3.2Å; E520-H524 WeakPolarHBondContact O-CA 3.35Å; E520-H524 PolarHBondContact O-N 3.04Å; E520-H524 PolarHBondContact O-ND1 2.97Å; E520-S525 PolarHBondContact OE1-OG 2.83Å
521	D	79.3	Confident	73.8	Confident	102 Å²	102	64.4 Å²	64.4	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-61	-34.7	175.8	-69	-34.3	0	0	0	111.5	K517 H518	K517-D521 VanDerWaalsContact O-CG 3.25Å; K517-D521 PolarHBondContact O-N 2.96Å; H518-D521 PolarHBondContact O-N 3.09Å
522	I	75	Confident	72.3	Confident	88 Å²	88	65.6 Å²	65.6	45%	0.451	35%	0.348	S	S	.	.	H	α-helix	trans	-90.9	-47.9	-177.8	-67.4	176.2	0	0	0	113.9	H518 E520	H518-I522 WeakPolarHBondContact CE1-CD1 3.38Å; H518-I522 WeakPolarHBondContact O-CG1 3.39Å; H518-I522 PolarHBondContact O-N 2.9Å; E520-I522 VanDerWaalsContact C-N 3.27Å; E520-I522 PolarHBondContact O-N 3.2Å
523	T	67.2	Low	70.6	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-102.2	-13.4	-171.6	61.6	0	0	0	0	114.2	H434 L519	H434-T523 HydrophobicContact CB-CG2 4.45Å; H434-T523 PolarHBondContact N-OG1 3.37Å; H434-T523 WeakPolarHBondContact O-CG2 3.33Å; H434-T523 PolarHBondContact O-OG1 2.92Å; L519-T523 PolarHBondContact O-N 2.88Å; L519-T523 PolarHBondContact O-OG1 2.9Å
524	H	62.8	Low	68.7	Low	136 Å²	136	68.4 Å²	68.4	63%	0.63	36%	0.361	S	S	*	.			trans	59.2	151.1	-163	-54.9	-28.5	0	0	0	113.2	E520 S526	E520-H524 WeakPolarHBondContact O-CA 3.35Å; E520-H524 PolarHBondContact O-N 3.04Å; E520-H524 PolarHBondContact O-ND1 2.97Å; H524-S526 PolarHBondContact O-N 2.98Å
525	S	61.5	Low	66.7	Low	53 Å²	53	61.8 Å²	61.8	37%	0.371	34%	0.335	S	S	.	.			trans	-65.3	118.7	176.8	23.2	0	0	0	0	109.8	E520	E520-S525 PolarHBondContact OE1-OG 2.83Å
526	S	65	Low	64.5	Low	22 Å²	22	63.1 Å²	63.1	15%	0.154	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-92.9	133.8	-175.1	63.9	0	0	0	0	111.4	C432 H434 H524 T528	C432-S526 PolarHBondContact N-O 3.21Å; C432-S526 PolarHBondContact O-N 2.97Å; C432-S526 PolarHBondContact O-OG 3.39Å; C432-S526 VanDerWaalsContact O-OG 3.13Å; C432-S526 PolarHBondContact SG-O 3.16Å; C432-S526 VanDerWaalsContact SG-O 3.34Å; C432-S526 PolarHBondContact SG-OG 2.88Å; H434-S526 PolarHBondContact NE2-OG 3.08Å; H524-S526 PolarHBondContact O-N 2.98Å; S526-T528 WeakPolarHBondContact CB-O 3.38Å; S526-T528 PolarHBondContact O-N 3.04Å; S526-T528 PolarHBondContact OG-O 3.41Å
527	N	66	Low	62.4	Low	103 Å²	103	67.9 Å²	67.9	55%	0.551	36%	0.361	S	S	*	.	S	Bend	trans	-83.9	4	175.5	-69.3	-29.8	0	0	0	113	R387 L388	R387-N527 VanDerWaalsContact CA-O 3.24Å; R387-N527 WeakPolarHBondContact CA-O 3.47Å; R387-N527 WeakPolarHBondContact CB-O 3.42Å; L388-N527 PolarHBondContact N-O 2.82Å
528	T	63.1	Low	60.4	Low	67 Å²	67	61.8 Å²	61.8	41%	0.411	34%	0.335	S	S	.	.	S	Bend	trans	-144.9	140.7	-178.8	44.2	0	0	0	0	108.3	R387 S526	R387-T528 HydrophobicContact CG-CG2 3.68Å; S526-T528 WeakPolarHBondContact CB-O 3.38Å; S526-T528 PolarHBondContact O-N 3.04Å; S526-T528 PolarHBondContact OG-O 3.41Å
529	G	62	Low	58.4	Low	13 Å²	13	60.7 Å²	60.7	13%	0.134	33%	0.33	C	S	.	.			trans	-63.1	172	170.3	0	0	0	0	0	113.9	L383	L383-G529 WeakPolarHBondContact O-CA 3.22Å; L383-G529 PolarHBondContact O-N 3.42Å
530	P	60.6	Low	56.5	Low	46 Å²	46	60.7 Å²	60.7	30%	0.299	33%	0.331	S	S	.	.			trans	-67.9	157.8	173.4	33.6	-35.1	0	0	0	110.2	Y532	P530-Y532 PolarHBondContact O-N 3.38Å
531	S	50.4	Low	54.6	Low	120 Å²	120	58.6 Å²	58.6	84%	0.839	32%	0.324	S	S	*	.	S	Bend	trans	-71.2	77	173.5	57.7	0	0	0	0	111.6
532	Y	46.8	Very low	52.9	Low	82 Å²	82	56.7 Å²	56.7	32%	0.322	31%	0.313	S	S	.	.			trans	47	79.2	153.6	-154.3	-121.3	0	0	0	116.5	L380 P530 P534 T565	L380-Y532 HydrophobicContact CD2-CD2 4.45Å; L380-Y532 HydrophobicContact CG-CD2 4.48Å; P530-Y532 PolarHBondContact O-N 3.38Å; Y532-P534 HydrophobicContact CD1-CG 4.16Å; Y532-P534 HydrophobicContact CE1-CG 4.18Å; Y532-P534 WeakPolarHBondContact O-CD 3.14Å; Y532-T565 HydrophobicContact CE1-CG2 3.8Å; Y532-T565 HydrophobicContact CE2-CG2 3.84Å; Y532-T565 VanDerWaalsContact OH-CA 3.24Å; Y532-T565 WeakPolarHBondContact OH-CA 3.21Å; Y532-T565 VanDerWaalsContact OH-CB 3.31Å; Y532-T565 WeakPolarHBondContact OH-CB 2.99Å; Y532-T565 WeakPolarHBondContact OH-CG2 3.11Å
533	I	49.3	Very low	51.5	Low	120 Å²	120	53.8 Å²	53.8	62%	0.615	30%	0.3	S	S	*	.			trans	-103.2	107.8	156.6	-59.3	-178.4	0	0	0	107.5	Y64 L535	Y64-I533 HydrophobicContact CE2-CG2 4.09Å; I533-L535 PolarHBondContact O-N 2.98Å
534	P	43.6	Very low	50.4	Low	28 Å²	28	55.8 Å²	55.8	18%	0.182	32%	0.316	C	S	.	.			trans	-67.7	128.5	-179.8	-22.9	35.5	0	0	0	112.3	Y532 T536 T565	Y532-P534 HydrophobicContact CD1-CG 4.16Å; Y532-P534 HydrophobicContact CE1-CG 4.18Å; Y532-P534 WeakPolarHBondContact O-CD 3.14Å; P534-T536 VanDerWaalsContact C-N 3.33Å; P534-T536 HydrophobicContact CB-CG2 4Å; P534-T536 PolarHBondContact O-N 2.63Å; P534-T565 HydrophobicContact CB-CG2 3.58Å; P534-T565 VanDerWaalsContact CB-OG1 3.29Å; P534-T565 WeakPolarHBondContact CB-OG1 3.13Å; P534-T565 HydrophobicContact CG-CG2 3.53Å; P534-T565 WeakPolarHBondContact CG-OG1 3.29Å
535	L	42.3	Very low	49.5	Very low	1 Å²	1	56.6 Å²	56.6	1%	0.005	31%	0.313	C	S	.	.			trans	-69.1	90.7	164.4	-73.8	156.3	0	0	0	108.5	Y64 S162 C163 I533 R537 T538 I558	Y64-L535 HydrophobicContact CD1-CD2 3.72Å; Y64-L535 HydrophobicContact CD2-CD2 4.09Å; Y64-L535 HydrophobicContact CE1-CD2 3.34Å; Y64-L535 HydrophobicContact CE1-CG 4.49Å; Y64-L535 HydrophobicContact CE2-CD2 3.71Å; Y64-L535 HydrophobicContact CE2-CG 4.14Å; Y64-L535 HydrophobicContact CG-CD2 4.1Å; S162-L535 WeakPolarHBondContact O-CD1 3.38Å; C163-L535 HydrophobicContact CB-CD1 4.16Å; C163-L535 VanDerWaalsContact SG-CD2 3.55Å; I533-L535 PolarHBondContact O-N 2.98Å; L535-R537 PolarHBondContact O-N 3.13Å; L535-T538 HydrophobicContact CB-CG2 4.31Å; L535-T538 HydrophobicContact CD2-CG2 3.67Å; L535-I558 HydrophobicContact CB-CG2 3.57Å; L535-I558 WeakPolarHBondContact O-CG2 3.29Å
536	T	41.4	Very low	48.6	Very low	39 Å²	39	54.7 Å²	54.7	24%	0.239	30%	0.298	C	S	.	.			trans	-76.5	-21.2	-164.6	51.5	0	0	0	0	115.2	P534 A562	P534-T536 VanDerWaalsContact C-N 3.33Å; P534-T536 HydrophobicContact CB-CG2 4Å; P534-T536 PolarHBondContact O-N 2.63Å; T536-A562 HydrophobicContact CG2-CB 4.19Å; T536-A562 WeakPolarHBondContact O-CB 3.38Å
537	R	40	Very low	47.5	Very low	111 Å²	111	60.4 Å²	60.4	42%	0.419	33%	0.327	S	S	.	.	S	Bend	trans	-149.5	6.4	-168.1	-65.6	-172.5	175.2	135.7	5.5	115.9	S62 L535 L539	S62-R537 PolarHBondContact O-NH1 2.98Å; S62-R537 VanDerWaalsContact O-NH1 3.07Å; L535-R537 PolarHBondContact O-N 3.13Å; R537-L539 PolarHBondContact O-N 3.39Å
538	T	42.8	Very low	46.3	Very low	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.314	C	S	.	.			trans	-83.3	122.6	-150.4	75.8	0	0	0	0	116.8	Y64 V66 D67 L535 I558	Y64-T538 VanDerWaalsContact CB-CG2 3.41Å; Y64-T538 HydrophobicContact CD1-CG2 3.74Å; Y64-T538 HydrophobicContact CD2-CG2 4.29Å; Y64-T538 HydrophobicContact CG-CG2 3.55Å; V66-T538 HydrophobicContact CB-CG2 4.13Å; D67-T538 WeakPolarHBondContact OD1-CA 3.11Å; D67-T538 WeakPolarHBondContact OD1-CB 3.27Å; L535-T538 HydrophobicContact CB-CG2 4.31Å; L535-T538 HydrophobicContact CD2-CG2 3.67Å; T538-I558 WeakPolarHBondContact O-CD1 3.43Å
539	L	41.5	Very low	45.2	Very low	6 Å²	6	60.2 Å²	60.2	3%	0.031	32%	0.324	C	S	.	.	S	Bend		-159.7	67.3	124.3	-72.5	-159.4	0	0	0	109.7	S500 A504 R537 I551 A554 I555 I558	S500-L539 PolarHBondContact OG-O 3.23Å; A504-L539 HydrophobicContact CB-CD1 4.08Å; A504-L539 HydrophobicContact CB-CD2 4.06Å; R537-L539 PolarHBondContact O-N 3.39Å; L539-I551 HydrophobicContact CB-CG2 3.84Å; L539-I551 HydrophobicContact CD1-CG2 3.92Å; L539-A554 HydrophobicContact CD1-CB 3.36Å; L539-A554 HydrophobicContact CG-CB 3.97Å; L539-I555 HydrophobicContact CB-CD1 4.13Å; L539-I555 HydrophobicContact CB-CG1 3.52Å; L539-I555 HydrophobicContact CG-CG1 3.98Å; L539-I558 HydrophobicContact CD2-CD1 3.93Å; L539-I558 HydrophobicContact CG-CD1 4.43Å
540	G	43.2	Very low	44.1	Very low	5 Å²	5	62.3 Å²	62.3	5%	0.052	34%	0.34	C	S	.	.	S	Bend	trans	76.1	-174.3	174.1	0	0	0	0	0	113.5	V66 D67 I542	V66-G540 WeakPolarHBondContact O-CA 3.48Å; D67-G540 PolarHBondContact OD1-N 3.36Å; G540-I542 PolarHBondContact O-N 2.93Å
541	P	42.4	Very low	43.3	Very low	31 Å²	31	60.7 Å²	60.7	20%	0.201	33%	0.329	C	S	.	.			trans	-69.2	119.8	178.6	26.8	-32.7	0	0	0	110.8	E493 T543	E493-P541 HydrophobicContact CB-CG 4.47Å; E493-P541 HydrophobicContact CG-CG 4.05Å; P541-T543 VanDerWaalsContact C-N 3.35Å; P541-T543 HydrophobicContact CB-CG2 4.29Å; P541-T543 PolarHBondContact O-N 3.09Å
542	I	44.3	Very low	42.9	Very low	62 Å²	62	55.7 Å²	55.7	32%	0.318	29%	0.292	S	S	.	.			trans	-66.6	92.8	172.4	-55.4	175.6	0	0	0	108.5	K296 L314 G540 I555	K296-I542 HydrophobicContact CB-CD1 4.24Å; L314-I542 HydrophobicContact CD1-CD1 4.27Å; G540-I542 PolarHBondContact O-N 2.93Å; I542-I555 HydrophobicContact CD1-CD1 4.33Å; I542-I555 HydrophobicContact CG1-CD1 3.93Å
543	T	45.4	Very low	42.7	Very low	28 Å²	28	53.6 Å²	53.6	17%	0.172	29%	0.29	C	S	.	.			trans	-107.4	144.3	172.3	67.5	0	0	0	0	110	E493 P541 R545 F546	E493-T543 HydrophobicContact CG-CG2 4.48Å; P541-T543 VanDerWaalsContact C-N 3.35Å; P541-T543 HydrophobicContact CB-CG2 4.29Å; P541-T543 PolarHBondContact O-N 3.09Å; T543-R545 PolarHBondContact O-N 2.79Å; T543-F546 VanDerWaalsContact OG1-CD2 3.27Å; T543-F546 WeakPolarHBondContact OG1-CD2 3.49Å; T543-F546 WeakPolarHBondContact OG1-CE2 3.31Å
544	S	44.4	Very low	42.5	Very low	98 Å²	98	48.1 Å²	48.1	69%	0.685	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	4.9	175.7	52.3	0	0	0	0	114.1
545	R	43.3	Very low	42.6	Very low	154 Å²	154	47 Å²	47	58%	0.581	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-12	-168.4	-67.8	176.3	167.6	177.3	-5.4	114.4	E493 T543	E493-R545 IonicContact OE2-NH1 3.43Å; T543-R545 PolarHBondContact O-N 2.79Å
546	F	42.5	Very low	42.8	Very low	13 Å²	13	47.3 Å²	47.3	6%	0.057	26%	0.257	C	S	.	.	S	Bend	trans	-121	132.8	-176.5	-56.4	-69.2	0	0	0	111.6	Y451 I494 F497 T543 T548	Y451-F546 HydrophobicContact CD2-CD1 4.32Å; I494-F546 HydrophobicContact CD1-CZ 4.45Å; I494-F546 HydrophobicContact CG1-CE1 3.75Å; I494-F546 HydrophobicContact CG1-CZ 3.51Å; F497-F546 HydrophobicContact CD2-CB 4.17Å; F497-F546 AromaticContact CD2-CD2 3.84Å; F497-F546 HydrophobicContact CD2-CD2 3.84Å; F497-F546 HydrophobicContact CD2-CG 4.05Å; F497-F546 HydrophobicContact CE2-CB 3.36Å; F497-F546 AromaticContact CE2-CD2 3.92Å; F497-F546 HydrophobicContact CE2-CD2 3.92Å; F497-F546 AromaticContact CE2-CG 3.72Å; F497-F546 HydrophobicContact CE2-CG 3.72Å; F497-F546 HydrophobicContact CG-CD2 4.49Å; F497-F546 HydrophobicContact CZ-CB 3.62Å; F497-F546 HydrophobicContact CZ-CG 4.05Å; T543-F546 VanDerWaalsContact OG1-CD2 3.27Å; T543-F546 WeakPolarHBondContact OG1-CD2 3.49Å; T543-F546 WeakPolarHBondContact OG1-CE2 3.31Å; F546-T548 WeakPolarHBondContact O-CA 3.38Å; F546-T548 PolarHBondContact O-N 3.08Å; F546-T548 PolarHBondContact O-OG1 3.02Å
547	N	41.3	Very low	43.1	Very low	141 Å²	141	45.6 Å²	45.6	75%	0.754	25%	0.246	S	C	*	.			trans	-61.1	111.7	-179.6	-87.2	-30.4	0	0	0	110.4	I549 I551	N547-I549 VanDerWaalsContact C-N 3.32Å; N547-I549 PolarHBondContact O-N 3.19Å; N547-I549 VanDerWaalsContact O-N 3.16Å; N547-I551 WeakPolarHBondContact O-CD1 3.23Å
548	T	41.9	Very low	43.3	Very low	46 Å²	46	40.3 Å²	40.3	28%	0.282	23%	0.226	S	C	.	.			trans	-89.7	7.3	-143.6	-19.4	0	0	0	0	114.1	F546 A550 I551 Q552	F546-T548 WeakPolarHBondContact O-CA 3.38Å; F546-T548 PolarHBondContact O-N 3.08Å; F546-T548 PolarHBondContact O-OG1 3.02Å; T548-A550 PolarHBondContact O-N 3.22Å; T548-I551 PolarHBondContact O-N 3.4Å; T548-Q552 HydrophobicContact CG2-CB 4.27Å; T548-Q552 WeakPolarHBondContact O-CB 3.24Å; T548-Q552 PolarHBondContact O-N 3.34Å
549	I	40	Very low	43.5	Very low	121 Å²	121	40.5 Å²	40.5	62%	0.621	23%	0.228	S	C	*	.	H	α-helix	trans	-62.8	-54.4	-156	-60.5	178.1	0	0	0	113.3	R250 N547	R250-I549 PolarHBondContact NH1-O 3.17Å; N547-I549 VanDerWaalsContact C-N 3.32Å; N547-I549 PolarHBondContact O-N 3.19Å; N547-I549 VanDerWaalsContact O-N 3.16Å
550	A	38.8	Very low	44	Very low	56 Å²	56	40.2 Å²	40.2	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-68.7	-42.2	178.2	0	0	0	0	0	112	T548 S553 A554	T548-A550 PolarHBondContact O-N 3.22Å; A550-S553 WeakPolarHBondContact O-CB 3.4Å; A550-S553 PolarHBondContact O-N 3.29Å; A550-A554 PolarHBondContact O-N 3.45Å
551	I	42.5	Very low	44.3	Very low	13 Å²	13	40.3 Å²	40.3	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-48.7	-175.1	-46.5	95.7	0	0	0	110.7	F497 L539 N547 T548 S553 A554 I555	F497-I551 HydrophobicContact CD2-CG1 4.38Å; F497-I551 HydrophobicContact CE1-CD1 4.35Å; F497-I551 HydrophobicContact CE1-CG1 4.38Å; F497-I551 HydrophobicContact CE2-CB 4.49Å; F497-I551 HydrophobicContact CE2-CD1 3.6Å; F497-I551 HydrophobicContact CE2-CG1 3.53Å; F497-I551 HydrophobicContact CE2-CG2 4.49Å; F497-I551 HydrophobicContact CZ-CD1 3.31Å; F497-I551 HydrophobicContact CZ-CG1 3.55Å; L539-I551 HydrophobicContact CB-CG2 3.84Å; L539-I551 HydrophobicContact CD1-CG2 3.92Å; N547-I551 WeakPolarHBondContact O-CD1 3.23Å; T548-I551 PolarHBondContact O-N 3.4Å; I551-S553 VanDerWaalsContact C-N 3.27Å; I551-S553 PolarHBondContact O-N 2.95Å; I551-A554 PolarHBondContact O-N 3.46Å; I551-A554 VanDerWaalsContact O-N 3.08Å; I551-I555 HydrophobicContact CG2-CD1 3.9Å; I551-I555 HydrophobicContact CG2-CG1 4.21Å; I551-I555 WeakPolarHBondContact O-CG1 3.39Å; I551-I555 PolarHBondContact O-N 3.11Å
552	Q	44	Very low	44.4	Very low	14 Å²	14	39.2 Å²	39.2	7%	0.065	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-33.3	-177.3	-150.9	72.3	1.2	0	0	112.4	A297 T548 S556	A297-Q552 WeakPolarHBondContact O-CG 3.47Å; A297-Q552 PolarHBondContact O-NE2 3.07Å; T548-Q552 HydrophobicContact CG2-CB 4.27Å; T548-Q552 WeakPolarHBondContact O-CB 3.24Å; T548-Q552 PolarHBondContact O-N 3.34Å; Q552-S556 WeakPolarHBondContact O-CB 3.46Å; Q552-S556 PolarHBondContact O-N 3.11Å; Q552-S556 PolarHBondContact O-OG 3.38Å
553	S	42.4	Very low	44.5	Very low	39 Å²	39	37.7 Å²	37.7	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-50.5	172.4	-173.8	0	0	0	0	110.8	A550 I551 S556 S557	A550-S553 WeakPolarHBondContact O-CB 3.4Å; A550-S553 PolarHBondContact O-N 3.29Å; I551-S553 VanDerWaalsContact C-N 3.27Å; I551-S553 PolarHBondContact O-N 2.95Å; S553-S556 WeakPolarHBondContact O-CB 3.4Å; S553-S556 PolarHBondContact O-N 3.02Å; S553-S556 VanDerWaalsContact O-N 3.16Å; S553-S557 PolarHBondContact O-N 2.96Å
554	A	45	Very low	44.6	Very low	4 Å²	4	37.6 Å²	37.6	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-72.3	-39.6	-174.4	0	0	0	0	0	113.9	P165 A504 L539 A550 I551 S556 S557 I558	P165-A554 VanDerWaalsContact CB-CA 3.46Å; P165-A554 HydrophobicContact CB-CB 3.51Å; P165-A554 HydrophobicContact CG-CB 3.76Å; A504-A554 HydrophobicContact CB-CB 4.22Å; L539-A554 HydrophobicContact CD1-CB 3.36Å; L539-A554 HydrophobicContact CG-CB 3.97Å; A550-A554 PolarHBondContact O-N 3.45Å; I551-A554 PolarHBondContact O-N 3.46Å; I551-A554 VanDerWaalsContact O-N 3.08Å; A554-S556 PolarHBondContact O-N 3.34Å; A554-S557 PolarHBondContact O-N 2.92Å; A554-I558 WeakPolarHBondContact O-CB 3.47Å; A554-I558 WeakPolarHBondContact O-CD1 3.43Å; A554-I558 VanDerWaalsContact O-CG1 3.24Å; A554-I558 WeakPolarHBondContact O-CG1 3.11Å; A554-I558 PolarHBondContact O-N 3.48Å
555	I	44	Very low	44.8	Very low	5 Å²	5	33.9 Å²	33.9	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-58.1	-39.8	169.2	-56.1	176	0	0	0	109.9	A297 L539 I542 I551 I558 A559	A297-I555 HydrophobicContact CB-CB 3.93Å; A297-I555 HydrophobicContact CB-CG2 3.59Å; L539-I555 HydrophobicContact CB-CD1 4.13Å; L539-I555 HydrophobicContact CB-CG1 3.52Å; L539-I555 HydrophobicContact CG-CG1 3.98Å; I542-I555 HydrophobicContact CD1-CD1 4.33Å; I542-I555 HydrophobicContact CG1-CD1 3.93Å; I551-I555 HydrophobicContact CG2-CD1 3.9Å; I551-I555 HydrophobicContact CG2-CG1 4.21Å; I551-I555 WeakPolarHBondContact O-CG1 3.39Å; I551-I555 PolarHBondContact O-N 3.11Å; I555-I558 PolarHBondContact O-N 2.99Å; I555-A559 WeakPolarHBondContact O-CB 3.43Å; I555-A559 PolarHBondContact O-N 3.21Å
556	S	47.9	Very low	44.7	Very low	8 Å²	8	33.5 Å²	33.5	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-48.1	-178.8	-61.4	0	0	0	0	111.9	A297 Q552 S553 A554 I558 A560	A297-S556 VanDerWaalsContact CB-CA 3.45Å; A297-S556 VanDerWaalsContact CB-OG 3.26Å; A297-S556 WeakPolarHBondContact CB-OG 3.18Å; A297-S556 PolarHBondContact O-OG 3.01Å; Q552-S556 WeakPolarHBondContact O-CB 3.46Å; Q552-S556 PolarHBondContact O-N 3.11Å; Q552-S556 PolarHBondContact O-OG 3.38Å; S553-S556 WeakPolarHBondContact O-CB 3.4Å; S553-S556 PolarHBondContact O-N 3.02Å; S553-S556 VanDerWaalsContact O-N 3.16Å; A554-S556 PolarHBondContact O-N 3.34Å; S556-I558 VanDerWaalsContact C-N 3.32Å; S556-I558 PolarHBondContact O-N 3.39Å; S556-A560 VanDerWaalsContact O-CB 3.32Å; S556-A560 WeakPolarHBondContact O-CB 3.37Å; S556-A560 PolarHBondContact O-N 2.7Å
557	S	48.2	Very low	44.5	Very low	2 Å²	2	36.1 Å²	36.1	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-42.1	173.8	-76.4	0	0	0	0	112.3	P165 W167 S553 A554 A560 I561	P165-S557 WeakPolarHBondContact O-CB 2.96Å; P165-S557 PolarHBondContact O-OG 3.44Å; W167-S557 PolarHBondContact NE1-OG 3.14Å; S553-S557 PolarHBondContact O-N 2.96Å; A554-S557 PolarHBondContact O-N 2.92Å; S557-A560 VanDerWaalsContact O-CB 3.3Å; S557-A560 WeakPolarHBondContact O-CB 3.22Å; S557-A560 PolarHBondContact O-N 3.37Å; S557-I561 WeakPolarHBondContact O-CG1 3.47Å; S557-I561 PolarHBondContact O-N 3.39Å
558	I	43.9	Very low	44	Very low	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.5	-43.8	-175.6	-70.6	165	0	0	0	111.1	C163 L535 T538 L539 A554 I555 S556 A560 I561 A562	C163-I558 WeakPolarHBondContact O-CD1 3.3Å; L535-I558 HydrophobicContact CB-CG2 3.57Å; L535-I558 WeakPolarHBondContact O-CG2 3.29Å; T538-I558 WeakPolarHBondContact O-CD1 3.43Å; L539-I558 HydrophobicContact CD2-CD1 3.93Å; L539-I558 HydrophobicContact CG-CD1 4.43Å; A554-I558 WeakPolarHBondContact O-CB 3.47Å; A554-I558 WeakPolarHBondContact O-CD1 3.43Å; A554-I558 VanDerWaalsContact O-CG1 3.24Å; A554-I558 WeakPolarHBondContact O-CG1 3.11Å; A554-I558 PolarHBondContact O-N 3.48Å; I555-I558 PolarHBondContact O-N 2.99Å; S556-I558 VanDerWaalsContact C-N 3.32Å; S556-I558 PolarHBondContact O-N 3.39Å; I558-A560 PolarHBondContact O-N 3.24Å; I558-I561 WeakPolarHBondContact O-CB 3.35Å; I558-I561 PolarHBondContact O-N 3.35Å; I558-I561 VanDerWaalsContact O-N 3.08Å; I558-A562 PolarHBondContact O-N 2.93Å
559	A	46.3	Very low	43.3	Very low	5 Å²	5	41.4 Å²	41.4	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-14	172.7	0	0	0	0	0	113	G294 I555 A562 S563	G294-A559 VanDerWaalsContact CA-CB 3.42Å; G294-A559 WeakPolarHBondContact CA-O 3.29Å; I555-A559 WeakPolarHBondContact O-CB 3.43Å; I555-A559 PolarHBondContact O-N 3.21Å; A559-A562 WeakPolarHBondContact O-CB 3.46Å; A559-S563 PolarHBondContact O-OG 3.08Å
560	A	51.5	Low	42.8	Very low	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-75.8	-46.4	164	0	0	0	0	0	112.8	W167 V254 V293 S556 S557 I558 A562 S563 L564	W167-A560 HydrophobicContact CZ2-CB 4Å; V254-A560 HydrophobicContact CB-CB 3.53Å; V254-A560 HydrophobicContact CG1-CB 4.48Å; V254-A560 HydrophobicContact CG2-CB 3.48Å; V254-A560 VanDerWaalsContact CG2-CB 3.48Å; V293-A560 HydrophobicContact CG1-CB 4.29Å; S556-A560 VanDerWaalsContact O-CB 3.32Å; S556-A560 WeakPolarHBondContact O-CB 3.37Å; S556-A560 PolarHBondContact O-N 2.7Å; S557-A560 VanDerWaalsContact O-CB 3.3Å; S557-A560 WeakPolarHBondContact O-CB 3.22Å; S557-A560 PolarHBondContact O-N 3.37Å; I558-A560 PolarHBondContact O-N 3.24Å; A560-A562 VanDerWaalsContact C-N 3.25Å; A560-A562 PolarHBondContact O-N 3.3Å; A560-S563 PolarHBondContact O-N 3.21Å; A560-S563 VanDerWaalsContact O-N 3.13Å; A560-L564 PolarHBondContact O-N 3.43Å
561	I	49.4	Very low	42	Very low	6 Å²	6	46.5 Å²	46.5	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-49.9	-53.2	170.5	-58.4	171.3	0	0	0	109	W167 S378 L380 S557 I558 S563 L564 T565	W167-I561 HydrophobicContact CH2-CG1 4.5Å; S378-I561 VanDerWaalsContact CB-CD1 3.42Å; S378-I561 VanDerWaalsContact CB-CG1 3.46Å; L380-I561 HydrophobicContact CD2-CG2 4.15Å; S557-I561 WeakPolarHBondContact O-CG1 3.47Å; S557-I561 PolarHBondContact O-N 3.39Å; I558-I561 WeakPolarHBondContact O-CB 3.35Å; I558-I561 PolarHBondContact O-N 3.35Å; I558-I561 VanDerWaalsContact O-N 3.08Å; I561-S563 PolarHBondContact O-N 3.05Å; I561-L564 WeakPolarHBondContact O-CB 3.35Å; I561-L564 PolarHBondContact O-N 3.35Å; I561-L564 VanDerWaalsContact O-N 3.08Å; I561-T565 HydrophobicContact CG2-CG2 4.17Å; I561-T565 WeakPolarHBondContact O-CG2 3.49Å; I561-T565 PolarHBondContact O-N 3.47Å
562	A	44.9	Very low	41.1	Very low	8 Å²	8	51.8 Å²	51.8	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-46.3	-28.1	178.8	0	0	0	0	0	116.7	T536 I558 A559 A560 T565 M566	T536-A562 HydrophobicContact CG2-CB 4.19Å; T536-A562 WeakPolarHBondContact O-CB 3.38Å; I558-A562 PolarHBondContact O-N 2.93Å; A559-A562 WeakPolarHBondContact O-CB 3.46Å; A560-A562 VanDerWaalsContact C-N 3.25Å; A560-A562 PolarHBondContact O-N 3.3Å; A562-T565 PolarHBondContact O-OG1 3.05Å; A562-M566 VanDerWaalsContact O-CG 3.23Å; A562-M566 WeakPolarHBondContact O-CG 3.31Å
563	S	47.2	Very low	40.1	Very low	31 Å²	31	57.9 Å²	57.9	22%	0.217	30%	0.302	C	S	.	.	H	α-helix	trans	-102.8	-23.4	-173.9	-51.6	0	0	0	0	111.9	V293 A559 A560 I561 T565	V293-S563 WeakPolarHBondContact CG1-OG 2.62Å; A559-S563 PolarHBondContact O-OG 3.08Å; A560-S563 PolarHBondContact O-N 3.21Å; A560-S563 VanDerWaalsContact O-N 3.13Å; I561-S563 PolarHBondContact O-N 3.05Å; S563-T565 PolarHBondContact O-N 3.25Å
564	L	46.2	Very low	39.2	Very low	25 Å²	25	59.3 Å²	59.3	13%	0.131	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-34	162	-57.5	170.8	0	0	0	110.1	W167 F205 V338 T340 A560 I561	W167-L564 HydrophobicContact CH2-CD1 4.06Å; W167-L564 HydrophobicContact CZ3-CD1 4.41Å; F205-L564 HydrophobicContact CB-CD2 4.28Å; F205-L564 HydrophobicContact CD1-CD2 4.41Å; F205-L564 HydrophobicContact CD2-CD2 3.52Å; F205-L564 HydrophobicContact CE2-CD2 3.81Å; F205-L564 HydrophobicContact CG-CD2 3.85Å; F205-L564 HydrophobicContact CZ-CD2 4.38Å; V338-L564 HydrophobicContact CG1-CD1 3.6Å; V338-L564 HydrophobicContact CG1-CD2 3.79Å; V338-L564 HydrophobicContact CG1-CG 4.34Å; T340-L564 HydrophobicContact CG2-CD2 4.14Å; A560-L564 PolarHBondContact O-N 3.43Å; I561-L564 WeakPolarHBondContact O-CB 3.35Å; I561-L564 PolarHBondContact O-N 3.35Å; I561-L564 VanDerWaalsContact O-N 3.08Å
565	T	49.8	Very low	38.2	Very low	21 Å²	21	59.5 Å²	59.5	13%	0.129	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.9	-174.7	77	0	0	0	0	114.7	Y532 P534 I561 A562 S563	Y532-T565 HydrophobicContact CE1-CG2 3.8Å; Y532-T565 HydrophobicContact CE2-CG2 3.84Å; Y532-T565 VanDerWaalsContact OH-CA 3.24Å; Y532-T565 WeakPolarHBondContact OH-CA 3.21Å; Y532-T565 VanDerWaalsContact OH-CB 3.31Å; Y532-T565 WeakPolarHBondContact OH-CB 2.99Å; Y532-T565 WeakPolarHBondContact OH-CG2 3.11Å; P534-T565 HydrophobicContact CB-CG2 3.58Å; P534-T565 VanDerWaalsContact CB-OG1 3.29Å; P534-T565 WeakPolarHBondContact CB-OG1 3.13Å; P534-T565 HydrophobicContact CG-CG2 3.53Å; P534-T565 WeakPolarHBondContact CG-OG1 3.29Å; I561-T565 HydrophobicContact CG2-CG2 4.17Å; I561-T565 WeakPolarHBondContact O-CG2 3.49Å; I561-T565 PolarHBondContact O-N 3.47Å; A562-T565 PolarHBondContact O-OG1 3.05Å; S563-T565 PolarHBondContact O-N 3.25Å
566	M	41.5	Very low	37.5	Very low	145 Å²	145	63.3 Å²	63.3	71%	0.714	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	6.4	-177.8	-61.1	-64.2	-61	0	0	112.7	A562	A562-M566 VanDerWaalsContact O-CG 3.23Å; A562-M566 WeakPolarHBondContact O-CG 3.31Å
567	H	38.2	Very low	36.5	Very low	69 Å²	69	63 Å²	63	32%	0.319	33%	0.329	S	S	.	.			trans	-124.6	47.1	-166.9	-105.1	-54.9	0	0	0	115.1	K204 F205 E569	K204-H567 PolarHBondContact NZ-O 3.37Å; F205-H567 HydrophobicContact CZ-CB 4.28Å; H567-E569 VanDerWaalsContact C-N 3.33Å
568	E	30	Very low	35.4	Very low	137 Å²	137	65.1 Å²	65.1	64%	0.64	34%	0.337	S	S	*	.			trans	-76.5	-15.7	164.6	-71.5	-161.4	120.6	0	0	113.7	T343	T343-E568 WeakPolarHBondContact CB-OE1 3.24Å; T343-E568 WeakPolarHBondContact CG2-OE1 3.36Å; T343-E568 PolarHBondContact OG1-OE1 3.42Å
569	E	28.2	Very low	34.5	Very low	161 Å²	161	69.5 Å²	69.5	75%	0.752	36%	0.357	S	S	*	.	S	Bend	trans	-96.7	147.8	-180	-67.1	-164.3	146.6	0	0	115.1	H567	H567-E569 VanDerWaalsContact C-N 3.33Å
570	L	28.8	Very low	33.6	Very low	143 Å²	143	71 Å²	71	75%	0.749	36%	0.364	S	S	*	.			trans	69	131	175.3	-106.9	66.3	0	0	0	119.1
571	N	22.7	Very low	32.6	Very low	140 Å²	140	71.8 Å²	71.8	75%	0.749	37%	0.368	S	S	*	.			trans	-100.9	-177.9	177.8	-63.4	-28.1	0	0	0	111.7
572	D	23.8	Very low	31.4	Very low	124 Å²	124	79.9 Å²	79.9	66%	0.663	41%	0.406	S	S	*	.			trans	65.9	87.5	149.3	-56.6	-32.5	0	0	0	118.9
573	I	22.7	Very low	30.5	Very low	143 Å²	143	81.3 Å²	81.3	73%	0.733	41%	0.412	S	S	*	.				169.9	144.2	97.1	-89.9	152	0	0	0	112.2
574	P	23.5	Very low	29.4	Very low	69 Å²	69	82.5 Å²	82.5	45%	0.448	41%	0.414	S	S	.	.			trans	-97.7	145	-174	37.3	-36.3	0	0	0	115.2	W199 K202	W199-P574 WeakPolarHBondContact CH2-O 3.1Å; K202-P574 HydrophobicContact CD-CB 3.67Å; K202-P574 HydrophobicContact CD-CG 4.03Å; K202-P574 HydrophobicContact CG-CB 4.13Å
575	N	24.6	Very low	28.4	Very low	7 Å²	7	85.9 Å²	85.9	4%	0.037	44%	0.44	C	S	.	.				75.2	0	59.6	-171.4	12.7	0	0	0	116.5	W199 K202 L257 D259	W199-N575 HydrophobicContact CD2-CB 4.2Å; W199-N575 HydrophobicContact CE3-CB 3.76Å; W199-N575 VanDerWaalsContact CE3-O 3.27Å; W199-N575 HydrophobicContact CH2-CB 4.5Å; W199-N575 WeakPolarHBondContact CH2-O 3.08Å; W199-N575 WeakPolarHBondContact CZ2-O 3.47Å; W199-N575 HydrophobicContact CZ3-CB 3.97Å; W199-N575 PolarHBondContact NE1-O 3.36Å; K202-N575 WeakPolarHBondContact CA-ND2 3.3Å; K202-N575 PolarHBondContact NZ-O 2.86Å; L257-N575 WeakPolarHBondContact CD2-ND2 3.19Å; L257-N575 VanDerWaalsContact CG-ND2 3.28Å; L257-N575 WeakPolarHBondContact CG-ND2 3.46Å; D259-N575 PolarHBondContact OD1-N 3.02Å
576	D	27.3	Very low	27.2	Very low	86 Å²	86	91.7 Å²	91.7	46%	0.46	46%	0.464	S	S	.	.				0	100.8	0	-144.9	93.4	0	0	0	109.9	W199 C260 Y578	W199-D576 HydrophobicContact CD2-CB 4.04Å; W199-D576 HydrophobicContact CH2-CB 4.03Å; W199-D576 HydrophobicContact CZ2-CB 3.25Å; W199-D576 PolarHBondContact NE1-OD1 3.13Å; C260-D576 VanDerWaalsContact CB-O 3.24Å; C260-D576 WeakPolarHBondContact CB-O 3.4Å; C260-D576 PolarHBondContact SG-O 2.68Å; D576-Y578 WeakPolarHBondContact OD2-CE2 3.42Å
577	S	27.4	Very low	26.4	Very low	1 Å²	1	88 Å²	88	1%	0.007	45%	0.446	C	S	.	.			trans	-135.3	139.3	-167.5	44.3	0	0	0	0	111.3	C260 L288 L328	C260-S577 VanDerWaalsContact CB-CB 3.5Å; C260-S577 WeakPolarHBondContact SG-CA 3.2Å; C260-S577 WeakPolarHBondContact SG-CB 3.43Å; L288-S577 WeakPolarHBondContact CD2-OG 3.24Å; L328-S577 WeakPolarHBondContact CB-O 3.41Å; L328-S577 VanDerWaalsContact CD1-CB 3.45Å; L328-S577 WeakPolarHBondContact CD1-O 3.48Å; L328-S577 WeakPolarHBondContact CD2-O 3.5Å; L328-S577 WeakPolarHBondContact CD2-OG 3.43Å; L328-S577 WeakPolarHBondContact CG-O 3.42Å
578	Y	25.4	Very low	25.8	Very low	46 Å²	46	91.1 Å²	91.1	18%	0.18	46%	0.464	C	S	.	.			trans	-160.4	117.2	-174	-78.6	-61.1	0	0	0	118.4	K196 S286 L328 D576	K196-Y578 VanDerWaalsContact CA-CE1 3.49Å; K196-Y578 WeakPolarHBondContact CA-OH 3.1Å; K196-Y578 HydrophobicContact CB-CE1 3.57Å; K196-Y578 HydrophobicContact CD-CD1 4.25Å; K196-Y578 HydrophobicContact CD-CE1 3.35Å; K196-Y578 VanDerWaalsContact CE-CZ 3.48Å; K196-Y578 WeakPolarHBondContact CE-OH 3.48Å; K196-Y578 HydrophobicContact CG-CE1 3.66Å; K196-Y578 WeakPolarHBondContact CG-OH 3.3Å; K196-Y578 PolarHBondContact NZ-OH 3.34Å; K196-Y578 PolarHBondContact O-OH 3.5Å; K196-Y578 VanDerWaalsContact O-OH 3.06Å; S286-Y578 VanDerWaalsContact CB-N 3.34Å; S286-Y578 WeakPolarHBondContact CB-O 3.45Å; S286-Y578 CarbonylContact O-C 3.47Å; S286-Y578 WeakPolarHBondContact O-CA 3.33Å; S286-Y578 PolarHBondContact O-N 3.36Å; S286-Y578 VanDerWaalsContact O-N 3.08Å; S286-Y578 VanDerWaalsContact O-O 3.09Å; L328-Y578 HydrophobicContact CB-CD1 3.75Å; L328-Y578 HydrophobicContact CB-CE1 3.95Å; L328-Y578 HydrophobicContact CD2-CE1 4.41Å; L328-Y578 WeakPolarHBondContact O-CD1 3.47Å; D576-Y578 WeakPolarHBondContact OD2-CE2 3.42Å
579	Q	26.3	Very low	25.6	Very low	93 Å²	93	90.6 Å²	90.6	44%	0.435	47%	0.466	S	S	.	.			trans	176.5	-5.2	155.5	-105.3	153.2	102.6	0	0	125.5	V285 S286 A329	V285-Q579 HydrophobicContact CG1-CB 3.38Å; V285-Q579 HydrophobicContact CG1-CG 4.1Å; S286-Q579 VanDerWaalsContact N-NE2 3.18Å; S286-Q579 PolarHBondContact O-N 3.46Å; A329-Q579 VanDerWaalsContact CB-O 3.23Å; A329-Q579 WeakPolarHBondContact CB-O 3.21Å; A329-Q579 VanDerWaalsContact N-N 3.14Å
580	L	26.3	Very low	25.4	Very low	36 Å²	36	90.7 Å²	90.7	19%	0.188	47%	0.466	C	S	.	.			trans	-141.4	141.6	-173	175.2	145.6	0	0	0	117.2	S327 S330 I583	S327-L580 CarbonylContact C-O 3.49Å; S327-L580 VanDerWaalsContact C-O 3.3Å; S327-L580 VanDerWaalsContact CB-CB 3.47Å; S327-L580 VanDerWaalsContact CB-N 3.32Å; S327-L580 WeakPolarHBondContact OG-CB 3.49Å; S330-L580 WeakPolarHBondContact CA-O 3.18Å; S330-L580 WeakPolarHBondContact CB-O 3.11Å; S330-L580 PolarHBondContact N-O 3.19Å; S330-L580 PolarHBondContact OG-O 3.34Å; L580-I583 HydrophobicContact CD1-CD1 4.24Å
581	N	30.4	Very low	25.2	Very low	16 Å²	16	90.8 Å²	90.8	9%	0.086	47%	0.466	C	S	.	.			trans	-169.2	86.6	131.4	-93.1	-51.5	0	0	0	105.5	S330 S332 I333	S330-N581 WeakPolarHBondContact CB-ND2 3.48Å; S330-N581 PolarHBondContact OG-ND2 2.86Å; S332-N581 WeakPolarHBondContact OG-CB 3.04Å; S332-N581 PolarHBondContact OG-OD1 2.95Å; I333-N581 PolarHBondContact N-ND2 2.57Å; I333-N581 VanDerWaalsContact N-ND2 3.12Å
582	E	25.1	Very low	25.4	Very low	177 Å²	177	89.9 Å²	89.9	83%	0.827	47%	0.466	S	S	*	.			trans	-146.8	39.8	-177.3	-159.9	159.4	-142.6	0	0	112
583	I	25.6	Very low	25.6	Very low	37 Å²	37	91 Å²	91	19%	0.19	47%	0.471	C	S	.	.			trans	-127.5	6.1	175.3	-38	-179	0	0	0	110.6	Q213 I246 L580 S585 K586	Q213-I583 VanDerWaalsContact CD-C 3.46Å; Q213-I583 PolarHBondContact NE2-O 3.39Å; Q213-I583 VanDerWaalsContact OE1-CA 3.28Å; Q213-I583 VanDerWaalsContact OE1-CB 3.31Å; Q213-I583 PolarHBondContact OE1-O 3.03Å; I246-I583 HydrophobicContact CD1-CD1 3.63Å; I246-I583 HydrophobicContact CD1-CG2 4.43Å; I246-I583 HydrophobicContact CG1-CD1 4.34Å; L580-I583 HydrophobicContact CD1-CD1 4.24Å; I583-S585 PolarHBondContact O-N 2.72Å; I583-K586 HydrophobicContact CG2-CB 4.08Å; I583-K586 HydrophobicContact CG2-CD 3.67Å; I583-K586 HydrophobicContact CG2-CG 3.72Å; I583-K586 PolarHBondContact O-N 2.87Å
584	Q	23.3	Very low	25.7	Very low	57 Å²	57	94.3 Å²	94.3	27%	0.266	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-10.2	-177.3	-161.5	169.9	74.5	0	0	112.1	D211 S332	D211-Q584 PolarHBondContact O-NE2 3.38Å; S332-Q584 PolarHBondContact O-NE2 3.3Å; S332-Q584 PolarHBondContact OG-NE2 3.47Å
585	S	25.6	Very low	25.7	Very low	95 Å²	95	98.6 Å²	98.6	66%	0.664	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.2	171.5	45.2	0	0	0	0	115.4	I583 I587	I583-S585 PolarHBondContact O-N 2.72Å; S585-I587 PolarHBondContact O-N 3.07Å
586	K	24.7	Very low	25.6	Very low	144 Å²	144	106.8 Å²	106.8	63%	0.626	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.4	178.2	-81.4	-164.1	177.6	-175.3	0	114.1	I583 L588	I583-K586 HydrophobicContact CG2-CB 4.08Å; I583-K586 HydrophobicContact CG2-CD 3.67Å; I583-K586 HydrophobicContact CG2-CG 3.72Å; I583-K586 PolarHBondContact O-N 2.87Å; K586-L588 PolarHBondContact O-N 2.71Å
587	I	24.7	Very low	25.5	Very low	66 Å²	66	109 Å²	109	34%	0.338	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-33	-173.9	-60.2	-179.4	0	0	0	112	I248 S585 N589	I248-I587 HydrophobicContact CD1-CD1 3.74Å; I248-I587 HydrophobicContact CD1-CG1 3.66Å; I248-I587 HydrophobicContact CG1-CD1 4.14Å; I248-I587 HydrophobicContact CG1-CG1 4.46Å; I248-I587 HydrophobicContact CG2-CD1 4.2Å; S585-I587 PolarHBondContact O-N 3.07Å; I587-N589 PolarHBondContact O-N 3.21Å
588	L	26.1	Very low	25.5	Very low	135 Å²	135	116.9 Å²	116.9	71%	0.707	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-73.8	-26.2	-168.8	-160.9	64.2	0	0	0	113.8	K586 H590	K586-L588 PolarHBondContact O-N 2.71Å; L588-H590 PolarHBondContact O-N 2.8Å
589	N	25	Very low	25.8	Very low	126 Å²	126	120.4 Å²	120.4	67%	0.674	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-80.8	-11.6	-173.6	-74.1	10.5	0	0	0	114.8	I587	I587-N589 PolarHBondContact O-N 3.21Å
590	H	24.3	Very low	25.8	Very low	163 Å²	163	123.9 Å²	123.9	76%	0.755	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-90.3	-9.1	-178.1	-94.5	-70.7	0	0	0	114.8	L588	L588-H590 PolarHBondContact O-N 2.8Å
591	L	24.9	Very low	25.7	Very low	145 Å²	145	127.8 Å²	127.8	76%	0.759	67%	0.666	S	S	*	*	S	Bend	trans	-90.3	-8.8	-175.2	-83.2	164.4	0	0	0	114.9
592	T	27.2	Very low	25.5	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	70%	0.702	S	S	*	*	S	Bend	trans	-98.7	-2.3	-172.9	40.5	0	0	0	0	115.4
593	L	26.3	Very low	25.5	Very low	148 Å²	148	132.2 Å²	132.2	78%	0.775	71%	0.706	S	S	*	*	S	Bend	trans	-103.4	6.2	-170.9	-97	166.5	0	0	0	116
594	Y	25.6	Very low	25.5	Very low	213 Å²	213	136.4 Å²	136.4	84%	0.835	73%	0.733	S	S	*	*	S	Bend	trans	-116	16	-167.2	-112.5	-76.9	0	0	0	116.6
595	N	22.7	Very low	25.5	Very low	159 Å²	159	139.9 Å²	139.9	85%	0.85	76%	0.758	S	S	*	*			trans	-132.9	88.7	178.9	-102	-21.6	0	0	0	112.4
596	H	23.7	Very low	25.4	Very low	179 Å²	179	141 Å²	141	83%	0.829	76%	0.761	S	S	*	*			trans	-151.9	156.5	162.6	-115.7	54.8	0	0	0	111.4
597	N	24.9	Very low	25.4	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	77%	0.768	S	S	*	*			trans	73.5	98	171.8	-50.7	-15.8	0	0	0	117.5
598	N	26.7	Very low	25.4	Very low	165 Å²	165	142.3 Å²	142.3	88%	0.882	79%	0.785	S	S	*	*				-180	120.8	109	-90.1	-20.4	0	0	0	112.7
599	P	32	Very low	25.3	Very low	120 Å²	120	142.3 Å²	142.3	78%	0.779	79%	0.785	S	S	*	*			trans	-113.7	135.7	172.4	36.8	-26.5	0	0	0	113.2
600	I	26.6	Very low	25.3	Very low	167 Å²	167	143.3 Å²	143.3	86%	0.856	80%	0.796	S	S	*	*			trans	-139.8	139.8	167.3	-61.5	-176.5	0	0	0	109.7
601	S	25.2	Very low	25.1	Very low	118 Å²	118	141.8 Å²	141.8	83%	0.825	80%	0.799	S	S	*	*			trans	-108.6	149.3	-179.1	-53.9	0	0	0	0	112
602	T	25.8	Very low	25	Very low	138 Å²	138	141.6 Å²	141.6	85%	0.847	80%	0.804	S	S	*	*			trans	-139.7	147.1	174.1	48.8	0	0	0	0	112.2
603	T	25.7	Very low	24.8	Very low	148 Å²	148	142.4 Å²	142.4	91%	0.908	81%	0.809	S	S	*	*			trans	-112.8	161.4	-170.3	6.3	0	0	0	0	113.9
604	T	24.9	Very low	24.6	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	80%	0.796	S	S	*	*			trans	-106.7	151.4	-163.9	4.9	0	0	0	0	115.1
605	T	23.3	Very low	24.5	Very low	129 Å²	129	136.2 Å²	136.2	79%	0.791	80%	0.799	S	S	*	*			trans	-155.6	167.5	157.8	-13.5	0	0	0	0	111
606	T	24.5	Very low	24.5	Very low	119 Å²	119	135.5 Å²	135.5	73%	0.73	79%	0.786	S	S	*	*			trans	-128.9	164.5	-162.3	51.8	0	0	0	0	114.3
607	T	24.6	Very low	24.5	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	79%	0.791	S	S	*	*			trans	143.9	170.4	151.1	47.2	0	0	0	0	112.1
608	T	23.9	Very low	24.4	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	79%	0.793	S	S	*	*				-159.5	154.9	-80.2	18.5	0	0	0	0	112.3
609	N	24.4	Very low	24.3	Very low	135 Å²	135	139.9 Å²	139.9	72%	0.722	79%	0.794	S	S	*	*			trans	64	125.1	152.5	-58.3	-8.8	0	0	0	121.4
610	T	23.7	Very low	23.9	Very low	148 Å²	148	138.9 Å²	138.9	91%	0.908	79%	0.79	S	S	*	*				-158.4	165.8	116	3.3	0	0	0	0	111.2
611	T	21.7	Very low	23.8	Very low	130 Å²	130	136.3 Å²	136.3	80%	0.798	79%	0.786	S	S	*	*			trans	-126.8	154.6	-161.3	48.9	0	0	0	0	113.9
612	T	22.4	Very low	23.8	Very low	142 Å²	142	137.4 Å²	137.4	87%	0.871	78%	0.782	S	S	*	*			trans	-149.8	153.8	163.1	-27.5	0	0	0	0	110.8
613	T	21.8	Very low	23.9	Very low	137 Å²	137	138.8 Å²	138.8	84%	0.84	78%	0.778	S	S	*	*			trans	-103.3	145.2	-165.6	24.2	0	0	0	0	114.3
614	T	23.1	Very low	23.8	Very low	84 Å²	84	138.2 Å²	138.2	52%	0.515	77%	0.769	S	S	.	*			trans	-133	156.8	172.4	47.7	0	0	0	0	111.1	L696	T614-L696 HydrophobicContact CG2-CD2 3.87Å; T614-L696 WeakPolarHBondContact OG1-CD2 3.38Å
615	T	24	Very low	24.1	Very low	147 Å²	147	138.1 Å²	138.1	90%	0.902	77%	0.771	S	S	*	*			trans	-116.3	136.9	-172.2	-25.1	0	0	0	0	111
616	Y	21.8	Very low	24.1	Very low	145 Å²	145	141.3 Å²	141.3	57%	0.569	78%	0.779	S	S	*	*			trans	-77.7	144.9	-173.2	-80.7	-112.5	0	0	0	113.5	Q700	Y616-Q700 PolarHBondContact OH-OE1 2.83Å
617	Y	23.2	Very low	24.1	Very low	237 Å²	237	144.9 Å²	144.9	93%	0.929	79%	0.787	S	S	*	*			trans	-134.1	152.2	144.3	-99	-81.5	0	0	0	110
618	H	22.9	Very low	24	Very low	164 Å²	164	150.3 Å²	150.3	76%	0.759	79%	0.794	S	S	*	*			trans	-115.4	134.8	-162.5	-155.7	-67.4	0	0	0	109.8
619	N	25.7	Very low	24.1	Very low	167 Å²	167	150.2 Å²	150.2	89%	0.893	80%	0.798	S	S	*	*			trans	-141.4	144	170.6	-119.4	-17.2	0	0	0	110.6
620	S	23	Very low	24	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	79%	0.793	S	S	*	*			trans	-121.8	123.9	-165.1	54.3	0	0	0	0	112.3
621	S	24.6	Very low	24.1	Very low	112 Å²	112	148.1 Å²	148.1	78%	0.783	79%	0.786	S	S	*	*			trans	-109.2	141.9	167.3	-171.9	0	0	0	0	109.8
622	I	24.9	Very low	24.3	Very low	142 Å²	142	148.3 Å²	148.3	73%	0.728	78%	0.783	S	S	*	*			trans	-119.1	136.3	-175.9	-63.4	175.6	0	0	0	108.7
623	H	27.3	Very low	24.5	Very low	167 Å²	167	148.6 Å²	148.6	77%	0.773	78%	0.779	S	S	*	*			trans	-127.7	139.9	176.1	-90.9	20.3	0	0	0	110.7
624	N	24.8	Very low	24.6	Very low	135 Å²	135	149.4 Å²	149.4	72%	0.722	77%	0.773	S	S	*	*			trans	-106.6	126.9	175.1	-82.2	-53.2	0	0	0	110
625	P	30.8	Very low	24.8	Very low	124 Å²	124	154 Å²	154	81%	0.805	79%	0.788	S	S	*	*			trans	-82.2	149.2	177	33.5	-34.2	0	0	0	111.7
626	M	24	Very low	24.8	Very low	195 Å²	195	154.5 Å²	154.5	96%	0.961	78%	0.778	S	S	*	*			trans	-107.8	154.7	174.3	-139.2	-178.1	-175	0	0	112.5
627	H	23.5	Very low	24.8	Very low	195 Å²	195	158.1 Å²	158.1	90%	0.903	79%	0.792	S	S	*	*			trans	-68.9	136.7	-162.4	-113.8	-104.4	0	0	0	114.9
628	R	23.2	Very low	24.8	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	79%	0.787	S	S	*	*			trans	-100.7	112.7	170.7	-178	-178.9	-177.5	-179.4	1	109.7
629	S	24.6	Very low	24.9	Very low	110 Å²	110	152.9 Å²	152.9	77%	0.769	79%	0.789	S	S	*	*			trans	-84.2	115.6	171.8	52.7	0	0	0	0	110.7
630	S	22.8	Very low	24.7	Very low	91 Å²	91	149.4 Å²	149.4	64%	0.636	78%	0.783	S	S	*	*			trans	-83.6	139.4	167.2	-161.5	0	0	0	0	110.1	D632	S630-D632 PolarHBondContact OG-OD2 2.76Å
631	I	26.4	Very low	24.7	Very low	148 Å²	148	152.2 Å²	152.2	76%	0.759	79%	0.79	S	S	*	*			trans	-134	100.4	162.1	-61.3	-178.8	0	0	0	106.4
632	D	26.3	Very low	24.7	Very low	134 Å²	134	152.8 Å²	152.8	72%	0.717	79%	0.793	S	S	*	*			trans	-70.8	143.9	172	-62.2	-84.3	0	0	0	110.6	S630	S630-D632 PolarHBondContact OG-OD2 2.76Å
633	N	25.5	Very low	24.6	Very low	149 Å²	149	154.2 Å²	154.2	80%	0.797	80%	0.801	S	S	*	*			trans	-151.6	105.2	162.1	-107.8	-37.8	0	0	0	110.4
634	H	23.2	Very low	24.5	Very low	153 Å²	153	152.4 Å²	152.4	71%	0.708	80%	0.802	S	S	*	*			trans	-68.9	126.2	170.9	-88.9	-77.2	0	0	0	110.7	F636	H634-F636 AromaticContact ND1-CE2 3.77Å
635	H	27.5	Very low	24.4	Very low	180 Å²	180	152.8 Å²	152.8	83%	0.833	80%	0.804	S	S	*	*			trans	-142	115.4	145.3	-87.6	-67.4	0	0	0	110.4
636	F	23.8	Very low	24.2	Very low	158 Å²	158	152.3 Å²	152.3	69%	0.693	80%	0.799	S	S	*	*			trans	-74.5	139.9	172.1	-80.5	-105.9	0	0	0	110.4	H634	H634-F636 AromaticContact ND1-CE2 3.77Å
637	Y	22.3	Very low	24.2	Very low	222 Å²	222	150.4 Å²	150.4	87%	0.871	79%	0.793	S	S	*	*			trans	-135.3	129.5	152.2	-100.2	-84.4	0	0	0	109.5	S639	Y637-S639 PolarHBondContact O-N 3.25Å
638	H	23.3	Very low	24.3	Very low	177 Å²	177	147.8 Å²	147.8	82%	0.819	79%	0.785	S	S	*	*			trans	-77.1	110.1	-179.1	-77	-91.7	0	0	0	110.6
639	S	24.5	Very low	24.3	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	78%	0.776	S	S	*	*			trans	-69.3	142.4	159.2	49.3	0	0	0	0	109.8	Y637 N641	Y637-S639 PolarHBondContact O-N 3.25Å; S639-N641 PolarHBondContact O-N 3.48Å
640	A	23	Very low	24.4	Very low	93 Å²	93	143.9 Å²	143.9	77%	0.769	77%	0.772	S	S	*	*			trans	-75	120.4	-174.2	0	0	0	0	0	112.2	C642	A640-C642 PolarHBondContact O-N 2.88Å
641	N	23.2	Very low	24.5	Very low	159 Å²	159	147.3 Å²	147.3	85%	0.85	78%	0.778	S	S	*	*			trans	32.6	82	154	-63.6	-8.2	0	0	0	118.2	S639	S639-N641 PolarHBondContact O-N 3.48Å
642	C	22.9	Very low	24.6	Very low	125 Å²	125	144 Å²	144	85%	0.845	77%	0.768	S	S	*	*			trans	-114.1	125.3	146	-79.7	0	0	0	0	109	A640 T644	A640-C642 PolarHBondContact O-N 2.88Å; C642-T644 PolarHBondContact O-N 3.26Å
643	L	23.4	Very low	24.7	Very low	172 Å²	172	142.6 Å²	142.6	90%	0.901	77%	0.769	S	S	*	*			trans	-86	89.6	-168.5	-78.7	163.2	0	0	0	113.1
644	T	25.3	Very low	24.9	Very low	129 Å²	129	140.7 Å²	140.7	79%	0.791	76%	0.758	S	S	*	*			trans	-139.5	88.1	158.2	48.9	0	0	0	0	110.2	C642 T646	C642-T644 PolarHBondContact O-N 3.26Å; T644-T646 PolarHBondContact O-N 3.35Å
645	N	22.1	Very low	25.4	Very low	143 Å²	143	137.3 Å²	137.3	77%	0.765	75%	0.751	S	S	*	*			trans	-93.2	81	-176	-175.6	21.3	0	0	0	112.1
646	T	27	Very low	25.5	Very low	114 Å²	114	132.9 Å²	132.9	70%	0.699	74%	0.74	S	S	*	*			trans	-139	79.6	172	38.2	0	0	0	0	111.1	T644 L648	T644-T646 PolarHBondContact O-N 3.35Å; T646-L648 PolarHBondContact O-N 2.82Å
647	N	25.1	Very low	25.9	Very low	154 Å²	154	128.4 Å²	128.4	82%	0.824	73%	0.729	S	S	*	*			trans	-70.7	65	172	-80.4	-46.1	0	0	0	112.3	H649	N647-H649 PolarHBondContact O-N 3.13Å
648	L	24.5	Very low	26.8	Very low	141 Å²	141	123 Å²	123	74%	0.738	71%	0.714	S	S	*	*			trans	-82.1	84.8	166.3	-92.9	162.8	0	0	0	108.9	T646 T650	T646-L648 PolarHBondContact O-N 2.82Å; L648-T650 PolarHBondContact O-N 3.4Å; L648-T650 PolarHBondContact O-OG1 3.34Å
649	H	24.4	Very low	27.4	Very low	155 Å²	155	121.3 Å²	121.3	72%	0.718	71%	0.705	S	S	*	*			trans	-77.6	60.9	-178.8	-160	75.9	0	0	0	111.6	N647 Q651	N647-H649 PolarHBondContact O-N 3.13Å; H649-Q651 PolarHBondContact NE2-NE2 3.39Å; H649-Q651 PolarHBondContact O-N 2.98Å
650	T	25.3	Very low	28.1	Very low	110 Å²	110	119.8 Å²	119.8	68%	0.675	69%	0.691	S	S	*	*			trans	-73	94.3	175.3	38.9	0	0	0	0	110.2	L648 S652	L648-T650 PolarHBondContact O-N 3.4Å; L648-T650 PolarHBondContact O-OG1 3.34Å; T650-S652 PolarHBondContact O-N 3.29Å
651	Q	25.4	Very low	29.5	Very low	163 Å²	163	117.8 Å²	117.8	76%	0.762	67%	0.671	S	S	*	*			trans	-68.6	82.4	167.9	-66.1	-168.3	1.7	0	0	109.8	H649 S653	H649-Q651 PolarHBondContact NE2-NE2 3.39Å; H649-Q651 PolarHBondContact O-N 2.98Å; Q651-S653 PolarHBondContact O-N 3.4Å
652	S	28.2	Very low	31.3	Very low	80 Å²	80	115.5 Å²	115.5	56%	0.559	66%	0.656	S	S	*	*			trans	-72.5	110	178.3	47.7	0	0	0	0	110.3	T650 L654	T650-S652 PolarHBondContact O-N 3.29Å; S652-L654 PolarHBondContact O-N 3.5Å
653	S	29.9	Very low	33.5	Very low	104 Å²	104	113.6 Å²	113.6	73%	0.727	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	31.6	178.6	45.5	0	0	0	0	114	Q651 S655 S656	Q651-S653 PolarHBondContact O-N 3.4Å; S653-S655 VanDerWaalsContact C-N 3.32Å; S653-S655 PolarHBondContact O-N 3.21Å; S653-S656 PolarHBondContact O-OG 3.26Å
654	L	29.8	Very low	35.5	Very low	109 Å²	109	110.5 Å²	110.5	57%	0.571	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-13.8	-176.8	-66.4	173.8	0	0	0	113.7	S652 S656 S657	S652-L654 PolarHBondContact O-N 3.5Å; L654-S656 VanDerWaalsContact C-N 3.25Å; L654-S656 PolarHBondContact O-N 2.92Å; L654-S657 PolarHBondContact O-N 3.11Å; L654-S657 PolarHBondContact O-OG 3.23Å
655	S	31.9	Very low	37.7	Very low	82 Å²	82	110.6 Å²	110.6	57%	0.573	61%	0.611	S	S	*	*	H	α-helix	trans	-60	-32.9	-177.9	-46.9	0	0	0	0	113.2	S653 F659	S653-S655 VanDerWaalsContact C-N 3.32Å; S653-S655 PolarHBondContact O-N 3.21Å; S655-F659 WeakPolarHBondContact O-CD2 3.44Å; S655-F659 VanDerWaalsContact O-CE2 3.3Å; S655-F659 WeakPolarHBondContact O-CE2 3.5Å
656	S	30.5	Very low	40.2	Very low	86 Å²	86	108.6 Å²	108.6	60%	0.601	60%	0.598	S	S	*	*	H	α-helix	trans	-81.6	-29	-175.5	45.8	0	0	0	0	114.4	S653 L654 T660	S653-S656 PolarHBondContact O-OG 3.26Å; L654-S656 VanDerWaalsContact C-N 3.25Å; L654-S656 PolarHBondContact O-N 2.92Å; S656-T660 PolarHBondContact O-OG1 2.74Å
657	S	32.2	Very low	42.2	Very low	64 Å²	64	106.5 Å²	106.5	45%	0.448	58%	0.583	S	S	.	*	H	α-helix	trans	-78.5	-30.9	-179.9	55.9	0	0	0	0	113.3	L654 T660 S661	L654-S657 PolarHBondContact O-N 3.11Å; L654-S657 PolarHBondContact O-OG 3.23Å; S657-T660 PolarHBondContact O-N 2.89Å; S657-T660 PolarHBondContact O-OG1 3.25Å; S657-S661 PolarHBondContact O-N 2.7Å
658	L	41.6	Very low	44.5	Very low	108 Å²	108	100.4 Å²	100.4	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-45.3	178.5	-97.4	158.5	0	0	0	112.3	T660 S661 E662	L658-T660 VanDerWaalsContact C-N 3.25Å; L658-T660 PolarHBondContact O-N 3.1Å; L658-S661 PolarHBondContact O-N 3.34Å; L658-S661 PolarHBondContact O-OG 2.86Å; L658-E662 WeakPolarHBondContact O-CB 3.38Å; L658-E662 PolarHBondContact O-N 2.83Å
659	F	34.9	Very low	47	Very low	142 Å²	142	98 Å²	98	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-63.5	-30	178.2	-64.2	-51.4	0	0	0	113	S655 M663	S655-F659 WeakPolarHBondContact O-CD2 3.44Å; S655-F659 VanDerWaalsContact O-CE2 3.3Å; S655-F659 WeakPolarHBondContact O-CE2 3.5Å; F659-M663 VanDerWaalsContact O-CB 3.29Å; F659-M663 WeakPolarHBondContact O-CB 3.45Å; F659-M663 PolarHBondContact O-N 2.81Å
660	T	39.9	Very low	49.4	Very low	83 Å²	83	94 Å²	94	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-70.2	-44.5	173.3	41.4	0	0	0	0	112.4	S656 S657 L658 M663 D664	S656-T660 PolarHBondContact O-OG1 2.74Å; S657-T660 PolarHBondContact O-N 2.89Å; S657-T660 PolarHBondContact O-OG1 3.25Å; L658-T660 VanDerWaalsContact C-N 3.25Å; L658-T660 PolarHBondContact O-N 3.1Å; T660-M663 PolarHBondContact O-N 2.91Å; T660-D664 WeakPolarHBondContact O-CB 3.39Å; T660-D664 VanDerWaalsContact O-CG 3.28Å; T660-D664 PolarHBondContact O-N 2.85Å
661	S	51.7	Low	52.1	Low	50 Å²	50	90.8 Å²	90.8	35%	0.35	51%	0.509	S	S	.	.	H	α-helix	trans	-68.2	-40.6	179.5	56	0	0	0	0	112.5	S657 L658 M663 D664 E665	S657-S661 PolarHBondContact O-N 2.7Å; L658-S661 PolarHBondContact O-N 3.34Å; L658-S661 PolarHBondContact O-OG 2.86Å; S661-M663 VanDerWaalsContact C-N 3.34Å; S661-M663 PolarHBondContact O-N 2.64Å; S661-D664 PolarHBondContact O-N 3.43Å; S661-E665 WeakPolarHBondContact O-CB 3.38Å; S661-E665 PolarHBondContact O-N 3.34Å
662	E	62.6	Low	54.9	Low	112 Å²	112	87.3 Å²	87.3	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-66.7	-34.7	179.3	-170.2	173	-151.1	0	0	111.8	L658 M666	L658-E662 WeakPolarHBondContact O-CB 3.38Å; L658-E662 PolarHBondContact O-N 2.83Å; E662-M666 VanDerWaalsContact O-CB 3.26Å; E662-M666 WeakPolarHBondContact O-CB 3.4Å; E662-M666 PolarHBondContact O-N 2.79Å
663	M	68.4	Low	57.5	Low	85 Å²	85	88.4 Å²	88.4	42%	0.419	49%	0.491	S	S	.	.	H	α-helix	trans	-73.1	-42.6	174	-168.2	72.5	-161.6	0	0	112.3	F659 T660 S661 E665 M666 N667	F659-M663 VanDerWaalsContact O-CB 3.29Å; F659-M663 WeakPolarHBondContact O-CB 3.45Å; F659-M663 PolarHBondContact O-N 2.81Å; T660-M663 PolarHBondContact O-N 2.91Å; S661-M663 VanDerWaalsContact C-N 3.34Å; S661-M663 PolarHBondContact O-N 2.64Å; M663-E665 VanDerWaalsContact C-N 3.34Å; M663-M666 HydrophobicContact CE-CE 4.13Å; M663-M666 PolarHBondContact O-N 3.14Å; M663-M666 HydrophobicContact SD-CE 3.51Å; M663-M666 VanDerWaalsContact SD-CE 3.51Å; M663-N667 WeakPolarHBondContact O-CB 3.41Å; M663-N667 PolarHBondContact O-N 3.37Å; M663-N667 PolarHBondContact O-ND2 2.81Å; M663-N667 VanDerWaalsContact O-ND2 3.14Å
664	D	65.5	Low	60	Low	106 Å²	106	89.9 Å²	89.9	57%	0.567	49%	0.486	S	S	*	.	H	α-helix	trans	-64.3	-39.4	176.4	-73.2	-18.9	0	0	0	111.4	T660 S661 N667 A668	T660-D664 WeakPolarHBondContact O-CB 3.39Å; T660-D664 VanDerWaalsContact O-CG 3.28Å; T660-D664 PolarHBondContact O-N 2.85Å; S661-D664 PolarHBondContact O-N 3.43Å; D664-N667 PolarHBondContact O-N 2.96Å; D664-A668 WeakPolarHBondContact O-CB 3.33Å; D664-A668 PolarHBondContact O-N 2.82Å
665	E	70.8	Confident	62.7	Low	131 Å²	131	85 Å²	85	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-66.6	-42.2	174.8	-174.2	170.9	-158.8	0	0	111.6	S661 M663 A668 L669	S661-E665 WeakPolarHBondContact O-CB 3.38Å; S661-E665 PolarHBondContact O-N 3.34Å; M663-E665 VanDerWaalsContact C-N 3.34Å; E665-A668 PolarHBondContact O-N 3.19Å; E665-L669 WeakPolarHBondContact O-CB 3.22Å; E665-L669 PolarHBondContact O-N 2.78Å
666	M	74.1	Confident	65.1	Low	102 Å²	102	84.6 Å²	84.6	50%	0.502	45%	0.451	S	S	.	.	H	α-helix	trans	-65.4	-37.1	174	-177.5	166.8	56.1	0	0	112.6	E662 M663 L669 C670	E662-M666 VanDerWaalsContact O-CB 3.26Å; E662-M666 WeakPolarHBondContact O-CB 3.4Å; E662-M666 PolarHBondContact O-N 2.79Å; M663-M666 HydrophobicContact CE-CE 4.13Å; M663-M666 PolarHBondContact O-N 3.14Å; M663-M666 HydrophobicContact SD-CE 3.51Å; M663-M666 VanDerWaalsContact SD-CE 3.51Å; M666-L669 PolarHBondContact O-N 3.08Å; M666-C670 PolarHBondContact O-N 3.42Å; M666-C670 PolarHBondContact O-SG 2.97Å; M666-C670 VanDerWaalsContact O-SG 3.34Å
667	N	70.1	Confident	67.6	Low	70 Å²	70	87 Å²	87	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-64.4	-46.2	173.8	-71.5	-31.9	0	0	0	111.2	M663 D664 L669 C670 D671	M663-N667 WeakPolarHBondContact O-CB 3.41Å; M663-N667 PolarHBondContact O-N 3.37Å; M663-N667 PolarHBondContact O-ND2 2.81Å; M663-N667 VanDerWaalsContact O-ND2 3.14Å; D664-N667 PolarHBondContact O-N 2.96Å; N667-L669 VanDerWaalsContact C-N 3.26Å; N667-L669 PolarHBondContact O-N 2.89Å; N667-C670 WeakPolarHBondContact O-CB 3.47Å; N667-C670 PolarHBondContact O-N 3.37Å; N667-C670 VanDerWaalsContact O-N 3.11Å; N667-D671 PolarHBondContact O-N 3.4Å
668	A	73.4	Confident	70.2	Confident	25 Å²	25	88.4 Å²	88.4	21%	0.207	44%	0.444	C	S	.	.	H	α-helix	trans	-62.5	-31.8	176	0	0	0	0	0	112.8	D664 E665 D671 E672	D664-A668 WeakPolarHBondContact O-CB 3.33Å; D664-A668 PolarHBondContact O-N 2.82Å; E665-A668 PolarHBondContact O-N 3.19Å; A668-D671 WeakPolarHBondContact O-CB 3.49Å; A668-E672 WeakPolarHBondContact O-CB 3.33Å; A668-E672 PolarHBondContact O-N 3.47Å
669	L	77.1	Confident	72.2	Confident	91 Å²	91	87.6 Å²	87.6	48%	0.476	43%	0.434	S	S	.	.	H	α-helix	trans	-68.6	-39.1	171.9	-109.5	163.4	0	0	0	112.7	E665 M666 N667 E672 I673	E665-L669 WeakPolarHBondContact O-CB 3.22Å; E665-L669 PolarHBondContact O-N 2.78Å; M666-L669 PolarHBondContact O-N 3.08Å; N667-L669 VanDerWaalsContact C-N 3.26Å; N667-L669 PolarHBondContact O-N 2.89Å; L669-E672 PolarHBondContact O-N 3.02Å; L669-I673 HydrophobicContact CD2-CD1 4.31Å; L669-I673 WeakPolarHBondContact O-CB 3.35Å; L669-I673 WeakPolarHBondContact O-CD1 3.41Å; L669-I673 WeakPolarHBondContact O-CG1 3.17Å; L669-I673 PolarHBondContact O-N 3.02Å
670	C	73.5	Confident	74.1	Confident	71 Å²	71	86.3 Å²	86.3	48%	0.48	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-46.6	172.6	-69.9	0	0	0	0	111.3	M666 N667 E672 I673 E674	M666-C670 PolarHBondContact O-N 3.42Å; M666-C670 PolarHBondContact O-SG 2.97Å; M666-C670 VanDerWaalsContact O-SG 3.34Å; N667-C670 WeakPolarHBondContact O-CB 3.47Å; N667-C670 PolarHBondContact O-N 3.37Å; N667-C670 VanDerWaalsContact O-N 3.11Å; C670-E672 VanDerWaalsContact C-N 3.34Å; C670-E672 PolarHBondContact O-N 2.99Å; C670-I673 PolarHBondContact O-N 3.27Å; C670-E674 PolarHBondContact O-N 3.3Å
671	D	82.2	Confident	75.7	Confident	43 Å²	43	90.6 Å²	90.6	23%	0.23	45%	0.445	C	S	.	.	H	α-helix	trans	-53.9	-47.9	174.2	-76.7	-19.8	0	0	0	111.6	N667 A668 E674 D675 H690 S694	N667-D671 PolarHBondContact O-N 3.4Å; A668-D671 WeakPolarHBondContact O-CB 3.49Å; D671-E674 PolarHBondContact O-N 3.08Å; D671-D675 PolarHBondContact O-N 2.87Å; D671-H690 HydrophobicContact CB-CB 3.53Å; D671-S694 PolarHBondContact OD2-OG 3.08Å
672	E	85.5	Confident	77	Confident	89 Å²	89	91.6 Å²	91.6	42%	0.416	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-38.2	177.8	-168.6	-176.4	163.5	0	0	112.5	A668 L669 C670 D675 I676	A668-E672 WeakPolarHBondContact O-CB 3.33Å; A668-E672 PolarHBondContact O-N 3.47Å; L669-E672 PolarHBondContact O-N 3.02Å; C670-E672 VanDerWaalsContact C-N 3.34Å; C670-E672 PolarHBondContact O-N 2.99Å; E672-D675 PolarHBondContact O-N 3.22Å; E672-I676 HydrophobicContact CG-CD1 3.95Å; E672-I676 HydrophobicContact CG-CG1 4.5Å; E672-I676 WeakPolarHBondContact O-CB 3.31Å; E672-I676 VanDerWaalsContact O-CG1 3.24Å; E672-I676 WeakPolarHBondContact O-CG1 3.46Å; E672-I676 PolarHBondContact O-N 2.9Å
673	I	81.5	Confident	77.6	Confident	104 Å²	104	87.9 Å²	87.9	53%	0.533	44%	0.438	S	S	.	.	H	α-helix	trans	-66.5	-37	177.2	-72.3	165.3	0	0	0	111.3	L669 C670 Y677	L669-I673 HydrophobicContact CD2-CD1 4.31Å; L669-I673 WeakPolarHBondContact O-CB 3.35Å; L669-I673 WeakPolarHBondContact O-CD1 3.41Å; L669-I673 WeakPolarHBondContact O-CG1 3.17Å; L669-I673 PolarHBondContact O-N 3.02Å; C670-I673 PolarHBondContact O-N 3.27Å; I673-Y677 WeakPolarHBondContact O-CB 3.47Å; I673-Y677 PolarHBondContact O-N 2.96Å
674	E	82.1	Confident	77.9	Confident	135 Å²	135	88.9 Å²	88.9	63%	0.631	44%	0.441	S	S	*	.	H	α-helix	trans	-68.6	-43.3	173	-68.5	-156.4	168.3	0	0	112.1	C670 D671 I676 Y677 Y678	C670-E674 PolarHBondContact O-N 3.3Å; D671-E674 PolarHBondContact O-N 3.08Å; E674-I676 VanDerWaalsContact C-N 3.33Å; E674-I676 PolarHBondContact O-N 3.32Å; E674-Y677 PolarHBondContact O-N 3.27Å; E674-Y678 WeakPolarHBondContact O-CB 3.33Å; E674-Y678 PolarHBondContact O-N 2.91Å
675	D	87.2	Confident	78.6	Confident	5 Å²	5	89 Å²	89	3%	0.027	44%	0.437	C	S	.	.	H	α-helix	trans	-56.8	-44.9	173.6	-79.5	-24.4	0	0	0	111.5	D671 E672 Y678 Y679 F685 P686 S689 H690 S691	D671-D675 PolarHBondContact O-N 2.87Å; E672-D675 PolarHBondContact O-N 3.22Å; D675-Y678 PolarHBondContact O-N 3.18Å; D675-Y679 PolarHBondContact O-N 3.44Å; D675-F685 HydrophobicContact CB-CD1 4.19Å; D675-F685 HydrophobicContact CB-CE1 4.34Å; D675-F685 WeakPolarHBondContact O-CD1 3.29Å; D675-P686 WeakPolarHBondContact OD1-CG 3.32Å; D675-S689 WeakPolarHBondContact OD1-CA 3.41Å; D675-S689 VanDerWaalsContact OD2-CA 3.32Å; D675-S689 WeakPolarHBondContact OD2-CA 2.96Å; D675-S689 WeakPolarHBondContact OD2-CB 3.49Å; D675-H690 IonicContact OD1-CD2 2.7Å; D675-H690 PolarHBondContact OD1-N 3.22Å; D675-H690 PolarHBondContact OD2-N 3.12Å; D675-S691 PolarHBondContact OD2-N 2.93Å
676	I	83.5	Confident	78.9	Confident	75 Å²	75	83.9 Å²	83.9	39%	0.385	42%	0.415	S	S	.	.	H	α-helix	trans	-66.3	-44.2	176.4	-70.9	166.8	0	0	0	111.3	E672 E674 Y678 Y679 V680	E672-I676 HydrophobicContact CG-CD1 3.95Å; E672-I676 HydrophobicContact CG-CG1 4.5Å; E672-I676 WeakPolarHBondContact O-CB 3.31Å; E672-I676 VanDerWaalsContact O-CG1 3.24Å; E672-I676 WeakPolarHBondContact O-CG1 3.46Å; E672-I676 PolarHBondContact O-N 2.9Å; E674-I676 VanDerWaalsContact C-N 3.33Å; E674-I676 PolarHBondContact O-N 3.32Å; I676-Y678 VanDerWaalsContact C-N 3.31Å; I676-Y678 PolarHBondContact O-N 2.86Å; I676-Y679 PolarHBondContact O-N 3.17Å; I676-V680 HydrophobicContact CG2-CG2 4.37Å; I676-V680 WeakPolarHBondContact O-CG2 3.34Å; I676-V680 PolarHBondContact O-N 3.06Å
677	Y	82.8	Confident	78.6	Confident	135 Å²	135	88.5 Å²	88.5	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-61.7	-41.7	177.9	178.3	-98.4	0	0	0	111.4	I673 E674 V680 R681	I673-Y677 WeakPolarHBondContact O-CB 3.47Å; I673-Y677 PolarHBondContact O-N 2.96Å; E674-Y677 PolarHBondContact O-N 3.27Å; Y677-V680 PolarHBondContact O-N 3.39Å; Y677-R681 VanDerWaalsContact O-CB 3.29Å; Y677-R681 WeakPolarHBondContact O-CB 2.99Å; Y677-R681 PolarHBondContact O-N 3.27Å; Y677-R681 PolarHBondContact OH-NH1 2.79Å
678	Y	85.6	Confident	78.3	Confident	94 Å²	94	93 Å²	93	37%	0.369	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-45.1	173.4	-169.5	-76.4	0	0	0	111.1	E674 D675 I676 R681 N682 H684 P686	E674-Y678 WeakPolarHBondContact O-CB 3.33Å; E674-Y678 PolarHBondContact O-N 2.91Å; D675-Y678 PolarHBondContact O-N 3.18Å; I676-Y678 VanDerWaalsContact C-N 3.31Å; I676-Y678 PolarHBondContact O-N 2.86Å; Y678-R681 PolarHBondContact O-N 3.18Å; Y678-N682 HydrophobicContact CD1-CB 4.23Å; Y678-N682 VanDerWaalsContact CD1-ND2 3.34Å; Y678-N682 WeakPolarHBondContact CD1-ND2 3.35Å; Y678-N682 WeakPolarHBondContact CD2-ND2 3.45Å; Y678-N682 HydrophobicContact CE1-CB 4.02Å; Y678-N682 VanDerWaalsContact CE1-ND2 3.28Å; Y678-N682 WeakPolarHBondContact CE1-ND2 3.49Å; Y678-N682 VanDerWaalsContact CE2-ND2 3.32Å; Y678-N682 WeakPolarHBondContact CE2-ND2 3.42Å; Y678-N682 VanDerWaalsContact CZ-ND2 3.27Å; Y678-N682 VanDerWaalsContact O-CB 3.31Å; Y678-N682 WeakPolarHBondContact O-CB 3Å; Y678-N682 PolarHBondContact O-N 3.01Å; Y678-N682 PolarHBondContact O-ND2 3.48Å; Y678-H684 VanDerWaalsContact CD1-O 3.27Å; Y678-H684 WeakPolarHBondContact CD1-O 3.44Å; Y678-H684 AromaticContact CE1-NE2 3.9Å; Y678-P686 HydrophobicContact CD1-CB 4.12Å; Y678-P686 HydrophobicContact CD1-CG 4.36Å; Y678-P686 HydrophobicContact CD2-CB 4.44Å; Y678-P686 HydrophobicContact CE1-CB 4.16Å; Y678-P686 HydrophobicContact CE2-CB 4.48Å; Y678-P686 HydrophobicContact CG-CB 4.27Å; Y678-P686 HydrophobicContact CG-CG 4.38Å
679	Y	84.7	Confident	77.6	Confident	92 Å²	92	93.4 Å²	93.4	36%	0.361	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-47.8	175.8	179.8	-88.8	0	0	0	112.7	D675 I676 R681 G683 H684 F685	D675-Y679 PolarHBondContact O-N 3.44Å; I676-Y679 PolarHBondContact O-N 3.17Å; Y679-R681 VanDerWaalsContact C-N 3.29Å; Y679-R681 PolarHBondContact O-N 3.02Å; Y679-G683 VanDerWaalsContact O-CA 3.24Å; Y679-G683 WeakPolarHBondContact O-CA 3.2Å; Y679-G683 PolarHBondContact O-N 3.42Å; Y679-H684 WeakPolarHBondContact CA-O 3.22Å; Y679-F685 HydrophobicContact CD2-CD1 4.42Å; Y679-F685 AromaticContact CD2-CD2 3.44Å; Y679-F685 HydrophobicContact CD2-CD2 3.44Å; Y679-F685 VanDerWaalsContact CD2-CD2 3.44Å; Y679-F685 HydrophobicContact CD2-CE1 4.48Å; Y679-F685 AromaticContact CD2-CE2 3.5Å; Y679-F685 HydrophobicContact CD2-CE2 3.5Å; Y679-F685 VanDerWaalsContact CD2-CE2 3.5Å; Y679-F685 AromaticContact CD2-CG 3.93Å; Y679-F685 HydrophobicContact CD2-CG 3.93Å; Y679-F685 HydrophobicContact CD2-CZ 4.05Å; Y679-F685 HydrophobicContact CE2-CD2 4.06Å; Y679-F685 HydrophobicContact CE2-CE2 4.01Å; Y679-F685 HydrophobicContact CG-CD2 4.19Å; Y679-F685 HydrophobicContact CG-CE1 4.32Å; Y679-F685 AromaticContact CG-CE2 3.97Å; Y679-F685 HydrophobicContact CG-CE2 3.97Å; Y679-F685 HydrophobicContact CG-CG 4.46Å; Y679-F685 HydrophobicContact CG-CZ 4.04Å
680	V	74.6	Confident	77.1	Confident	114 Å²	114	93.5 Å²	93.5	69%	0.691	46%	0.456	S	S	*	.	H	α-helix	trans	-63	-37.1	179.8	171.2	0	0	0	0	111.4	I676 Y677	I676-V680 HydrophobicContact CG2-CG2 4.37Å; I676-V680 WeakPolarHBondContact O-CG2 3.34Å; I676-V680 PolarHBondContact O-N 3.06Å; Y677-V680 PolarHBondContact O-N 3.39Å
681	R	72.6	Confident	76.2	Confident	174 Å²	174	91.1 Å²	91.1	66%	0.657	44%	0.44	S	S	*	.	H	α-helix	trans	-78.7	-36.7	-178.5	-172.5	168.8	178.3	157.1	-3.8	113.7	Y677 Y678 Y679	Y677-R681 VanDerWaalsContact O-CB 3.29Å; Y677-R681 WeakPolarHBondContact O-CB 2.99Å; Y677-R681 PolarHBondContact O-N 3.27Å; Y677-R681 PolarHBondContact OH-NH1 2.79Å; Y678-R681 PolarHBondContact O-N 3.18Å; Y679-R681 VanDerWaalsContact C-N 3.29Å; Y679-R681 PolarHBondContact O-N 3.02Å
682	N	78.7	Confident	74.5	Confident	71 Å²	71	94.9 Å²	94.9	38%	0.38	46%	0.459	S	S	.	.	H	α-helix	trans	-113	-6.7	-169.9	-57.3	-42.9	0	0	0	114	Y678 H684	Y678-N682 HydrophobicContact CD1-CB 4.23Å; Y678-N682 VanDerWaalsContact CD1-ND2 3.34Å; Y678-N682 WeakPolarHBondContact CD1-ND2 3.35Å; Y678-N682 WeakPolarHBondContact CD2-ND2 3.45Å; Y678-N682 HydrophobicContact CE1-CB 4.02Å; Y678-N682 VanDerWaalsContact CE1-ND2 3.28Å; Y678-N682 WeakPolarHBondContact CE1-ND2 3.49Å; Y678-N682 VanDerWaalsContact CE2-ND2 3.32Å; Y678-N682 WeakPolarHBondContact CE2-ND2 3.42Å; Y678-N682 VanDerWaalsContact CZ-ND2 3.27Å; Y678-N682 VanDerWaalsContact O-CB 3.31Å; Y678-N682 WeakPolarHBondContact O-CB 3Å; Y678-N682 PolarHBondContact O-N 3.01Å; Y678-N682 PolarHBondContact O-ND2 3.48Å; N682-H684 PolarHBondContact O-N 2.7Å; N682-H684 PolarHBondContact O-ND1 3.49Å
683	G	74.9	Confident	72.7	Confident	34 Å²	34	94.5 Å²	94.5	35%	0.351	47%	0.467	S	S	.	.	S	Bend	trans	75.2	3.4	179.9	0	0	0	0	0	115.7	Y679	Y679-G683 VanDerWaalsContact O-CA 3.24Å; Y679-G683 WeakPolarHBondContact O-CA 3.2Å; Y679-G683 PolarHBondContact O-N 3.42Å
684	H	74.5	Confident	71.1	Confident	105 Å²	105	91.9 Å²	91.9	49%	0.486	46%	0.457	S	S	.	.	S	Bend	trans	-150.6	150.6	179.5	64.7	-76.7	0	0	0	109.9	Y678 Y679 N682	Y678-H684 VanDerWaalsContact CD1-O 3.27Å; Y678-H684 WeakPolarHBondContact CD1-O 3.44Å; Y678-H684 AromaticContact CE1-NE2 3.9Å; Y679-H684 WeakPolarHBondContact CA-O 3.22Å; N682-H684 PolarHBondContact O-N 2.7Å; N682-H684 PolarHBondContact O-ND1 3.49Å
685	F	81.3	Confident	69	Low	108 Å²	108	91.1 Å²	91.1	47%	0.474	46%	0.457	S	S	.	.			trans	-71.4	157.2	176.2	-78.5	-77.5	0	0	0	111.4	D675 Y679	D675-F685 HydrophobicContact CB-CD1 4.19Å; D675-F685 HydrophobicContact CB-CE1 4.34Å; D675-F685 WeakPolarHBondContact O-CD1 3.29Å; Y679-F685 HydrophobicContact CD2-CD1 4.42Å; Y679-F685 AromaticContact CD2-CD2 3.44Å; Y679-F685 HydrophobicContact CD2-CD2 3.44Å; Y679-F685 VanDerWaalsContact CD2-CD2 3.44Å; Y679-F685 HydrophobicContact CD2-CE1 4.48Å; Y679-F685 AromaticContact CD2-CE2 3.5Å; Y679-F685 HydrophobicContact CD2-CE2 3.5Å; Y679-F685 VanDerWaalsContact CD2-CE2 3.5Å; Y679-F685 AromaticContact CD2-CG 3.93Å; Y679-F685 HydrophobicContact CD2-CG 3.93Å; Y679-F685 HydrophobicContact CD2-CZ 4.05Å; Y679-F685 HydrophobicContact CE2-CD2 4.06Å; Y679-F685 HydrophobicContact CE2-CE2 4.01Å; Y679-F685 HydrophobicContact CG-CD2 4.19Å; Y679-F685 HydrophobicContact CG-CE1 4.32Å; Y679-F685 AromaticContact CG-CE2 3.97Å; Y679-F685 HydrophobicContact CG-CE2 3.97Å; Y679-F685 HydrophobicContact CG-CG 4.46Å; Y679-F685 HydrophobicContact CG-CZ 4.04Å
686	P	76.1	Confident	67	Low	25 Å²	25	95 Å²	95	16%	0.162	48%	0.477	C	S	.	.			trans	-63.7	154	173.9	27.8	-33.1	0	0	0	111.1	D675 Y678 Q688	D675-P686 WeakPolarHBondContact OD1-CG 3.32Å; Y678-P686 HydrophobicContact CD1-CB 4.12Å; Y678-P686 HydrophobicContact CD1-CG 4.36Å; Y678-P686 HydrophobicContact CD2-CB 4.44Å; Y678-P686 HydrophobicContact CE1-CB 4.16Å; Y678-P686 HydrophobicContact CE2-CB 4.48Å; Y678-P686 HydrophobicContact CG-CB 4.27Å; Y678-P686 HydrophobicContact CG-CG 4.38Å; P686-Q688 PolarHBondContact O-N 2.98Å; P686-Q688 VanDerWaalsContact O-N 3.13Å
687	M	68.3	Low	64.9	Low	198 Å²	198	97 Å²	97	98%	0.975	49%	0.485	S	S	*	.	S	Bend	trans	-65.5	-15.5	-176.9	-79.5	-167.9	67.1	0	0	114.4
688	Q	64.1	Low	62.9	Low	165 Å²	165	96.4 Å²	96.4	77%	0.771	49%	0.486	S	S	*	.	S	Bend	trans	-130.7	100.8	168.6	-70	177.5	-30.7	0	0	106	P686 H690	P686-Q688 PolarHBondContact O-N 2.98Å; P686-Q688 VanDerWaalsContact O-N 3.13Å; Q688-H690 PolarHBondContact O-N 3.41Å
689	S	59.9	Low	60.7	Low	33 Å²	33	96 Å²	96	23%	0.231	50%	0.498	C	S	.	.			trans	-69.4	124.8	171.1	53.8	0	0	0	0	109	D675 L692	D675-S689 WeakPolarHBondContact OD1-CA 3.41Å; D675-S689 VanDerWaalsContact OD2-CA 3.32Å; D675-S689 WeakPolarHBondContact OD2-CA 2.96Å; D675-S689 WeakPolarHBondContact OD2-CB 3.49Å; S689-L692 WeakPolarHBondContact OG-CD1 3.36Å
690	H	65.5	Low	58.6	Low	94 Å²	94	97.1 Å²	97.1	44%	0.435	51%	0.506	S	S	.	.	S	Bend	trans	-66.4	-43.2	-177.6	-69.7	-108.4	0	0	0	110.8	D671 D675 Q688 L692 S693	D671-H690 HydrophobicContact CB-CB 3.53Å; D675-H690 IonicContact OD1-CD2 2.7Å; D675-H690 PolarHBondContact OD1-N 3.22Å; D675-H690 PolarHBondContact OD2-N 3.12Å; Q688-H690 PolarHBondContact O-N 3.41Å; H690-L692 PolarHBondContact O-N 2.89Å; H690-S693 PolarHBondContact O-N 2.8Å; H690-S693 VanDerWaalsContact O-N 3.09Å
691	S	54.8	Low	57.1	Low	21 Å²	21	100.7 Å²	100.7	15%	0.147	51%	0.512	C	S	.	.	H	α-helix	trans	-51.3	-45	-177.8	173	0	0	0	0	114.5	D675 S693 S694 L695	D675-S691 PolarHBondContact OD2-N 2.93Å; S691-S693 PolarHBondContact O-N 3.23Å; S691-S694 PolarHBondContact O-N 3.49Å; S691-L695 PolarHBondContact O-N 2.86Å
692	L	45.5	Very low	55.3	Low	122 Å²	122	99.7 Å²	99.7	64%	0.639	52%	0.515	S	S	*	.	H	α-helix	trans	-67.4	-20	-176.8	-69.4	-177	0	0	0	114.3	S689 H690	S689-L692 WeakPolarHBondContact OG-CD1 3.36Å; H690-L692 PolarHBondContact O-N 2.89Å
693	S	49	Very low	52.8	Low	81 Å²	81	104.3 Å²	104.3	57%	0.566	54%	0.535	S	S	*	.	H	α-helix	trans	-77.4	-42.1	179.3	-58.5	0	0	0	0	111.5	H690 S691	H690-S693 PolarHBondContact O-N 2.8Å; H690-S693 VanDerWaalsContact O-N 3.09Å; S691-S693 PolarHBondContact O-N 3.23Å
694	S	46.9	Very low	50.6	Low	48 Å²	48	112.3 Å²	112.3	34%	0.336	56%	0.56	S	S	.	*	H	α-helix	trans	-68.6	-39.4	-177.5	-60.4	0	0	0	0	112.1	D671 S691 L696 H697	D671-S694 PolarHBondContact OD2-OG 3.08Å; S691-S694 PolarHBondContact O-N 3.49Å; S694-L696 VanDerWaalsContact C-N 3.33Å; S694-L696 PolarHBondContact O-N 3.49Å; S694-H697 PolarHBondContact O-N 3.02Å
695	L	39.4	Very low	48.4	Very low	119 Å²	119	115.9 Å²	115.9	62%	0.623	58%	0.576	S	S	*	*	H	α-helix	trans	-62.4	-34.8	180	-114	162.1	0	0	0	113.6	S691 H697 H698	S691-L695 PolarHBondContact O-N 2.86Å; L695-H697 VanDerWaalsContact C-N 3.3Å; L695-H697 PolarHBondContact O-N 2.84Å; L695-H698 PolarHBondContact O-N 2.89Å
696	L	44.5	Very low	45.9	Very low	88 Å²	88	116.5 Å²	116.5	46%	0.461	59%	0.592	S	S	.	*	H	α-helix	trans	-68.6	-29.4	-178.5	-145.7	79.7	0	0	0	112.7	T614 S694 H698 S699	T614-L696 HydrophobicContact CG2-CD2 3.87Å; T614-L696 WeakPolarHBondContact OG1-CD2 3.38Å; S694-L696 VanDerWaalsContact C-N 3.33Å; S694-L696 PolarHBondContact O-N 3.49Å; L696-H698 VanDerWaalsContact C-N 3.33Å; L696-H698 PolarHBondContact O-N 3.42Å; L696-S699 PolarHBondContact O-N 3.29Å
697	H	39.8	Very low	43.6	Very low	117 Å²	117	123.7 Å²	123.7	54%	0.542	62%	0.623	S	S	.	*	H	α-helix	trans	-70.3	-25.8	178.5	-86.7	-66.4	0	0	0	113.7	S694 L695	S694-H697 PolarHBondContact O-N 3.02Å; L695-H697 VanDerWaalsContact C-N 3.3Å; L695-H697 PolarHBondContact O-N 2.84Å
698	H	41.2	Very low	41.8	Very low	121 Å²	121	119.5 Å²	119.5	56%	0.56	61%	0.61	S	S	*	*	H	α-helix	trans	-73.8	-33	177.4	-148.7	98.2	0	0	0	111.9	L695 L696	L695-H698 PolarHBondContact O-N 2.89Å; L696-H698 VanDerWaalsContact C-N 3.33Å; L696-H698 PolarHBondContact O-N 3.42Å
699	S	38.6	Very low	39.9	Very low	87 Å²	87	119.9 Å²	119.9	61%	0.608	61%	0.612	S	S	*	*	H	α-helix	trans	-62.9	-49.5	-178.5	180	0	0	0	0	113.4	L696 K701 Q702	L696-S699 PolarHBondContact O-N 3.29Å; S699-K701 VanDerWaalsContact C-N 3.27Å; S699-K701 PolarHBondContact O-N 2.87Å; S699-Q702 PolarHBondContact O-N 3.48Å
700	Q	40.7	Very low	38.3	Very low	114 Å²	114	127.4 Å²	127.4	53%	0.533	64%	0.643	S	S	.	*	G	3₁₀ helix	trans	-70.4	-15.1	-170.5	-71.3	-169.4	-4.6	0	0	114.9	Y616	Y616-Q700 PolarHBondContact OH-OE1 2.83Å
701	K	43	Very low	36.3	Very low	190 Å²	190	130.6 Å²	130.6	83%	0.826	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-79.1	-14.6	-178.8	-85.5	-177.9	177.3	172.1	0	114.8	S699	S699-K701 VanDerWaalsContact C-N 3.27Å; S699-K701 PolarHBondContact O-N 2.87Å
702	Q	33.8	Very low	35	Very low	152 Å²	152	138 Å²	138	71%	0.71	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-101	3.5	-173.5	-60.2	-161.1	20.7	0	0	115.6	S699	S699-Q702 PolarHBondContact O-N 3.48Å
703	Q	28	Very low	33.9	Very low	169 Å²	169	139.7 Å²	139.7	79%	0.79	69%	0.693	S	S	*	*			trans	-122.4	72.3	176.3	-67.8	-165.6	2.7	0	0	113.5
704	K	28.7	Very low	32.7	Very low	202 Å²	202	144.4 Å²	144.4	88%	0.878	71%	0.707	S	S	*	*			trans	-126	87.5	155.8	-109.3	-175	176.5	-179	0	109.5
705	Q	26.5	Very low	31.5	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-67.8	133.7	172.5	-71.8	-175.7	-14.5	0	0	110.2
706	P	30.4	Very low	30.9	Very low	122 Å²	122	148.7 Å²	148.7	79%	0.792	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-82	117.6	173.4	31.4	-31.4	0	0	0	110.6
707	H	27.3	Very low	29.9	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.815	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-84.3	155	165.2	-99	-16.6	0	0	0	111.5
708	P	29.4	Very low	29.2	Very low	110 Å²	110	150.3 Å²	150.3	71%	0.714	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-96.6	169.8	-140.3	-7.5	28	0	0	0	115.4
709	H	25.4	Very low	28.3	Very low	173 Å²	173	154.4 Å²	154.4	80%	0.801	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-52	143.6	176.5	-64.6	-92.4	0	0	0	114.6
710	H	25.7	Very low	27.8	Very low	191 Å²	191	158.2 Å²	158.2	88%	0.884	78%	0.775	S	S	*	*			trans	-124.6	142.3	146.3	-106	32.5	0	0	0	109.9
711	H	24.7	Very low	26.9	Very low	161 Å²	161	158.9 Å²	158.9	75%	0.745	78%	0.782	S	S	*	*			trans	-84	142.9	179.6	-66.7	-96	0	0	0	110.6
712	H	26	Very low	26.2	Very low	177 Å²	177	157.6 Å²	157.6	82%	0.819	78%	0.779	S	S	*	*				-174	118.4	115.6	-94.5	-76.2	0	0	0	107
713	H	22.7	Very low	25.7	Very low	156 Å²	156	157.2 Å²	157.2	72%	0.722	78%	0.781	S	S	*	*				80.5	130.6	72.5	-119	-85.9	0	0	0	114.3
714	E	23.6	Very low	25.5	Very low	180 Å²	180	154.6 Å²	154.6	84%	0.841	78%	0.782	S	S	*	*			trans	67.8	143	174.9	-48.3	-169.7	171.8	0	0	116.8
715	G	22.6	Very low	25.6	Very low	68 Å²	68	149.4 Å²	149.4	70%	0.701	78%	0.776	S	S	*	*			cis	169	165.9	-10.7	0	0	0	0	0	113.8
716	K	26	Very low	26	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.826	77%	0.77	S	S	*	*			trans	75.4	111.7	162.4	-62.5	173.8	-177.7	166.8	0	120.7
717	N	24.4	Very low	25.6	Very low	131 Å²	131	147.9 Å²	147.9	70%	0.701	77%	0.772	S	S	*	*				92.8	120.5	115.2	-68.8	10.7	0	0	0	124.1
718	T	24.5	Very low	25.5	Very low	108 Å²	108	144.5 Å²	144.5	66%	0.663	77%	0.768	S	S	*	*				85.2	117.9	126.6	53.3	0	0	0	0	124.2
719	Y	22.4	Very low	26.1	Very low	207 Å²	207	144.6 Å²	144.6	81%	0.812	77%	0.768	S	S	*	*			trans	49.8	122.1	135.6	-61.1	-61	0	0	0	122.1
720	L	27.8	Very low	25.9	Very low	166 Å²	166	146.5 Å²	146.5	87%	0.869	77%	0.77	S	S	*	*				-165.7	176.1	95.3	-107.5	166.2	0	0	0	113
721	N	22.5	Very low	25.8	Very low	128 Å²	128	143.8 Å²	143.8	68%	0.684	76%	0.761	S	S	*	*			trans	-118.1	178	-165.3	-85.6	-27.2	0	0	0	114
722	H	28.2	Very low	25.7	Very low	164 Å²	164	142 Å²	142	76%	0.759	76%	0.757	S	S	*	*			trans	87.2	155.7	162.5	-57.2	-87.7	0	0	0	118.3
723	L	23.5	Very low	25.5	Very low	144 Å²	144	142 Å²	142	75%	0.754	76%	0.755	S	S	*	*			cis	-177.4	149.9	-48.5	-115.1	160.7	0	0	0	110.1
724	S	23.4	Very low	25.8	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	76%	0.764	S	S	*	*			trans	78.6	151.6	159.7	-56.6	0	0	0	0	120.7
725	A	29.5	Very low	25.7	Very low	93 Å²	93	141.4 Å²	141.4	77%	0.769	76%	0.757	S	S	*	*			trans	-109	-169.7	-179.2	0	0	0	0	0	111.5
726	P	35.4	Very low	26	Very low	109 Å²	109	144.5 Å²	144.5	71%	0.708	76%	0.763	S	S	*	*				-160.4	-178.5	68.2	45.4	-23.4	0	0	0	118.8
727	I	21.7	Very low	25.9	Very low	160 Å²	160	142.8 Å²	142.8	82%	0.821	76%	0.762	S	S	*	*			trans	39.7	136.3	136.6	-69.7	168.9	0	0	0	120.2
728	S	25.3	Very low	25.9	Very low	104 Å²	104	143 Å²	143	73%	0.727	77%	0.769	S	S	*	*			cis	-171.3	-176.1	-5.8	66.8	0	0	0	0	111.1
729	P	42.3	Very low	25.9	Very low	112 Å²	112	143.7 Å²	143.7	73%	0.727	77%	0.773	S	S	*	*			trans	-105.8	-177	-170.3	42.8	-36.7	0	0	0	115.4
730	Y	22.5	Very low	25.9	Very low	214 Å²	214	140.8 Å²	140.8	84%	0.839	77%	0.772	S	S	*	*			trans	-167.4	164.8	143.6	-124.1	-110.7	0	0	0	115.3
731	L	22.6	Very low	25.8	Very low	133 Å²	133	138.7 Å²	138.7	70%	0.696	77%	0.766	S	S	*	*			trans	-27.8	163.1	175.4	-58.6	170.3	0	0	0	119.7
732	N	23.5	Very low	25.9	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	77%	0.767	S	S	*	*			cis	-179.8	175.5	44.3	-139.4	-28.5	0	0	0	113
733	K	21	Very low	25.7	Very low	177 Å²	177	137.1 Å²	137.1	77%	0.77	77%	0.767	S	S	*	*			trans	-28	143.7	171.7	-64.7	169.4	176.7	179.1	0	118.7
734	F	29.2	Very low	25.9	Very low	208 Å²	208	138.4 Å²	138.4	91%	0.912	78%	0.775	S	S	*	*			trans	-126.2	147.8	145.5	-99.8	-88.9	0	0	0	111.6
735	V	21.2	Very low	25.8	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	78%	0.775	S	S	*	*			trans	-117.3	136.1	176	174	0	0	0	0	107.5
736	T	29.6	Very low	25.8	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	78%	0.775	S	S	*	*			trans	-133.5	130.4	172.8	42.2	0	0	0	0	110.2
737	N	23.1	Very low	25.2	Very low	153 Å²	153	141.5 Å²	141.5	82%	0.818	78%	0.781	S	S	*	*			trans	-86.9	153.8	-176.9	-66.9	-16.9	0	0	0	111.6
738	T	23.6	Very low	25.5	Very low	137 Å²	137	141.8 Å²	141.8	84%	0.84	78%	0.783	S	S	*	*			trans	-98	132.1	174.3	48.1	0	0	0	0	111.7
739	T	25.4	Very low	25.4	Very low	122 Å²	122	142.4 Å²	142.4	75%	0.748	78%	0.782	S	S	*	*			trans	-145.4	106.7	164.9	49.9	0	0	0	0	111.5
740	D	23.3	Very low	24.6	Very low	146 Å²	146	142.7 Å²	142.7	78%	0.781	78%	0.782	S	S	*	*			trans	66	152.9	131	-52.8	-36.4	0	0	0	125.4
741	T	25.5	Very low	24.7	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	79%	0.786	S	S	*	*			trans	84.8	93.9	150.5	33.8	0	0	0	0	122.5
742	T	25	Very low	24.7	Very low	115 Å²	115	141.8 Å²	141.8	71%	0.706	79%	0.792	S	S	*	*				66.9	113.3	124.3	53.6	0	0	0	0	122.6
743	N	22.7	Very low	24.7	Very low	143 Å²	143	147.7 Å²	147.7	77%	0.765	81%	0.805	S	S	*	*				37.3	123.4	120.8	-56.6	-3.7	0	0	0	120.2
744	N	29	Very low	24.7	Very low	172 Å²	172	145.5 Å²	145.5	92%	0.92	81%	0.811	S	S	*	*				-152.8	146.8	126.1	-107.2	-41	0	0	0	111.6
745	T	21.1	Very low	24.5	Very low	131 Å²	131	144 Å²	144	80%	0.804	81%	0.812	S	S	*	*			trans	-116.5	136.5	-176.9	-38.1	0	0	0	0	109.6
746	A	28.2	Very low	24.7	Very low	92 Å²	92	144 Å²	144	76%	0.76	82%	0.817	S	S	*	*			trans	-149.4	116.1	173	0	0	0	0	0	111.2
747	D	22.8	Very low	24.5	Very low	157 Å²	157	144 Å²	144	84%	0.84	82%	0.817	S	S	*	*			trans	-73.4	137.1	169	-69.8	-63.2	0	0	0	110.6
748	I	29.4	Very low	24.5	Very low	166 Å²	166	146.5 Å²	146.5	85%	0.851	82%	0.82	S	S	*	*			trans	-132.1	123.4	161.9	-62.6	-175.7	0	0	0	109.5
749	T	23.2	Very low	24.6	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.724	82%	0.818	S	S	*	*			trans	-90.5	141.8	-170.3	-17.8	0	0	0	0	113.1
750	T	23.9	Very low	24.6	Very low	117 Å²	117	147 Å²	147	72%	0.718	82%	0.823	S	S	*	*			trans	10.3	131.4	154.4	56.9	0	0	0	0	119.9
751	N	25.1	Very low	24.6	Very low	171 Å²	171	146.9 Å²	146.9	91%	0.914	82%	0.823	S	S	*	*			trans	-146.8	126.5	145	-116.3	-44.7	0	0	0	112.4
752	N	22.5	Very low	24.7	Very low	157 Å²	157	149.4 Å²	149.4	84%	0.84	83%	0.832	S	S	*	*			trans	-96.6	138.3	175.8	-78.9	-42.7	0	0	0	110.3
753	R	23.4	Very low	24.6	Very low	248 Å²	248	152.5 Å²	152.5	94%	0.936	84%	0.835	S	S	*	*			trans	-146.7	118.4	164.4	-121.5	178	-176.9	179	1.3	111.6
754	C	21.2	Very low	24.6	Very low	131 Å²	131	152.3 Å²	152.3	89%	0.885	83%	0.834	S	S	*	*			trans	-69.3	148.5	173.2	-58.7	0	0	0	0	111.1
755	L	25.7	Very low	24.6	Very low	177 Å²	177	151.4 Å²	151.4	93%	0.927	83%	0.828	S	S	*	*			trans	-106.4	148.5	167.3	-86	162.7	0	0	0	110.5
756	S	24.6	Very low	24.8	Very low	117 Å²	117	152.2 Å²	152.2	82%	0.818	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-91.2	137.5	-167.8	-171.4	0	0	0	0	113
757	T	25.3	Very low	24.9	Very low	132 Å²	132	155.6 Å²	155.6	81%	0.81	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-77.8	130.1	172.5	47.4	0	0	0	0	111.4
758	K	23.6	Very low	24.9	Very low	206 Å²	206	156.7 Å²	156.7	90%	0.896	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.9	120	172.3	-91	-177.3	172.2	178.3	0	111.4
759	T	25.5	Very low	24.7	Very low	130 Å²	130	154.8 Å²	154.8	80%	0.798	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-78.6	134.8	166.7	2.6	0	0	0	0	110.9
760	T	25.3	Very low	25.1	Very low	139 Å²	139	155.1 Å²	155.1	85%	0.853	84%	0.837	S	S	*	*			trans	-105.4	134.8	169	38.2	0	0	0	0	110.3
761	N	23.5	Very low	25.3	Very low	144 Å²	144	157.2 Å²	157.2	77%	0.77	84%	0.842	S	S	*	*			trans	-93	131.7	-177.1	-60	-66.6	0	0	0	110.9
762	N	27.2	Very low	25.2	Very low	174 Å²	174	158.7 Å²	158.7	93%	0.93	84%	0.84	S	S	*	*			trans	-114.6	148.7	153.5	-83.1	-25.2	0	0	0	108.6
763	K	23.6	Very low	25.5	Very low	180 Å²	180	157.6 Å²	157.6	78%	0.783	84%	0.84	S	S	*	*			trans	-148.6	144.7	-152.5	-132.6	-169.6	178.5	-173.4	0	111.7
764	L	23.1	Very low	25.5	Very low	140 Å²	140	153.1 Å²	153.1	73%	0.733	83%	0.834	S	S	*	*			trans	65.8	160.5	173.5	-78.5	70.5	0	0	0	114.6
765	L	28.2	Very low	25.6	Very low	153 Å²	153	155.5 Å²	155.5	80%	0.801	83%	0.832	S	S	*	*			cis	-114	158.2	1.5	-87.9	88.4	0	0	0	113
766	N	25.9	Very low	25.7	Very low	147 Å²	147	153.9 Å²	153.9	79%	0.786	82%	0.823	S	S	*	*			trans	-84.3	157.8	160.7	-57.6	-17.7	0	0	0	110
767	N	30	Very low	25.8	Very low	163 Å²	163	155.8 Å²	155.8	87%	0.872	82%	0.823	S	S	*	*			trans	-164.3	163.5	138.8	-101.3	-10.3	0	0	0	110.8
768	E	23.6	Very low	25.9	Very low	181 Å²	181	156 Å²	156	85%	0.846	82%	0.819	S	S	*	*			trans	-107.2	136.6	-157.2	-54.5	166.8	126.4	0	0	113.6
769	C	23.8	Very low	26.1	Very low	125 Å²	125	153.9 Å²	153.9	85%	0.845	82%	0.818	S	S	*	*				-177.5	144.7	128.5	-98	0	0	0	0	111.9
770	P	33	Very low	26.3	Very low	125 Å²	125	156.6 Å²	156.6	81%	0.812	82%	0.818	S	S	*	*			trans	-96.2	124.4	-175.5	34.9	-32	0	0	0	113.8
771	I	28.2	Very low	26.4	Very low	162 Å²	162	156.8 Å²	156.8	83%	0.831	81%	0.812	S	S	*	*			trans	-123.8	131	161	-63.2	-178.7	0	0	0	108.6
772	K	23.2	Very low	26.7	Very low	202 Å²	202	156.9 Å²	156.9	88%	0.878	81%	0.811	S	S	*	*			trans	-85.6	111.5	-176.5	-65.1	175.5	-179.4	175	0	111.6
773	T	26.9	Very low	26.6	Very low	134 Å²	134	155.3 Å²	155.3	82%	0.822	80%	0.803	S	S	*	*			trans	-153.2	144.4	149.6	2	0	0	0	0	110.8
774	N	23.4	Very low	26.8	Very low	154 Å²	154	153.2 Å²	153.2	82%	0.824	80%	0.799	S	S	*	*			trans	-76.1	133.8	178.6	-50.8	-48.5	0	0	0	110.1
775	H	25.2	Very low	26.8	Very low	180 Å²	180	152.2 Å²	152.2	83%	0.833	80%	0.801	S	S	*	*			trans	-162.7	158.4	136	-109.9	-75.7	0	0	0	111
776	L	26.1	Very low	26.6	Very low	143 Å²	143	152.7 Å²	152.7	75%	0.749	80%	0.801	S	S	*	*			trans	-10.6	126	-178.9	-79.6	68.6	0	0	0	118.1
777	I	26.9	Very low	26.5	Very low	157 Å²	157	154.5 Å²	154.5	81%	0.805	80%	0.802	S	S	*	*			trans	-123.7	134.9	139	-65.6	-177.6	0	0	0	108.2	N779	I777-N779 PolarHBondContact O-N 3.36Å
778	D	28.3	Very low	26.3	Very low	136 Å²	136	153.6 Å²	153.6	73%	0.727	80%	0.796	S	S	*	*			trans	-49.5	122.1	-174.5	-52.1	-58.6	0	0	0	114	K780	D778-K780 PolarHBondContact O-N 2.78Å
779	N	27.6	Very low	26.4	Very low	163 Å²	163	149.9 Å²	149.9	87%	0.872	79%	0.785	S	S	*	*			trans	-72.9	73.6	162.3	-97.4	-28.3	0	0	0	109.6	I777 I781	I777-N779 PolarHBondContact O-N 3.36Å; N779-I781 PolarHBondContact O-N 3.39Å
780	K	30.2	Very low	26.6	Very low	187 Å²	187	149 Å²	149	81%	0.813	78%	0.78	S	S	*	*			trans	-56.1	97.5	176.2	-170.2	173.2	-170.3	168.5	0	109.6	D778 I782	D778-K780 PolarHBondContact O-N 2.78Å; K780-I782 PolarHBondContact O-N 3.3Å
781	I	27.5	Very low	26.3	Very low	142 Å²	142	152.7 Å²	152.7	73%	0.728	78%	0.784	S	S	*	*			trans	-57.4	109.6	-173.3	-61.6	178.1	0	0	0	109.6	N779 N783	N779-I781 PolarHBondContact O-N 3.39Å; I781-N783 VanDerWaalsContact C-N 3.35Å; I781-N783 PolarHBondContact O-N 3.1Å
782	I	29	Very low	26.2	Very low	146 Å²	146	148.5 Å²	148.5	75%	0.749	77%	0.773	S	S	*	*			trans	-75.5	92.6	176.3	-54.4	179.4	0	0	0	107.1	K780 I784	K780-I782 PolarHBondContact O-N 3.3Å; I782-I784 HydrophobicContact CG2-CG1 3.91Å; I782-I784 PolarHBondContact O-N 2.99Å
783	N	25.7	Very low	26.5	Very low	141 Å²	141	145 Å²	145	75%	0.754	77%	0.771	S	S	*	*			trans	-65.3	84.5	171.2	-80.3	-20.6	0	0	0	109.9	I781 P785	I781-N783 VanDerWaalsContact C-N 3.35Å; I781-N783 PolarHBondContact O-N 3.1Å; N783-P785 VanDerWaalsContact O-CD 3.27Å; N783-P785 WeakPolarHBondContact O-CD 3.04Å
784	I	26.2	Very low	26.5	Very low	136 Å²	136	144.4 Å²	144.4	70%	0.697	77%	0.767	S	S	*	*			trans	-71.6	114	169.4	-58.9	177.5	0	0	0	107.3	I782 M786	I782-I784 HydrophobicContact CG2-CG1 3.91Å; I782-I784 PolarHBondContact O-N 2.99Å; I784-M786 PolarHBondContact O-N 2.85Å
785	P	24.9	Very low	26.5	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	76%	0.764	S	S	*	*			trans	-73.9	93.7	-177.7	29.9	-33.8	0	0	0	110	N783 K787	N783-P785 VanDerWaalsContact O-CD 3.27Å; N783-P785 WeakPolarHBondContact O-CD 3.04Å; P785-K787 PolarHBondContact O-N 2.77Å
786	M	23.6	Very low	26.6	Very low	163 Å²	163	142.5 Å²	142.5	80%	0.803	76%	0.761	S	S	*	*			trans	-69.9	99.7	-177.4	-161.7	176.6	-164.7	0	0	110.6	I784 I788	I784-M786 PolarHBondContact O-N 2.85Å; M786-I788 VanDerWaalsContact C-N 3.29Å; M786-I788 PolarHBondContact O-N 3.19Å
787	K	23.9	Very low	26.5	Very low	186 Å²	186	142.4 Å²	142.4	81%	0.809	76%	0.76	S	S	*	*			trans	-75.2	73	-173.9	-167.2	175.5	-177.6	175.1	0	112.3	P785 T789	P785-K787 PolarHBondContact O-N 2.77Å; K787-T789 PolarHBondContact O-N 2.93Å
788	I	24.8	Very low	26.5	Very low	144 Å²	144	145.5 Å²	145.5	74%	0.738	76%	0.762	S	S	*	*			trans	-63.8	113.7	176.1	-61.4	174.9	0	0	0	109	M786	M786-I788 VanDerWaalsContact C-N 3.29Å; M786-I788 PolarHBondContact O-N 3.19Å
789	T	26.9	Very low	26.4	Very low	103 Å²	103	144.6 Å²	144.6	63%	0.632	76%	0.764	S	S	*	*			trans	-98.4	90.3	180	42.3	0	0	0	0	110.3	K787 K791	K787-T789 PolarHBondContact O-N 2.93Å; T789-K791 VanDerWaalsContact C-N 3.34Å; T789-K791 PolarHBondContact O-N 2.9Å
790	S	27.6	Very low	26.3	Very low	106 Å²	106	145.7 Å²	145.7	74%	0.741	76%	0.76	S	S	*	*			trans	-67.3	87.4	173.3	40	0	0	0	0	111.1	A792	S790-A792 PolarHBondContact O-N 3.46Å
791	K	26.3	Very low	26.4	Very low	202 Å²	202	142 Å²	142	88%	0.878	76%	0.755	S	S	*	*			trans	-71	66.7	171.2	-69.7	-173.4	178	-178.4	0	111.7	T789	T789-K791 VanDerWaalsContact C-N 3.34Å; T789-K791 PolarHBondContact O-N 2.9Å
792	A	27	Very low	26.4	Very low	74 Å²	74	146.3 Å²	146.3	61%	0.612	76%	0.764	S	S	*	*			trans	-96	119.3	164.7	0	0	0	0	0	108.5	S790 V794	S790-A792 PolarHBondContact O-N 3.46Å; A792-V794 PolarHBondContact O-N 3.42Å; A792-V794 VanDerWaalsContact O-N 3.12Å
793	P	27.8	Very low	26.4	Very low	128 Å²	128	146.6 Å²	146.6	83%	0.831	76%	0.762	S	S	*	*			trans	-71	108.7	179.5	27.8	-32.7	0	0	0	110.2	L795	P793-L795 PolarHBondContact O-N 2.81Å; P793-L795 VanDerWaalsContact O-N 3.08Å
794	V	26.9	Very low	26.7	Very low	122 Å²	122	147.6 Å²	147.6	74%	0.739	77%	0.767	S	S	*	*			trans	-70.6	103.5	173.6	-179.3	0	0	0	0	108.6	A792 L796	A792-V794 PolarHBondContact O-N 3.42Å; A792-V794 VanDerWaalsContact O-N 3.12Å; V794-L796 HydrophobicContact CG1-CG 4.38Å; V794-L796 PolarHBondContact O-N 3.3Å
795	L	24.7	Very low	26.9	Very low	144 Å²	144	151.5 Å²	151.5	75%	0.754	78%	0.775	S	S	*	*			trans	-77.2	88.1	-178.8	-157.3	155.2	0	0	0	109.4	P793 I797	P793-L795 PolarHBondContact O-N 2.81Å; P793-L795 VanDerWaalsContact O-N 3.08Å; L795-I797 VanDerWaalsContact C-N 3.34Å; L795-I797 HydrophobicContact CD2-CD1 4.21Å; L795-I797 HydrophobicContact CD2-CG1 3.54Å; L795-I797 PolarHBondContact O-N 2.83Å
796	L	27.4	Very low	27.2	Very low	150 Å²	150	148.5 Å²	148.5	79%	0.785	77%	0.766	S	S	*	*			trans	-68.4	84.8	179.2	-83.3	165.5	0	0	0	111.4	V794 R798	V794-L796 HydrophobicContact CG1-CG 4.38Å; V794-L796 PolarHBondContact O-N 3.3Å; L796-R798 VanDerWaalsContact C-N 3.3Å; L796-R798 PolarHBondContact O-N 3.01Å
797	I	23.2	Very low	27.3	Very low	142 Å²	142	146.9 Å²	146.9	73%	0.728	77%	0.769	S	S	*	*			trans	-69.1	90.1	166.8	-53.8	178.9	0	0	0	108.1	L795	L795-I797 VanDerWaalsContact C-N 3.34Å; L795-I797 HydrophobicContact CD2-CD1 4.21Å; L795-I797 HydrophobicContact CD2-CG1 3.54Å; L795-I797 PolarHBondContact O-N 2.83Å
798	R	26.7	Very low	27.7	Very low	221 Å²	221	148.6 Å²	148.6	83%	0.834	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-60.9	132.6	161.7	-72.9	-174.4	175.3	-172.4	-2.4	107.8	L796 K800	L796-R798 VanDerWaalsContact C-N 3.3Å; L796-R798 PolarHBondContact O-N 3.01Å; R798-K800 PolarHBondContact O-N 2.93Å
799	P	26	Very low	28	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-54.9	128.2	170.3	-23.1	33.4	0	0	0	109.2
800	K	26.6	Very low	28.2	Very low	185 Å²	185	148.1 Å²	148.1	80%	0.804	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-62.1	135.1	166.1	-74.6	-174.2	175.6	-177.5	0	107.2	R798	R798-K800 PolarHBondContact O-N 2.93Å
801	P	30.8	Very low	28.4	Very low	109 Å²	109	148.3 Å²	148.3	71%	0.708	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-57.3	147.1	170.6	26.8	-34	0	0	0	108.9	H803	P801-H803 PolarHBondContact O-N 2.83Å
802	Y	27.8	Very low	29	Very low	233 Å²	233	146.7 Å²	146.7	91%	0.914	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.2	116.9	174.1	-85.5	-104.2	0	0	0	108.5	D804	Y802-D804 PolarHBondContact O-N 3.05Å
803	H	30.5	Very low	29.5	Very low	152 Å²	152	149.1 Å²	149.1	70%	0.704	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.4	119.7	158.8	-85.6	-83.1	0	0	0	106.8	P801 Y805	P801-H803 PolarHBondContact O-N 2.83Å; H803-Y805 PolarHBondContact O-N 3.27Å
804	D	30.7	Very low	29.8	Very low	162 Å²	162	151.3 Å²	151.3	87%	0.866	77%	0.773	S	S	*	*			trans	-55.5	108.9	161.2	-84.6	-48.8	0	0	0	108	Y802 G806	Y802-D804 PolarHBondContact O-N 3.05Å; D804-G806 PolarHBondContact O-N 3.23Å
805	Y	30.5	Very low	30	Very low	219 Å²	219	156.8 Å²	156.8	86%	0.859	78%	0.781	S	S	*	*			trans	-71.8	84.9	165.7	-84.8	-88.1	0	0	0	107.2	H803 C807	H803-Y805 PolarHBondContact O-N 3.27Å; Y805-C807 PolarHBondContact O-N 3.07Å
806	G	30.6	Very low	30.4	Very low	56 Å²	56	157.7 Å²	157.7	58%	0.577	78%	0.779	S	S	*	*			trans	-48.9	125	175.1	0	0	0	0	0	109.8	D804 Y808	D804-G806 PolarHBondContact O-N 3.23Å; G806-Y808 PolarHBondContact O-N 3.38Å
807	C	27.6	Very low	30.6	Very low	129 Å²	129	159.3 Å²	159.3	87%	0.872	78%	0.782	S	S	*	*			trans	-57.1	105	-174.9	-62.7	0	0	0	0	110.2	Y805 G809	Y805-C807 PolarHBondContact O-N 3.07Å; C807-G809 PolarHBondContact O-N 3.12Å; C807-G809 VanDerWaalsContact O-N 3.09Å
808	Y	30.9	Very low	30.9	Very low	221 Å²	221	160.9 Å²	160.9	87%	0.867	79%	0.79	S	S	*	*			trans	-60.2	116.3	169.1	-92.9	-96	0	0	0	108	G806 I810	G806-Y808 PolarHBondContact O-N 3.38Å; Y808-I810 PolarHBondContact O-N 3.02Å
809	G	31.1	Very low	31.1	Very low	76 Å²	76	155 Å²	155	78%	0.784	78%	0.779	S	S	*	*			trans	-63.1	103.3	-174.6	0	0	0	0	0	111.1	C807 N811	C807-G809 PolarHBondContact O-N 3.12Å; C807-G809 VanDerWaalsContact O-N 3.09Å; G809-N811 PolarHBondContact O-N 3.5Å
810	I	30.9	Very low	31.1	Very low	161 Å²	161	157 Å²	157	83%	0.826	78%	0.778	S	S	*	*			trans	-67.9	114.6	167.5	-61.5	178.6	0	0	0	106.7	Y808 E812	Y808-I810 PolarHBondContact O-N 3.02Å; I810-E812 PolarHBondContact O-N 3.4Å
811	N	33.3	Very low	31.1	Very low	111 Å²	111	156.8 Å²	156.8	59%	0.594	79%	0.785	S	S	*	*			trans	-57.4	114.8	-170.2	-169	-1.1	0	0	0	111.3	G809 N813	G809-N811 PolarHBondContact O-N 3.5Å; N811-N813 PolarHBondContact O-N 2.99Å
812	E	37.2	Very low	31	Very low	168 Å²	168	156.7 Å²	156.7	79%	0.785	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-63.2	-15	-168.6	-68.9	-159.1	125.1	0	0	114.7	I810 E814 R815	I810-E812 PolarHBondContact O-N 3.4Å; E812-E814 PolarHBondContact O-N 2.86Å; E812-R815 PolarHBondContact O-N 2.96Å
813	N	38.4	Very low	30.9	Very low	124 Å²	124	150.7 Å²	150.7	66%	0.663	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-71.2	-28.4	-174.5	-72.6	-31.2	0	0	0	114.5	N811 R815	N811-N813 PolarHBondContact O-N 2.99Å; N813-R815 PolarHBondContact O-N 2.89Å
814	E	34	Very low	30.6	Very low	174 Å²	174	149.5 Å²	149.5	81%	0.813	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-76.5	-9.4	178.3	-70.9	-170.5	143.3	0	0	113.4	E812 K816	E812-E814 PolarHBondContact O-N 2.86Å; E814-K816 VanDerWaalsContact C-N 3.27Å; E814-K816 PolarHBondContact O-N 3.11Å
815	R	30.5	Very low	30.5	Very low	237 Å²	237	147.7 Å²	147.7	89%	0.894	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-86.3	15	-178	-145	179.3	-175	-175.7	1.8	114.6	E812 N813	E812-R815 PolarHBondContact O-N 2.96Å; N813-R815 PolarHBondContact O-N 2.89Å
816	K	34.7	Very low	30.3	Very low	164 Å²	164	144.6 Å²	144.6	71%	0.713	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-115.8	-4.2	-175.6	-79	-178	176.9	170.4	0	116.6	E814	E814-K816 VanDerWaalsContact C-N 3.27Å; E814-K816 PolarHBondContact O-N 3.11Å
817	E	29.9	Very low	30.2	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	78%	0.776	S	S	*	*			trans	-106.8	13.6	-178.1	-66.2	-157.1	132.7	0	0	115.7	T819	E817-T819 PolarHBondContact O-N 3.1Å
818	I	30.9	Very low	30.3	Very low	175 Å²	175	146.8 Å²	146.8	90%	0.897	77%	0.772	S	S	*	*			trans	-97.3	74.1	165.7	-52.3	-176.4	0	0	0	109.1
819	T	29.3	Very low	30.2	Very low	99 Å²	99	143.7 Å²	143.7	61%	0.607	77%	0.771	S	S	*	*			trans	-102.4	124.3	-176.9	-56.4	0	0	0	0	111	E817	E817-T819 PolarHBondContact O-N 3.1Å
820	Q	26.6	Very low	30.2	Very low	159 Å²	159	148.8 Å²	148.8	74%	0.743	77%	0.774	S	S	*	*			trans	56.5	88.9	162.7	-65.1	170.1	21.6	0	0	117.9
821	L	27.1	Very low	30.1	Very low	180 Å²	180	149.8 Å²	149.8	94%	0.942	78%	0.775	S	S	*	*			trans	-112.4	89.5	139	-91.1	170.5	0	0	0	108.6	S823	L821-S823 PolarHBondContact O-N 3.29Å
822	T	28.2	Very low	29.8	Very low	108 Å²	108	151 Å²	151	66%	0.663	79%	0.787	S	S	*	*			trans	-85.7	96.3	-168.7	-45.4	0	0	0	0	111.3	T824	T822-T824 PolarHBondContact O-N 3.37Å
823	S	25.3	Very low	29.3	Very low	107 Å²	107	148.3 Å²	148.3	75%	0.748	78%	0.782	S	S	*	*			trans	-82.8	103	171.3	46.2	0	0	0	0	111.1	L821 V825	L821-S823 PolarHBondContact O-N 3.29Å; S823-V825 PolarHBondContact O-N 3.03Å; S823-V825 VanDerWaalsContact O-N 3.1Å
824	T	25.2	Very low	28.6	Very low	126 Å²	126	148.3 Å²	148.3	77%	0.773	79%	0.787	S	S	*	*			trans	-67.6	105.5	-175.1	-46.7	0	0	0	0	112.5	T822	T822-T824 PolarHBondContact O-N 3.37Å
825	V	27.5	Very low	28.1	Very low	125 Å²	125	146.6 Å²	146.6	76%	0.758	78%	0.782	S	S	*	*			trans	-110.6	122.9	166.6	-178.7	0	0	0	0	108.7	S823 S827	S823-V825 PolarHBondContact O-N 3.03Å; S823-V825 VanDerWaalsContact O-N 3.1Å; V825-S827 PolarHBondContact O-N 3.09Å; V825-S827 VanDerWaalsContact O-N 3.16Å
826	I	27.5	Very low	27.8	Very low	153 Å²	153	141.5 Å²	141.5	79%	0.785	78%	0.777	S	S	*	*			trans	-76.8	103.5	-174.6	-59.6	173.6	0	0	0	109.5
827	S	27.8	Very low	27.3	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	78%	0.778	S	S	*	*			trans	-86	107.5	176.8	42.9	0	0	0	0	111.8	V825 N829	V825-S827 PolarHBondContact O-N 3.09Å; V825-S827 VanDerWaalsContact O-N 3.16Å; S827-N829 PolarHBondContact O-N 3.16Å
828	T	30.5	Very low	26.9	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	77%	0.773	S	S	*	*			trans	-77.8	117.8	167.9	46.9	0	0	0	0	110.4	Q830	T828-Q830 PolarHBondContact O-N 3.18Å
829	N	28	Very low	26.6	Very low	156 Å²	156	133.8 Å²	133.8	83%	0.834	77%	0.769	S	S	*	*			trans	-59.2	124.8	-178.2	-70.9	-43.8	0	0	0	113	S827	S827-N829 PolarHBondContact O-N 3.16Å
830	Q	31.1	Very low	26.2	Very low	184 Å²	184	135.3 Å²	135.3	86%	0.86	78%	0.779	S	S	*	*			trans	-132.8	124.8	153.5	-67.3	-167.8	-0	0	0	108.4	T828	T828-Q830 PolarHBondContact O-N 3.18Å
831	Q	29.4	Very low	26	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	79%	0.787	S	S	*	*			trans	-86.8	124.1	-173.9	-70.4	173.7	-30.6	0	0	110.7	T833	Q831-T833 PolarHBondContact O-N 2.81Å
832	T	26.3	Very low	25.8	Very low	138 Å²	138	132.6 Å²	132.6	85%	0.847	78%	0.781	S	S	*	*			trans	-84.2	91.4	177.9	-45.1	0	0	0	0	110.5	T834	T832-T834 PolarHBondContact O-N 2.82Å
833	T	26.9	Very low	25.5	Very low	110 Å²	110	136.2 Å²	136.2	68%	0.675	79%	0.79	S	S	*	*			trans	-80.8	106.8	-178.9	-47.2	0	0	0	0	111.6	Q831 I835	Q831-T833 PolarHBondContact O-N 2.81Å; T833-I835 PolarHBondContact O-N 2.89Å
834	T	23.1	Very low	25.6	Very low	125 Å²	125	138.9 Å²	138.9	77%	0.767	80%	0.795	S	S	*	*			trans	-70	115.3	174.7	-51.1	0	0	0	0	111	T832	T832-T834 PolarHBondContact O-N 2.82Å
835	I	24.8	Very low	25.5	Very low	138 Å²	138	139 Å²	139	71%	0.708	79%	0.792	S	S	*	*			trans	-104.8	113.2	176.5	-60.5	177.3	0	0	0	109.6	T833	T833-I835 PolarHBondContact O-N 2.89Å
836	T	22.9	Very low	25.5	Very low	129 Å²	129	140.9 Å²	140.9	79%	0.791	80%	0.797	S	S	*	*			trans	-89.8	110.7	175	-55.1	0	0	0	0	109.9
837	T	24.8	Very low	25.3	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	79%	0.793	S	S	*	*			trans	-95.2	109.9	-176.4	-39	0	0	0	0	111.6
838	S	22.2	Very low	25.3	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	80%	0.802	S	S	*	*			trans	-95	122.5	173.1	54.5	0	0	0	0	111.4
839	T	23.3	Very low	25	Very low	133 Å²	133	141.4 Å²	141.4	82%	0.816	80%	0.801	S	S	*	*			trans	-91.9	119.5	-176.8	48.1	0	0	0	0	113
840	T	21.8	Very low	24.9	Very low	132 Å²	132	145.2 Å²	145.2	81%	0.81	81%	0.805	S	S	*	*			trans	-107.3	124.1	170	48.3	0	0	0	0	111.3
841	T	22	Very low	24.4	Very low	148 Å²	148	139.7 Å²	139.7	91%	0.908	80%	0.798	S	S	*	*			trans	-88.7	127.1	-178.9	1.4	0	0	0	0	112
842	T	23.3	Very low	24.1	Very low	133 Å²	133	139.6 Å²	139.6	82%	0.816	80%	0.799	S	S	*	*			trans	-129.1	123.8	169.3	43.1	0	0	0	0	110.8
843	H	22.4	Very low	24	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.856	80%	0.798	S	S	*	*			trans	-67.7	144.9	169.3	-84.8	-94.4	0	0	0	110.4
844	N	26.4	Very low	23.8	Very low	162 Å²	162	145.7 Å²	145.7	87%	0.866	81%	0.807	S	S	*	*			trans	-153.1	145.1	140.4	-138.2	-18.7	0	0	0	112.1
845	N	23.3	Very low	24	Very low	129 Å²	129	143.1 Å²	143.1	69%	0.69	81%	0.806	S	S	*	*			trans	-98.1	142.8	176.6	-66.1	-24.1	0	0	0	109.5
846	N	27.8	Very low	23.8	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	81%	0.809	S	S	*	*				177.4	149.8	118.3	-88.8	-15.8	0	0	0	111.9
847	S	23.6	Very low	24	Very low	101 Å²	101	147.6 Å²	147.6	71%	0.706	81%	0.812	S	S	*	*			trans	-81.1	156.9	169.6	48.3	0	0	0	0	111.5
848	N	27.1	Very low	24.1	Very low	167 Å²	167	148.2 Å²	148.2	89%	0.893	82%	0.815	S	S	*	*			trans	-159.8	154.3	132.5	-105.7	-27.7	0	0	0	111.7
849	V	24.3	Very low	24.1	Very low	127 Å²	127	152.1 Å²	152.1	77%	0.77	82%	0.819	S	S	*	*			trans	-108.3	133.6	-174.9	174.6	0	0	0	0	109.7
850	Y	26.5	Very low	24.3	Very low	237 Å²	237	151.5 Å²	151.5	93%	0.929	82%	0.817	S	S	*	*			trans	-151.4	165.5	152.8	-90.7	-69.3	0	0	0	109
851	G	21.4	Very low	24.4	Very low	68 Å²	68	154.1 Å²	154.1	70%	0.701	82%	0.82	S	S	*	*			trans	-160.4	-142.3	-175.6	0	0	0	0	0	113.1
852	M	22.3	Very low	24.6	Very low	178 Å²	178	154.1 Å²	154.1	88%	0.877	82%	0.82	S	S	*	*			trans	87.5	129.8	178.6	-74.5	-66.9	-169.1	0	0	120
853	N	23.8	Very low	24.8	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	82%	0.819	S	S	*	*			trans	82.8	138.2	147.5	-85.3	-12.2	0	0	0	123.3
854	Y	23	Very low	24.8	Very low	225 Å²	225	150.9 Å²	150.9	88%	0.882	82%	0.818	S	S	*	*			trans	-105	155	179.2	-77.4	-105.4	0	0	0	110.5
855	G	26.2	Very low	24.8	Very low	72 Å²	72	147.8 Å²	147.8	74%	0.742	82%	0.815	S	S	*	*			trans	-142.8	119.3	165.9	0	0	0	0	0	110.2
856	N	22.3	Very low	25	Very low	143 Å²	143	147.9 Å²	147.9	77%	0.765	82%	0.82	S	S	*	*			trans	-90.8	136.6	-179.3	-69.1	-25.9	0	0	0	111
857	Y	27.2	Very low	24.9	Very low	217 Å²	217	150.1 Å²	150.1	85%	0.851	82%	0.822	S	S	*	*			trans	-138	142.2	158.8	-83.2	-77.7	0	0	0	110.4
858	V	25	Very low	24.9	Very low	133 Å²	133	150.2 Å²	150.2	81%	0.806	82%	0.823	S	S	*	*			trans	-116.2	135.2	-174.9	176	0	0	0	0	108.9
859	F	23.6	Very low	24.6	Very low	190 Å²	190	147.6 Å²	147.6	83%	0.833	82%	0.816	S	S	*	*			trans	-123.5	130.6	173.1	-83.7	-88.2	0	0	0	110.1
860	P	26.2	Very low	24.7	Very low	120 Å²	120	150 Å²	150	78%	0.779	82%	0.819	S	S	*	*			trans	-84.4	150.3	175.2	33.9	-33.8	0	0	0	112.2
861	E	24	Very low	24.5	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.874	81%	0.812	S	S	*	*			trans	-77.8	160.9	178.3	-55.4	171.3	122.4	0	0	112.4
862	T	27.1	Very low	24.7	Very low	147 Å²	147	149.3 Å²	149.3	90%	0.902	82%	0.819	S	S	*	*			trans	-153	156.2	150.8	-14.7	0	0	0	0	111
863	S	26.2	Very low	24.8	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	81%	0.813	S	S	*	*			trans	-91.8	153.3	-152.8	46.6	0	0	0	0	116.7
864	V	23.5	Very low	24.9	Very low	138 Å²	138	149.7 Å²	149.7	84%	0.836	82%	0.817	S	S	*	*			trans	-49.2	134.6	171.9	177.1	0	0	0	0	112.5
865	A	26.6	Very low	25.3	Very low	96 Å²	96	144.6 Å²	144.6	79%	0.793	81%	0.811	S	S	*	*			trans	-118.2	132.1	161.6	0	0	0	0	0	110
866	T	26.9	Very low	25.4	Very low	131 Å²	131	149.7 Å²	149.7	80%	0.804	82%	0.821	S	S	*	*			trans	-80.2	145.7	-176.1	46.1	0	0	0	0	112.5
867	K	26.1	Very low	25.6	Very low	212 Å²	212	147.7 Å²	147.7	92%	0.922	82%	0.818	S	S	*	*			trans	-136.6	152.6	159.2	-83.4	-161.3	174.3	179.4	0	113.1
868	S	24.4	Very low	25.4	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	81%	0.814	S	S	*	*			trans	-72.7	150.2	-161.3	46.7	0	0	0	0	115.5
869	C	20	Very low	25.5	Very low	111 Å²	111	144.3 Å²	144.3	75%	0.75	82%	0.817	S	S	*	*			trans	-57.1	146.7	162.3	-174.6	0	0	0	0	111.5
870	H	26.4	Very low	25.5	Very low	178 Å²	178	144.6 Å²	144.6	82%	0.824	81%	0.813	S	S	*	*			trans	-122.2	119.6	159.9	-112.4	-80.5	0	0	0	108.6
871	Q	22.9	Very low	25.5	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	82%	0.816	S	S	*	*			trans	-80.8	137.6	167.6	-69.1	174.1	-41.7	0	0	109.3
872	S	25.7	Very low	25.5	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	80%	0.8	S	S	*	*			trans	-121.3	127.7	156.1	54.6	0	0	0	0	108.4
873	I	24	Very low	25.5	Very low	145 Å²	145	143.7 Å²	143.7	74%	0.744	80%	0.795	S	S	*	*			trans	-99.9	131.6	178.6	-62.7	169.6	0	0	0	107.4
874	Q	25.8	Very low	25.6	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	80%	0.797	S	S	*	*			trans	-126.8	129.8	151.7	-78.8	-161.2	-27.4	0	0	109.3
875	P	31.7	Very low	25.7	Very low	118 Å²	118	148.1 Å²	148.1	77%	0.766	80%	0.796	S	S	*	*			trans	-86	146.4	178.1	34.5	-33.2	0	0	0	111
876	L	27.5	Very low	25.6	Very low	180 Å²	180	151.6 Å²	151.6	94%	0.942	80%	0.801	S	S	*	*			trans	-119.4	136.2	159	-96	164.7	0	0	0	109
877	S	27	Very low	25.6	Very low	100 Å²	100	154.2 Å²	154.2	70%	0.699	80%	0.804	S	S	*	*			trans	-91.5	133.9	-158.7	52.9	0	0	0	0	113.7
878	S	22.9	Very low	25.7	Very low	111 Å²	111	151 Å²	151	78%	0.776	80%	0.802	S	S	*	*			trans	8.4	110.2	148.3	57.3	0	0	0	0	117.6
879	I	26.7	Very low	25.8	Very low	169 Å²	169	150 Å²	150	87%	0.867	80%	0.795	S	S	*	*			trans	-100.3	132.9	142.5	-65.4	179.2	0	0	0	106.8
880	R	23	Very low	26	Very low	196 Å²	196	150 Å²	150	74%	0.74	80%	0.797	S	S	*	*			trans	-114.8	124.4	-176.5	173.6	-169.6	-177.1	170.5	4.8	107.8	D882	R880-D882 IonicContact CZ-OD2 2.64Å; R880-D882 IonicContact NE-OD2 3.06Å; R880-D882 PolarHBondContact NE-OD2 2.87Å; R880-D882 IonicContact NH2-OD2 3.17Å; R880-D882 PolarHBondContact NH2-OD2 2.87Å
881	N	27.1	Very low	26	Very low	159 Å²	159	149.3 Å²	149.3	85%	0.85	79%	0.793	S	S	*	*			trans	-135.8	122.7	159.2	-86.8	-28.8	0	0	0	107.4
882	D	25	Very low	26.2	Very low	100 Å²	100	147.4 Å²	147.4	54%	0.535	79%	0.793	S	S	.	*			trans	-88.7	170.9	173.4	-73.4	-73.6	0	0	0	109.3	R880	R880-D882 IonicContact CZ-OD2 2.64Å; R880-D882 IonicContact NE-OD2 3.06Å; R880-D882 PolarHBondContact NE-OD2 2.87Å; R880-D882 IonicContact NH2-OD2 3.17Å; R880-D882 PolarHBondContact NH2-OD2 2.87Å
883	H	25.8	Very low	26.2	Very low	175 Å²	175	150.7 Å²	150.7	81%	0.81	79%	0.793	S	S	*	*			trans	75.1	144.2	-178.9	-51.5	-92.9	0	0	0	115.4
884	D	28.5	Very low	26.3	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	79%	0.791	S	S	*	*			cis	-123.3	158.6	10.2	-112.5	-43.7	0	0	0	115.6
885	K	25.9	Very low	26.2	Very low	192 Å²	192	146 Å²	146	84%	0.835	79%	0.786	S	S	*	*			trans	-121.9	76.2	-170.1	-168.2	-177.8	-177.3	-179.1	0	111.8	Q887	K885-Q887 PolarHBondContact O-N 2.84Å
886	L	25.3	Very low	25.9	Very low	170 Å²	170	148.4 Å²	148.4	89%	0.89	79%	0.791	S	S	*	*			trans	-57.8	107.8	179.8	-82.9	164.2	0	0	0	112.4
887	Q	26.1	Very low	25.9	Very low	185 Å²	185	146 Å²	146	86%	0.864	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.2	117.7	166.8	-70.7	-174	-46	0	0	109.5	K885 S889	K885-Q887 PolarHBondContact O-N 2.84Å; Q887-S889 PolarHBondContact O-N 3.03Å
888	V	27.7	Very low	25.9	Very low	144 Å²	144	147.6 Å²	147.6	87%	0.873	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78.4	117.1	168.9	179.6	0	0	0	0	108.5
889	S	26.1	Very low	26.2	Very low	82 Å²	82	149.6 Å²	149.6	57%	0.573	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.5	127.1	-178.4	51.7	0	0	0	0	111.9	Q887 H891	Q887-S889 PolarHBondContact O-N 3.03Å; S889-H891 PolarHBondContact O-N 3.34Å
890	S	25.4	Very low	26.2	Very low	113 Å²	113	147.6 Å²	147.6	79%	0.79	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.4	117.9	169.7	46.6	0	0	0	0	110.2	T892	S890-T892 PolarHBondContact O-N 3.24Å
891	H	26.8	Very low	26.5	Very low	162 Å²	162	145.4 Å²	145.4	75%	0.75	78%	0.784	S	S	*	*			trans	-79	107.4	177.4	-69.6	-73.8	0	0	0	111	S889 F893	S889-H891 PolarHBondContact O-N 3.34Å; H891-F893 PolarHBondContact O-N 2.79Å
892	T	26.5	Very low	26.5	Very low	130 Å²	130	143.5 Å²	143.5	80%	0.798	77%	0.774	S	S	*	*			trans	-74.5	113.4	172.3	-48.1	0	0	0	0	110.3	S890	S890-T892 PolarHBondContact O-N 3.24Å
893	F	24.6	Very low	26.7	Very low	191 Å²	191	145.7 Å²	145.7	84%	0.838	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-81.3	118.3	171.1	-96.8	-96	0	0	0	110.8	H891	H891-F893 PolarHBondContact O-N 2.79Å
894	T	26	Very low	27	Very low	117 Å²	117	145.9 Å²	145.9	72%	0.718	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-81	123.7	168.3	47.9	0	0	0	0	110.2
895	P	25.3	Very low	27	Very low	121 Å²	121	145.3 Å²	145.3	79%	0.786	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-71.9	133.1	-180	29	-34	0	0	0	111.4
896	I	25.5	Very low	27.4	Very low	168 Å²	168	143.8 Å²	143.8	86%	0.862	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.1	128.2	178	-62.7	174.6	0	0	0	109.3
897	T	27.6	Very low	27.5	Very low	128 Å²	128	143.5 Å²	143.5	79%	0.785	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.6	130.1	-174.7	-25.2	0	0	0	0	111.6	I899	T897-I899 PolarHBondContact O-N 3.31Å
898	T	26.9	Very low	27.7	Very low	135 Å²	135	140.1 Å²	140.1	83%	0.828	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-68.6	123	179.1	-35.5	0	0	0	0	111.2
899	I	27.9	Very low	27.6	Very low	152 Å²	152	140.3 Å²	140.3	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-81.1	128.6	173.4	-63.8	177.4	0	0	0	109.1	T897	T897-I899 PolarHBondContact O-N 3.31Å
900	N	26.5	Very low	27.6	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	79%	0.789	S	S	*	*			trans	-102.4	110.5	-173.4	-173.4	27.7	0	0	0	110.8
901	N	29.4	Very low	27.6	Very low	150 Å²	150	148.1 Å²	148.1	80%	0.802	80%	0.797	S	S	*	*			trans	-101.3	117.6	178.2	-82.9	-6.3	0	0	0	111.2
902	N	28.5	Very low	27.7	Very low	119 Å²	119	147.8 Å²	147.8	64%	0.636	80%	0.8	S	S	*	*			trans	-93	164.4	177.8	-68.2	-46.7	0	0	0	112.5
903	N	29.3	Very low	27.7	Very low	145 Å²	145	148.6 Å²	148.6	78%	0.775	80%	0.799	S	S	*	*			trans	72	136.8	168.7	-47.9	-29	0	0	0	114.4
904	H	31.6	Very low	27.8	Very low	179 Å²	179	144.4 Å²	144.4	83%	0.829	79%	0.794	S	S	*	*			cis	-141.5	161.6	35.7	-106.9	-83.4	0	0	0	115.1
905	N	29.3	Very low	27.7	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	80%	0.797	S	S	*	*			trans	-65.5	153.3	168.8	-57.9	-31.2	0	0	0	112.7
906	N	32.8	Very low	27.8	Very low	161 Å²	161	146.4 Å²	146.4	86%	0.861	80%	0.799	S	S	*	*				-164.3	155.5	118.1	-99.6	-28.3	0	0	0	112.9
907	N	27.5	Very low	27.7	Very low	163 Å²	163	142.7 Å²	142.7	87%	0.872	79%	0.793	S	S	*	*			trans	-86.6	135	-176.2	-67.4	-42.7	0	0	0	112.4
908	S	30	Very low	27.6	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	80%	0.799	S	S	*	*			trans	-150.5	104.5	158.9	58.8	0	0	0	0	111
909	T	25.8	Very low	27.4	Very low	149 Å²	149	146.1 Å²	146.1	91%	0.914	80%	0.797	S	S	*	*			trans	-86.3	113	179.5	48.6	0	0	0	0	111.9
910	S	27.5	Very low	27.6	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	80%	0.798	S	S	*	*			trans	-146.6	135.4	164.3	53.9	0	0	0	0	110.8
911	R	25.1	Very low	27.5	Very low	255 Å²	255	147.9 Å²	147.9	96%	0.962	81%	0.806	S	S	*	*			trans	-76.3	125.3	176.7	-62.4	171	177.4	160.3	-4	109.9
912	I	28.6	Very low	27.1	Very low	155 Å²	155	146.9 Å²	146.9	80%	0.795	81%	0.805	S	S	*	*			trans	-137.6	146.8	159.7	-62.8	-175	0	0	0	107.4
913	D	26.8	Very low	27	Very low	148 Å²	148	150.9 Å²	150.9	79%	0.791	81%	0.813	S	S	*	*			trans	-69.8	159.3	-164.6	-59.4	-82.4	0	0	0	115.6	S915	D913-S915 PolarHBondContact O-N 3.37Å
914	S	27.1	Very low	26.6	Very low	103 Å²	103	148.6 Å²	148.6	72%	0.72	81%	0.808	S	S	*	*			trans	-80.3	81.6	-155.4	-52.3	0	0	0	0	115	M916	S914-M916 PolarHBondContact O-N 2.88Å
915	S	23.7	Very low	26.1	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	81%	0.807	S	S	*	*			trans	-69.1	79.1	154.7	48.2	0	0	0	0	109.9	D913 A917	D913-S915 PolarHBondContact O-N 3.37Å; S915-A917 VanDerWaalsContact C-N 3.34Å; S915-A917 PolarHBondContact O-N 2.85Å
916	M	25.6	Very low	25.9	Very low	166 Å²	166	145.2 Å²	145.2	82%	0.818	81%	0.81	S	S	*	*			trans	-69.8	82.9	-172.8	-68	-157.6	-73.7	0	0	113.5	S914	S914-M916 PolarHBondContact O-N 2.88Å
917	A	24.9	Very low	25.4	Very low	89 Å²	89	143.8 Å²	143.8	74%	0.736	81%	0.807	S	S	*	*			trans	-64.7	141.8	153.3	0	0	0	0	0	109.8	S915 T919	S915-A917 VanDerWaalsContact C-N 3.34Å; S915-A917 PolarHBondContact O-N 2.85Å; A917-T919 PolarHBondContact O-N 3.11Å
918	F	24	Very low	25.2	Very low	208 Å²	208	142.4 Å²	142.4	91%	0.912	81%	0.809	S	S	*	*			trans	-71.2	127.1	-169.7	-75.7	-105.9	0	0	0	113
919	T	24	Very low	24.8	Very low	127 Å²	127	145.9 Å²	145.9	78%	0.779	81%	0.812	S	S	*	*			trans	-130.9	146.8	152.7	43.6	0	0	0	0	109.6	A917	A917-T919 PolarHBondContact O-N 3.11Å
920	P	30.9	Very low	24.7	Very low	125 Å²	125	146.5 Å²	146.5	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.5	132.5	-158.2	33.5	-34.8	0	0	0	113.9
921	F	24.3	Very low	24.5	Very low	192 Å²	192	147 Å²	147	84%	0.842	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-89.9	120.9	166.5	-94.7	-85.9	0	0	0	111.6	Y923	F921-Y923 HydrophobicContact CD1-CD2 4.27Å; F921-Y923 HydrophobicContact CD1-CE2 4.37Å
922	V	22.2	Very low	24.4	Very low	130 Å²	130	143.9 Å²	143.9	79%	0.788	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.6	127.5	160.9	175.5	0	0	0	0	108
923	Y	25	Very low	24.3	Very low	203 Å²	203	142.2 Å²	142.2	80%	0.796	80%	0.801	S	S	*	*			trans	-144.1	156.7	160.5	-107	-75.7	0	0	0	112.4	F921	F921-Y923 HydrophobicContact CD1-CD2 4.27Å; F921-Y923 HydrophobicContact CD1-CE2 4.37Å
924	S	22.8	Very low	24.1	Very low	97 Å²	97	144.1 Å²	144.1	68%	0.678	81%	0.805	S	S	*	*			trans	-89.9	150.6	-157	51.3	0	0	0	0	115.6
925	S	20.6	Very low	23.9	Very low	115 Å²	115	148.5 Å²	148.5	80%	0.804	81%	0.811	S	S	*	*			trans	-70.2	144.2	167.5	52.7	0	0	0	0	113.2
926	T	24.1	Very low	24	Very low	133 Å²	133	150 Å²	150	82%	0.816	82%	0.816	S	S	*	*			trans	-128	132.9	162.8	46.5	0	0	0	0	110.4
927	T	23	Very low	24	Very low	131 Å²	131	148.4 Å²	148.4	80%	0.804	82%	0.816	S	S	*	*			trans	-95.2	139.1	-176.1	48.4	0	0	0	0	111.7
928	C	22.7	Very low	24	Very low	134 Å²	134	151.1 Å²	151.1	91%	0.905	82%	0.823	S	S	*	*			trans	-119.2	147.4	169.3	-70.3	0	0	0	0	110.5
929	H	21.8	Very low	24.3	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.866	82%	0.821	S	S	*	*			trans	-103.8	156.7	-160	-132.4	-85.4	0	0	0	114.1
930	E	23	Very low	24.5	Very low	161 Å²	161	146.8 Å²	146.8	75%	0.752	83%	0.825	S	S	*	*			trans	-79.5	151.8	171.9	-57.2	179.1	121.8	0	0	112.8
931	S	23.9	Very low	24.3	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	83%	0.829	S	S	*	*			trans	-157.7	125.4	161.4	62.4	0	0	0	0	112.3
932	F	22.9	Very low	24.3	Very low	190 Å²	190	145.1 Å²	145.1	83%	0.833	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-94.3	143.4	179	-80.5	-108.8	0	0	0	112.8
933	P	25.8	Very low	24.4	Very low	119 Å²	119	145.3 Å²	145.3	77%	0.773	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-99.9	154.1	165.1	36.2	-30.6	0	0	0	113.2
934	H	22.7	Very low	24.4	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.875	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-91.7	162.5	-173.6	-109	-100.8	0	0	0	115.2
935	F	24.8	Very low	24.4	Very low	194 Å²	194	148.2 Å²	148.2	85%	0.851	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-84.6	159	179.2	-69	-101.7	0	0	0	114.2
936	T	25.8	Very low	24.6	Very low	146 Å²	146	152 Å²	152	90%	0.896	85%	0.847	S	S	*	*			trans	-155.1	165.3	151.6	5.3	0	0	0	0	110.7
937	T	25	Very low	24.6	Very low	133 Å²	133	151.9 Å²	151.9	82%	0.816	85%	0.849	S	S	*	*			trans	-118.4	149.8	-156	5.5	0	0	0	0	114.6
938	T	24.8	Very low	24.6	Very low	146 Å²	146	154.3 Å²	154.3	90%	0.896	85%	0.852	S	S	*	*			trans	-155.9	161.9	155.5	-18	0	0	0	0	112.1
939	T	30.1	Very low	24.6	Very low	139 Å²	139	159.3 Å²	159.3	85%	0.853	85%	0.851	S	S	*	*			trans	-100.4	153.5	-165.9	47.1	0	0	0	0	114.8
940	A	27.4	Very low	24.8	Very low	105 Å²	105	156 Å²	156	87%	0.868	84%	0.844	S	S	*	*			trans	-142.4	158.1	167.6	0	0	0	0	0	111.6
941	T	27.7	Very low	24.8	Very low	146 Å²	146	155.1 Å²	155.1	90%	0.896	85%	0.845	S	S	*	*			trans	-110.2	158.8	-169	43.8	0	0	0	0	114.4
942	T	25.1	Very low	24.9	Very low	135 Å²	135	158.7 Å²	158.7	83%	0.828	85%	0.846	S	S	*	*			trans	-91.2	144.1	-178.2	47.7	0	0	0	0	114
943	T	24.3	Very low	24.9	Very low	135 Å²	135	155.9 Å²	155.9	83%	0.828	85%	0.845	S	S	*	*			trans	-135	148	157	47.9	0	0	0	0	110.7
944	T	24.1	Very low	24.9	Very low	135 Å²	135	156.1 Å²	156.1	83%	0.828	84%	0.844	S	S	*	*			trans	-109	148	-177.1	45.9	0	0	0	0	111.6
945	Y	22.5	Very low	25	Very low	226 Å²	226	152.6 Å²	152.6	89%	0.886	84%	0.838	S	S	*	*			trans	-132.7	132.7	167.4	-92.6	-87	0	0	0	110.4
946	E	24.7	Very low	25	Very low	195 Å²	195	148.6 Å²	148.6	91%	0.911	83%	0.834	S	S	*	*			trans	-87.3	158.5	166.7	-64.3	-176.7	114.3	0	0	110.2
947	C	24.2	Very low	24.9	Very low	129 Å²	129	149.7 Å²	149.7	87%	0.872	83%	0.833	S	S	*	*			trans	-137.9	118.5	175	-172.8	0	0	0	0	109.7
948	E	24.2	Very low	24.9	Very low	183 Å²	183	150.1 Å²	150.1	86%	0.855	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-75.4	163.5	-178.5	-65.9	-168.5	110.5	0	0	113.1
949	R	21.8	Very low	24.9	Very low	238 Å²	238	151.8 Å²	151.8	90%	0.898	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-87	121.4	179.3	-66.9	176.5	176.8	166.1	-1.4	111
950	V	26.4	Very low	24.8	Very low	119 Å²	119	151.8 Å²	151.8	72%	0.721	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-102.5	121.8	165.4	-177.8	0	0	0	0	109.2
951	N	23.4	Very low	24.7	Very low	142 Å²	142	154.2 Å²	154.2	76%	0.759	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-79.9	123	175.7	-71.7	-30.3	0	0	0	110.2	T953	N951-T953 PolarHBondContact O-N 3.09Å
952	F	24.5	Very low	24.6	Very low	189 Å²	189	150.9 Å²	150.9	83%	0.829	82%	0.818	S	S	*	*			trans	-86.4	97.5	172.2	-81.7	-89.7	0	0	0	111.2	V954	F952-V954 PolarHBondContact O-N 3.2Å
953	T	23.9	Very low	24.7	Very low	131 Å²	131	151 Å²	151	80%	0.804	82%	0.819	S	S	*	*			trans	-81.5	96.5	169.8	-40.1	0	0	0	0	109.3	N951 P955	N951-T953 PolarHBondContact O-N 3.09Å; T953-P955 WeakPolarHBondContact O-CD 3.47Å
954	V	25.6	Very low	24.8	Very low	124 Å²	124	148 Å²	148	75%	0.752	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.1	122.5	175.9	-179	0	0	0	0	109.4	F952	F952-V954 PolarHBondContact O-N 3.2Å
955	P	24.3	Very low	24.9	Very low	115 Å²	115	152.7 Å²	152.7	75%	0.747	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-65.2	136.1	176.8	-21.4	34.2	0	0	0	111.7	T953 L957	T953-P955 WeakPolarHBondContact O-CD 3.47Å; P955-L957 PolarHBondContact O-N 3.47Å
956	S	24.4	Very low	25	Very low	110 Å²	110	152.4 Å²	152.4	77%	0.769	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.5	123.4	177	52.6	0	0	0	0	111.6
957	L	25.3	Very low	25	Very low	169 Å²	169	148.6 Å²	148.6	89%	0.885	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62.8	136.5	159.4	-107.3	79.8	0	0	0	109.3	P955 R959	P955-L957 PolarHBondContact O-N 3.47Å; L957-R959 PolarHBondContact O-N 3.48Å
958	V	25.1	Very low	25.1	Very low	141 Å²	141	148.8 Å²	148.8	86%	0.855	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-69.2	123.1	-176.3	177	0	0	0	0	110.1
959	R	24.2	Very low	25.1	Very low	181 Å²	181	148.4 Å²	148.4	68%	0.683	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-82.9	124	177.4	-158	-177.2	-161	-167.7	4.2	108.9	L957	L957-R959 PolarHBondContact O-N 3.48Å
960	T	27	Very low	25.3	Very low	139 Å²	139	144.9 Å²	144.9	85%	0.853	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.5	135	168.2	38.4	0	0	0	0	109.9
961	N	26.6	Very low	25.3	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-98.2	157.6	-176.7	-71.9	-30.7	0	0	0	111.4
962	G	25.6	Very low	25.5	Very low	76 Å²	76	146.1 Å²	146.1	78%	0.784	81%	0.814	S	S	*	*			trans	131.1	71.9	147.1	0	0	0	0	0	118.3
963	T	27.1	Very low	25.4	Very low	137 Å²	137	146.6 Å²	146.6	84%	0.84	82%	0.815	S	S	*	*			trans	-136.8	128	141.2	35.8	0	0	0	0	108.4
964	G	26.2	Very low	25.6	Very low	73 Å²	73	147.7 Å²	147.7	75%	0.753	82%	0.815	S	S	*	*			trans	-91.6	131.5	-169.5	0	0	0	0	0	113.3
965	Y	25.8	Very low	25.6	Very low	234 Å²	234	148.7 Å²	148.7	92%	0.918	82%	0.817	S	S	*	*			trans	-84.6	115.2	168.2	-82.1	-93.4	0	0	0	110.4
966	Y	25	Very low	25.7	Very low	220 Å²	220	149.7 Å²	149.7	86%	0.863	82%	0.82	S	S	*	*			trans	-79.3	127.6	164.4	-86.2	-86.1	0	0	0	110.2	T968	Y966-T968 PolarHBondContact O-N 3.06Å
967	S	24.4	Very low	25.9	Very low	115 Å²	115	151 Å²	151	80%	0.804	82%	0.819	S	S	*	*			trans	-75.5	105.8	174.7	-172.7	0	0	0	0	110.2	Q969	S967-Q969 PolarHBondContact O-N 3.09Å
968	T	26.1	Very low	26	Very low	133 Å²	133	150 Å²	150	82%	0.816	81%	0.814	S	S	*	*			trans	-78	114.3	174.6	38.7	0	0	0	0	110.5	Y966	Y966-T968 PolarHBondContact O-N 3.06Å
969	Q	25.6	Very low	26.2	Very low	175 Å²	175	152.3 Å²	152.3	82%	0.818	82%	0.816	S	S	*	*			trans	-64.7	155.2	-179.7	-67.5	176.3	-21	0	0	112.6	S967 I971	S967-Q969 PolarHBondContact O-N 3.09Å; Q969-I971 PolarHBondContact O-N 2.9Å; Q969-I971 VanDerWaalsContact O-N 3.14Å
970	N	25.1	Very low	26.3	Very low	163 Å²	163	149.8 Å²	149.8	87%	0.872	82%	0.815	S	S	*	*			trans	-60.5	112	179.7	-68.9	-46.9	0	0	0	112
971	I	26.1	Very low	26.3	Very low	158 Å²	158	148.8 Å²	148.8	81%	0.81	81%	0.814	S	S	*	*			trans	-96.7	104.4	163.1	-60.9	178.7	0	0	0	108	Q969 K973	Q969-I971 PolarHBondContact O-N 2.9Å; Q969-I971 VanDerWaalsContact O-N 3.14Å; I971-K973 PolarHBondContact O-N 3.3Å; I971-K973 VanDerWaalsContact O-N 3.09Å
972	T	26.9	Very low	26.3	Very low	130 Å²	130	147.4 Å²	147.4	80%	0.798	81%	0.807	S	S	*	*			trans	-62.3	106.5	172.4	47.5	0	0	0	0	110
973	K	24.2	Very low	26.3	Very low	199 Å²	199	148.6 Å²	148.6	87%	0.865	81%	0.81	S	S	*	*			trans	-94.6	127.3	178.4	-155.8	169.4	-173.8	176.9	0	109.7	I971	I971-K973 PolarHBondContact O-N 3.3Å; I971-K973 VanDerWaalsContact O-N 3.09Å
974	L	27.4	Very low	26.1	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	80%	0.802	S	S	*	*			trans	-58.8	146.7	-169.8	-81	65.8	0	0	0	113.4	T976	L974-T976 PolarHBondContact O-N 3.11Å
975	D	25.9	Very low	26	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	80%	0.803	S	S	*	*			trans	-62.9	100.4	169.2	-67.3	-68.6	0	0	0	112	N977	D975-N977 VanDerWaalsContact C-N 3.31Å; D975-N977 PolarHBondContact O-N 3.03Å
976	T	25.6	Very low	25.8	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	79%	0.791	S	S	*	*			trans	-76.1	86.6	162.4	52.9	0	0	0	0	109	L974	L974-T976 PolarHBondContact O-N 3.11Å
977	N	28.4	Very low	25.8	Very low	138 Å²	138	140 Å²	140	74%	0.738	79%	0.791	S	S	*	*			trans	-55.9	143.3	179.4	-83.6	-65.7	0	0	0	112.8	D975 H979	D975-N977 VanDerWaalsContact C-N 3.31Å; D975-N977 PolarHBondContact O-N 3.03Å; N977-H979 PolarHBondContact O-N 2.99Å
978	N	27.6	Very low	25.7	Very low	148 Å²	148	144.5 Å²	144.5	79%	0.791	79%	0.792	S	S	*	*			trans	-62.4	119.3	176.1	-78	-27.4	0	0	0	111.3	N980	N978-N980 PolarHBondContact O-N 3.45Å
979	H	28.8	Very low	25.7	Very low	190 Å²	190	143.5 Å²	143.5	88%	0.88	79%	0.79	S	S	*	*			trans	-80	96.9	160.5	-82	-66.6	0	0	0	109.7	N977 S981	N977-H979 PolarHBondContact O-N 2.99Å; H979-S981 PolarHBondContact O-N 3.29Å; H979-S981 VanDerWaalsContact O-N 3.14Å
980	N	28	Very low	25.7	Very low	127 Å²	127	141 Å²	141	68%	0.679	79%	0.787	S	S	*	*			trans	-64.7	109.3	171	-72.4	-15.4	0	0	0	110.1	N978 N982	N978-N980 PolarHBondContact O-N 3.45Å; N980-N982 PolarHBondContact O-N 2.99Å
981	S	25.9	Very low	25.7	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	78%	0.783	S	S	*	*			trans	-77.3	61.7	175.5	42.9	0	0	0	0	112.2	H979 A983	H979-S981 PolarHBondContact O-N 3.29Å; H979-S981 VanDerWaalsContact O-N 3.14Å; S981-A983 PolarHBondContact O-N 3.13Å
982	N	26.8	Very low	25.6	Very low	126 Å²	126	140.9 Å²	140.9	67%	0.674	78%	0.782	S	S	*	*			trans	-67.9	96.4	176.4	-78.9	4.8	0	0	0	111	N980 I984	N980-N982 PolarHBondContact O-N 2.99Å; N982-I984 HydrophobicContact CB-CG1 4.41Å; N982-I984 PolarHBondContact O-N 3.04Å; N982-I984 VanDerWaalsContact O-N 3.09Å
983	A	24.6	Very low	25.4	Very low	102 Å²	102	139 Å²	139	84%	0.843	77%	0.774	S	S	*	*			trans	-74	92.3	171.2	0	0	0	0	0	110.6	S981	S981-A983 PolarHBondContact O-N 3.13Å
984	I	24.7	Very low	25.4	Very low	134 Å²	134	135.6 Å²	135.6	69%	0.687	77%	0.769	S	S	*	*			trans	-86.8	109.4	-179.8	-54.8	176.3	0	0	0	110.2	N982 C986	N982-I984 HydrophobicContact CB-CG1 4.41Å; N982-I984 PolarHBondContact O-N 3.04Å; N982-I984 VanDerWaalsContact O-N 3.09Å; I984-C986 VanDerWaalsContact CG2-SG 3.58Å; I984-C986 PolarHBondContact O-N 3.21Å
985	S	23.4	Very low	25.1	Very low	110 Å²	110	135.6 Å²	135.6	77%	0.769	77%	0.765	S	S	*	*			trans	-89.7	85.2	167.6	49.2	0	0	0	0	111.1	T987	S985-T987 PolarHBondContact O-N 3.29Å
986	C	22.2	Very low	24.9	Very low	98 Å²	98	136.3 Å²	136.3	66%	0.662	76%	0.764	S	S	*	*			trans	-62.9	122.3	175.6	-65.3	0	0	0	0	111.9	I984	I984-C986 VanDerWaalsContact CG2-SG 3.58Å; I984-C986 PolarHBondContact O-N 3.21Å
987	T	23.8	Very low	25.7	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	75%	0.754	S	S	*	*			trans	-122.6	122.5	158	23.4	0	0	0	0	109.4	S985	S985-T987 PolarHBondContact O-N 3.29Å
988	Y	23.4	Very low	25.4	Very low	211 Å²	211	134.8 Å²	134.8	83%	0.827	75%	0.754	S	S	*	*			trans	-76.5	138.5	-177	-84	-110.8	0	0	0	111.3
989	S	24.7	Very low	25.4	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	75%	0.754	S	S	*	*			trans	-139.8	116.5	158	52.1	0	0	0	0	109.3
990	V	25.4	Very low	25.1	Very low	123 Å²	123	131.2 Å²	131.2	75%	0.745	74%	0.743	S	S	*	*			trans	-104.1	119.1	178.7	175.8	0	0	0	0	108.3
991	N	26	Very low	25	Very low	148 Å²	148	134.3 Å²	134.3	79%	0.791	76%	0.756	S	S	*	*			trans	-74	148.1	173.1	-73.1	-46.5	0	0	0	111.1
992	H	24.8	Very low	25	Very low	170 Å²	170	135 Å²	135	79%	0.787	75%	0.75	S	S	*	*			trans	-149.1	122.2	147.3	-108.1	-74.4	0	0	0	112.1
993	S	21.9	Very low	25.1	Very low	92 Å²	92	139 Å²	139	64%	0.643	76%	0.762	S	S	*	*			trans	29.2	132.5	141.6	56.4	0	0	0	0	119.7
994	V	23.3	Very low	25.1	Very low	126 Å²	126	142.9 Å²	142.9	76%	0.764	76%	0.762	S	S	*	*				-179.5	152.2	83.9	146.3	0	0	0	0	107.8
995	Q	21.9	Very low	25.3	Very low	153 Å²	153	141.8 Å²	141.8	72%	0.715	77%	0.767	S	S	*	*			cis	-177.3	172.8	-20.8	-168	179.4	10.5	0	0	107.4
996	Q	22.4	Very low	25.5	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	77%	0.765	S	S	*	*			trans	78.1	158.2	162.5	-55.1	-163.5	15.3	0	0	118
997	P	41	Very low	25.6	Very low	93 Å²	93	142.3 Å²	142.3	60%	0.604	76%	0.755	S	S	*	*			cis	-142.9	163.3	-47.3	40.3	-25.8	0	0	0	115.2
998	I	22.5	Very low	25.8	Very low	147 Å²	147	141.2 Å²	141.2	75%	0.754	75%	0.753	S	S	*	*			trans	68	147.4	146.9	-70.2	163.1	0	0	0	116.4
999	H	27.3	Very low	25.8	Very low	169 Å²	169	134 Å²	134	78%	0.782	74%	0.743	S	S	*	*			cis	-130.7	154.9	2.2	-130.9	-48.5	0	0	0	110.3
1000	S	22.5	Very low	25.8	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	75%	0.749	S	S	*	*			trans	-85.3	154.1	170	48.8	0	0	0	0	113.4
1001	M	27.5	Very low	25.7	Very low	193 Å²	193	139 Å²	139	95%	0.951	75%	0.752	S	S	*	*			trans	-149.3	131.8	146	-109.8	-162.5	178	0	0	111.1
1002	D	25.4	Very low	25.6	Very low	132 Å²	132	137 Å²	137	71%	0.706	75%	0.75	S	S	*	*			trans	-80.8	152.5	-174.1	-60.6	-89.9	0	0	0	114.3
1003	K	29.4	Very low	25.6	Very low	210 Å²	210	133.9 Å²	133.9	91%	0.913	75%	0.747	S	S	*	*			trans	-158.3	106.6	142.2	-112.2	156.9	-170.4	172.6	0	111.6
1004	Q	23	Very low	25.5	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	76%	0.757	S	S	*	*			trans	-83	137.1	170.6	-62.3	176	-8.3	0	0	110.2
1005	S	30.2	Very low	25.4	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	76%	0.76	S	S	*	*			trans	-154.8	80.3	164	64.5	0	0	0	0	113.4
1006	S	28.1	Very low	25.5	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	77%	0.766	S	S	*	*			trans	38.9	98.6	132.5	-50.6	0	0	0	0	121
1007	Y	23.9	Very low	25.6	Very low	115 Å²	115	141.1 Å²	141.1	45%	0.451	77%	0.772	S	S	.	*				59.6	137.9	117	-95.2	-98	0	0	0	124.5	I1100 C1101 N1102	Y1007-I1100 HydrophobicContact CD1-CG2 4.13Å; Y1007-I1100 HydrophobicContact CD2-CG2 3.82Å; Y1007-I1100 HydrophobicContact CE1-CG2 3.62Å; Y1007-I1100 HydrophobicContact CE2-CG2 3.3Å; Y1007-I1100 HydrophobicContact CG-CG2 4.2Å; Y1007-I1100 WeakPolarHBondContact OH-CG2 3.46Å; Y1007-C1101 VanDerWaalsContact OH-C 3.3Å; Y1007-C1101 PolarHBondContact OH-O 2.77Å; Y1007-C1101 VanDerWaalsContact OH-O 3.14Å; Y1007-N1102 WeakPolarHBondContact OH-CA 3.38Å; Y1007-N1102 WeakPolarHBondContact OH-CB 3.42Å; Y1007-N1102 PolarHBondContact OH-N 3.28Å; Y1007-N1102 PolarHBondContact OH-OD1 2.74Å
1008	S	26.6	Very low	25	Very low	117 Å²	117	144.7 Å²	144.7	82%	0.818	79%	0.785	S	S	*	*			trans	72.5	141.8	152.7	-157.8	0	0	0	0	117.4
1009	G	23.9	Very low	25.8	Very low	61 Å²	61	141.2 Å²	141.2	63%	0.629	77%	0.772	S	S	*	*			cis	156.8	138.8	-8	0	0	0	0	0	113.4
1010	M	25.7	Very low	25.8	Very low	183 Å²	183	135 Å²	135	90%	0.901	75%	0.753	S	S	*	*			trans	65.5	127.3	174.8	-65.4	-101.2	70	0	0	118.3
1011	L	23.4	Very low	26	Very low	154 Å²	154	137.6 Å²	137.6	81%	0.806	76%	0.759	S	S	*	*			trans	-79.4	148.9	170.6	-59.7	109.2	0	0	0	112
1012	S	23.4	Very low	26	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	74%	0.743	S	S	*	*			trans	-157.6	106.7	139.4	-169.4	0	0	0	0	109.8
1013	S	23.8	Very low	26.1	Very low	104 Å²	104	132 Å²	132	73%	0.727	75%	0.749	S	S	*	*			trans	-103.7	103.2	-172.9	38.5	0	0	0	0	111.5
1014	Y	21.3	Very low	25.8	Very low	217 Å²	217	130.7 Å²	130.7	85%	0.851	74%	0.743	S	S	*	*			trans	-89.5	118.8	171.4	-96.9	-93.3	0	0	0	110.9
1015	C	21	Very low	25.9	Very low	123 Å²	123	127.8 Å²	127.8	83%	0.831	74%	0.738	S	S	*	*			trans	-76.3	140.5	170.6	-69.2	0	0	0	0	111.3
1016	S	23.7	Very low	25.6	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	74%	0.736	S	S	*	*			trans	-106.3	149.8	-179.9	45.2	0	0	0	0	112.6
1017	Y	25	Very low	25.5	Very low	226 Å²	226	129.6 Å²	129.6	89%	0.886	74%	0.74	S	S	*	*			trans	-119.9	153.8	-177.4	-103.1	-98.4	0	0	0	110.3
1018	L	26.9	Very low	25.5	Very low	168 Å²	168	129.7 Å²	129.7	88%	0.88	75%	0.753	S	S	*	*			trans	-153.6	133.3	162.5	-117.4	141.1	0	0	0	113.2
1019	P	40.9	Very low	25.3	Very low	74 Å²	74	129.5 Å²	129.5	48%	0.481	75%	0.75	S	S	.	*			trans	-113.4	-152.7	-172.2	43.7	-36	0	0	0	113.5	I1300 R1303	P1019-I1300 HydrophobicContact CG-CG2 4.47Å; P1019-R1303 PolarHBondContact O-NH1 3.36Å
1020	G	26.2	Very low	25.4	Very low	37 Å²	37	132.6 Å²	132.6	38%	0.381	76%	0.761	S	S	.	*			trans	168.2	-161	171.4	0	0	0	0	0	115.8	R1303	G1020-R1303 VanDerWaalsContact C-CZ 3.47Å; G1020-R1303 WeakPolarHBondContact O-CG 3Å; G1020-R1303 PolarHBondContact O-NE 3.15Å
1021	L	27.8	Very low	25.3	Very low	149 Å²	149	127.4 Å²	127.4	78%	0.78	74%	0.743	S	S	*	*			trans	-98.4	177.5	-168	-80.6	70.2	0	0	0	113.6	R1303	L1021-R1303 PolarHBondContact O-NE 2.65Å; L1021-R1303 PolarHBondContact O-NH2 3.22Å
1022	A	26.2	Very low	25.4	Very low	73 Å²	73	129.1 Å²	129.1	60%	0.603	75%	0.746	S	S	*	*			cis	177.5	-177.5	-35.9	0	0	0	0	0	110.7
1023	T	27.1	Very low	25.5	Very low	136 Å²	136	127.1 Å²	127.1	83%	0.834	74%	0.742	S	S	*	*			trans	68.9	152.3	164.3	59.7	0	0	0	0	119.5
1024	K	23.5	Very low	25.7	Very low	182 Å²	182	129.4 Å²	129.4	79%	0.791	75%	0.745	S	S	*	*			cis	-166.4	176.4	-35.3	-150.5	174.8	-178	-176.9	0	108.8
1025	T	26.3	Very low	25.9	Very low	123 Å²	123	125.7 Å²	125.7	76%	0.755	74%	0.74	S	S	*	*			trans	65.5	152.2	164.5	48.2	0	0	0	0	119.3
1026	T	22.9	Very low	26.1	Very low	121 Å²	121	128.5 Å²	128.5	74%	0.742	74%	0.74	S	S	*	*			cis	-165.4	177	-47.3	7.5	0	0	0	0	110.9
1027	T	25.5	Very low	26.2	Very low	132 Å²	132	127.2 Å²	127.2	81%	0.81	73%	0.731	S	S	*	*			trans	78.9	163.7	160.4	16.8	0	0	0	0	120
1028	T	23.4	Very low	26.2	Very low	117 Å²	117	124.6 Å²	124.6	72%	0.718	73%	0.732	S	S	*	*				-146.1	170.8	-94.1	-42.2	0	0	0	0	111.2
1029	C	23	Very low	26.2	Very low	112 Å²	112	125.8 Å²	125.8	76%	0.757	73%	0.73	S	S	*	*			trans	78	151.6	161.5	-58	0	0	0	0	118.1
1030	C	25.5	Very low	25.5	Very low	127 Å²	127	128 Å²	128	86%	0.858	74%	0.744	S	S	*	*			cis	-162	167.6	-28.3	-108.8	0	0	0	0	109.3
1031	S	24.4	Very low	25.4	Very low	74 Å²	74	133.2 Å²	133.2	52%	0.517	76%	0.763	S	S	.	*			trans	-139.4	-178.9	-171.3	57.6	0	0	0	0	114.1
1032	H	25.9	Very low	25.3	Very low	189 Å²	189	135 Å²	135	88%	0.875	76%	0.764	S	S	*	*			trans	85.3	152.9	179.8	-47.5	87.4	0	0	0	116.1
1033	G	24.5	Very low	25.3	Very low	65 Å²	65	137.5 Å²	137.5	67%	0.67	77%	0.772	S	S	*	*			cis	156.3	110.2	-12	0	0	0	0	0	115.6
1034	I	28.2	Very low	25.2	Very low	152 Å²	152	137.5 Å²	137.5	78%	0.779	77%	0.772	S	S	*	*			trans	30.1	121.8	151.3	-27.9	177.4	0	0	0	119.3
1035	N	26.5	Very low	25.3	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	77%	0.77	S	S	*	*				168.1	133.9	114.4	-93.4	-65.9	0	0	0	116.1
1036	H	24.5	Very low	25.2	Very low	182 Å²	182	132.4 Å²	132.4	84%	0.843	77%	0.77	S	S	*	*			trans	-143.6	104.3	144.1	-92.1	-67.4	0	0	0	106.5
1037	S	26.1	Very low	25.2	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	78%	0.775	S	S	*	*				78.3	53.7	73.5	81.3	0	0	0	0	115.4
1038	L	25.4	Very low	25.2	Very low	171 Å²	171	135 Å²	135	90%	0.895	77%	0.774	S	S	*	*			trans	-98	126.3	156.7	-77.3	170.3	0	0	0	109.3	P1040	L1038-P1040 WeakPolarHBondContact O-CD 3.32Å
1039	K	26.3	Very low	25.2	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.835	78%	0.778	S	S	*	*			trans	-77.5	118.6	-169.3	-63.1	175.6	-179.2	176.4	0	111.5	L1041	K1039-L1041 PolarHBondContact O-N 3.31Å
1040	P	25.2	Very low	25.3	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	78%	0.775	S	S	*	*			trans	-76.4	93.7	172	30.9	-32.7	0	0	0	110.3	L1038 F1042	L1038-P1040 WeakPolarHBondContact O-CD 3.32Å; P1040-F1042 PolarHBondContact O-N 3.37Å
1041	L	25.6	Very low	25.3	Very low	148 Å²	148	135.4 Å²	135.4	78%	0.775	77%	0.77	S	S	*	*			trans	-74.4	72.3	172.6	-99.4	164.3	0	0	0	111.2	K1039	K1039-L1041 PolarHBondContact O-N 3.31Å
1042	F	25.2	Very low	25.3	Very low	186 Å²	186	136.6 Å²	136.6	82%	0.816	78%	0.779	S	S	*	*			trans	-130.9	67.2	166.3	-80.7	-73.2	0	0	0	110.2	P1040 T1044	P1040-F1042 PolarHBondContact O-N 3.37Å; F1042-T1044 PolarHBondContact O-N 3.39Å; F1042-T1044 VanDerWaalsContact O-N 3.09Å
1043	T	25.5	Very low	25.4	Very low	125 Å²	125	136.9 Å²	136.9	77%	0.767	78%	0.777	S	S	*	*			trans	-63.7	105	158.8	45.8	0	0	0	0	108.1	S1045	T1043-S1045 VanDerWaalsContact C-N 3.3Å; T1043-S1045 PolarHBondContact O-N 3.39Å
1044	T	25.1	Very low	25.4	Very low	137 Å²	137	142.1 Å²	142.1	84%	0.84	78%	0.784	S	S	*	*			trans	-65.2	92	169.6	48	0	0	0	0	108.7	F1042 A1046	F1042-T1044 PolarHBondContact O-N 3.39Å; F1042-T1044 VanDerWaalsContact O-N 3.09Å; T1044-A1046 PolarHBondContact O-N 3.09Å
1045	S	25.2	Very low	25.3	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	78%	0.783	S	S	*	*			trans	-64.2	96.5	172.3	52.2	0	0	0	0	108.4	T1043 L1047	T1043-S1045 VanDerWaalsContact C-N 3.3Å; T1043-S1045 PolarHBondContact O-N 3.39Å; S1045-L1047 PolarHBondContact O-N 3.38Å
1046	A	25.6	Very low	25.1	Very low	92 Å²	92	140.8 Å²	140.8	76%	0.76	79%	0.787	S	S	*	*			trans	-58.2	110	175	0	0	0	0	0	108.5	T1044 N1048	T1044-A1046 PolarHBondContact O-N 3.09Å; A1046-N1048 PolarHBondContact O-N 2.75Å
1047	L	23.2	Very low	25.1	Very low	160 Å²	160	139.1 Å²	139.1	84%	0.838	78%	0.783	S	S	*	*			trans	-68.6	90.9	170.3	-88.7	166.6	0	0	0	107.4	S1045 I1049	S1045-L1047 PolarHBondContact O-N 3.38Å; L1047-I1049 PolarHBondContact O-N 2.84Å
1048	N	25	Very low	25	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	79%	0.793	S	S	*	*			trans	-69.3	79.7	176.4	-172.2	15.7	0	0	0	108.4	A1046 S1050	A1046-N1048 PolarHBondContact O-N 2.75Å; N1048-S1050 VanDerWaalsContact C-N 3.28Å; N1048-S1050 PolarHBondContact O-N 3.25Å
1049	I	23.4	Very low	25	Very low	156 Å²	156	145 Å²	145	80%	0.8	79%	0.787	S	S	*	*			trans	-64.6	94.8	173.9	-61.7	176.8	0	0	0	106.5	L1047 S1051	L1047-I1049 PolarHBondContact O-N 2.84Å; I1049-S1051 PolarHBondContact O-N 3.19Å
1050	S	24.7	Very low	24.9	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	78%	0.781	S	S	*	*			trans	-64.6	102.8	-179.2	54.5	0	0	0	0	109.1	N1048 S1052	N1048-S1050 VanDerWaalsContact C-N 3.28Å; N1048-S1050 PolarHBondContact O-N 3.25Å; S1050-S1052 PolarHBondContact O-N 3.16Å
1051	S	26.5	Very low	25.1	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	78%	0.78	S	S	*	*			trans	-55	110.1	173.1	53.7	0	0	0	0	109.4	I1049 K1053	I1049-S1051 PolarHBondContact O-N 3.19Å; S1051-K1053 PolarHBondContact O-N 2.99Å
1052	S	24.6	Very low	25.3	Very low	100 Å²	100	144.7 Å²	144.7	70%	0.699	77%	0.771	S	S	*	*			trans	-61.1	121.4	179.9	46.2	0	0	0	0	109.8	S1050 Q1054	S1050-S1052 PolarHBondContact O-N 3.16Å; S1052-Q1054 PolarHBondContact O-N 2.79Å
1053	K	27	Very low	25.6	Very low	194 Å²	194	143.5 Å²	143.5	84%	0.843	77%	0.773	S	S	*	*			trans	-67.2	92.9	-178.1	-63.1	175.9	-179.1	177.3	0	110.7	S1051	S1051-K1053 PolarHBondContact O-N 2.99Å
1054	Q	25.7	Very low	25.8	Very low	176 Å²	176	145.8 Å²	145.8	82%	0.822	77%	0.773	S	S	*	*			trans	-91	122.7	162.9	-79.7	178.8	-42	0	0	109.2	S1052 C1056	S1052-Q1054 PolarHBondContact O-N 2.79Å; Q1054-C1056 PolarHBondContact O-N 3.44Å; Q1054-C1056 VanDerWaalsContact O-N 3.16Å
1055	N	25.2	Very low	26	Very low	141 Å²	141	146 Å²	146	75%	0.754	77%	0.773	S	S	*	*			trans	-85	88.7	-166.8	-62.6	-43.2	0	0	0	111.4	I1057	N1055-I1057 PolarHBondContact O-N 2.8Å; N1055-I1057 VanDerWaalsContact O-N 3.1Å
1056	C	22.6	Very low	26.1	Very low	122 Å²	122	147.4 Å²	147.4	82%	0.824	77%	0.769	S	S	*	*			trans	-73.8	95.9	161.8	-65.6	0	0	0	0	109.1	Q1054 Y1058	Q1054-C1056 PolarHBondContact O-N 3.44Å; Q1054-C1056 VanDerWaalsContact O-N 3.16Å; C1056-Y1058 PolarHBondContact O-N 2.88Å
1057	I	24.7	Very low	26.2	Very low	148 Å²	148	151.5 Å²	151.5	76%	0.759	77%	0.772	S	S	*	*			trans	-66.7	129.4	179	-65.1	173.8	0	0	0	109.6	N1055 H1059	N1055-I1057 PolarHBondContact O-N 2.8Å; N1055-I1057 VanDerWaalsContact O-N 3.1Å; I1057-H1059 PolarHBondContact O-N 2.82Å; I1057-H1059 VanDerWaalsContact O-N 3.13Å
1058	Y	22.6	Very low	26.3	Very low	219 Å²	219	148.8 Å²	148.8	86%	0.859	77%	0.765	S	S	*	*			trans	-67.3	105.4	177.3	-85.8	-101.9	0	0	0	111.5	C1056 R1060	C1056-Y1058 PolarHBondContact O-N 2.88Å; Y1058-R1060 PolarHBondContact O-N 3.29Å
1059	H	25.3	Very low	26.5	Very low	169 Å²	169	148.4 Å²	148.4	78%	0.782	76%	0.762	S	S	*	*			trans	-87.9	86.9	162.2	-124.6	-75.8	0	0	0	110.4	I1057 N1061	I1057-H1059 PolarHBondContact O-N 2.82Å; I1057-H1059 VanDerWaalsContact O-N 3.13Å; H1059-N1061 PolarHBondContact O-N 2.82Å; H1059-N1061 VanDerWaalsContact O-N 3.09Å
1060	R	26.1	Very low	26.7	Very low	184 Å²	184	151.1 Å²	151.1	69%	0.694	76%	0.763	S	S	*	*			trans	-79.9	81.3	-178.7	-176.4	-178.6	-179.5	175.7	-5.3	110.7	Y1058 E1062	Y1058-R1060 PolarHBondContact O-N 3.29Å; R1060-E1062 VanDerWaalsContact C-N 3.29Å; R1060-E1062 HydrophobicContact CG-CG 4.11Å; R1060-E1062 IonicContact CZ-OE1 2.66Å; R1060-E1062 IonicContact CZ-OE2 2.7Å; R1060-E1062 IonicContact NE-OE1 3.34Å; R1060-E1062 PolarHBondContact NE-OE1 2.76Å; R1060-E1062 IonicContact NE-OE2 2.73Å; R1060-E1062 PolarHBondContact NE-OE2 3.47Å; R1060-E1062 IonicContact NH2-OE1 3.16Å; R1060-E1062 PolarHBondContact NH2-OE1 2.88Å; R1060-E1062 IonicContact NH2-OE2 2.7Å; R1060-E1062 PolarHBondContact NH2-OE2 2.77Å; R1060-E1062 PolarHBondContact O-N 3.42Å
1061	N	28.2	Very low	26.9	Very low	145 Å²	145	153.7 Å²	153.7	78%	0.775	77%	0.769	S	S	*	*			trans	-80.2	77.8	170	-79.1	16.3	0	0	0	110.8	H1059 N1063	H1059-N1061 PolarHBondContact O-N 2.82Å; H1059-N1061 VanDerWaalsContact O-N 3.09Å; N1061-N1063 PolarHBondContact O-N 3.38Å
1062	E	30.6	Very low	27.1	Very low	123 Å²	123	156.9 Å²	156.9	58%	0.575	77%	0.773	S	S	*	*			trans	-72.1	112.8	158.3	-75.9	171.1	169.2	0	0	108.6	R1060	R1060-E1062 VanDerWaalsContact C-N 3.29Å; R1060-E1062 HydrophobicContact CG-CG 4.11Å; R1060-E1062 IonicContact CZ-OE1 2.66Å; R1060-E1062 IonicContact CZ-OE2 2.7Å; R1060-E1062 IonicContact NE-OE1 3.34Å; R1060-E1062 PolarHBondContact NE-OE1 2.76Å; R1060-E1062 IonicContact NE-OE2 2.73Å; R1060-E1062 PolarHBondContact NE-OE2 3.47Å; R1060-E1062 IonicContact NH2-OE1 3.16Å; R1060-E1062 PolarHBondContact NH2-OE1 2.88Å; R1060-E1062 IonicContact NH2-OE2 2.7Å; R1060-E1062 PolarHBondContact NH2-OE2 2.77Å; R1060-E1062 PolarHBondContact O-N 3.42Å
1063	N	30.4	Very low	27.3	Very low	161 Å²	161	157.4 Å²	157.4	86%	0.861	77%	0.773	S	S	*	*			trans	163.5	94.6	147.8	-86.8	-32.8	0	0	0	111.2	N1061	N1061-N1063 PolarHBondContact O-N 3.38Å
1064	K	30.2	Very low	27.4	Very low	174 Å²	174	157.8 Å²	157.8	76%	0.757	78%	0.775	S	S	*	*			trans	-176.9	89.9	143.1	-107.4	168.7	172.6	-113.4	0	110.5	E1066	K1064-E1066 IonicContact NZ-OE1 3.63Å; K1064-E1066 PolarHBondContact NZ-OE1 3.47Å; K1064-E1066 PolarHBondContact O-N 2.75Å
1065	T	28.5	Very low	27.7	Very low	140 Å²	140	156.4 Å²	156.4	86%	0.859	77%	0.769	S	S	*	*			trans	-77.3	104.3	159.2	44.1	0	0	0	0	108.1
1066	E	27.6	Very low	27.9	Very low	137 Å²	137	158.4 Å²	158.4	64%	0.64	77%	0.773	S	S	*	*			trans	-107.1	106.6	168.9	-70.4	-179.6	-172.4	0	0	107.5	K1064 C1068	K1064-E1066 IonicContact NZ-OE1 3.63Å; K1064-E1066 PolarHBondContact NZ-OE1 3.47Å; K1064-E1066 PolarHBondContact O-N 2.75Å; E1066-C1068 PolarHBondContact O-N 3.41Å; E1066-C1068 VanDerWaalsContact O-N 3.11Å
1067	E	27.9	Very low	28.2	Very low	177 Å²	177	161.2 Å²	161.2	83%	0.827	77%	0.768	S	S	*	*			trans	-74.3	97.8	-174.9	-69	179.7	114.3	0	0	110.9	I1069	E1067-I1069 VanDerWaalsContact C-N 3.31Å; E1067-I1069 PolarHBondContact O-N 2.95Å
1068	C	26.2	Very low	28.4	Very low	104 Å²	104	160.9 Å²	160.9	70%	0.703	77%	0.768	S	S	*	*			trans	-74.4	84.8	167.8	-63.7	0	0	0	0	110.4	E1066 Y1070	E1066-C1068 PolarHBondContact O-N 3.41Å; E1066-C1068 VanDerWaalsContact O-N 3.11Å; C1068-Y1070 HydrophobicContact CB-CD2 4.19Å; C1068-Y1070 HydrophobicContact CB-CE2 4.26Å; C1068-Y1070 PolarHBondContact O-N 2.93Å; C1068-Y1070 VanDerWaalsContact O-N 3.09Å
1069	I	28.8	Very low	28.6	Very low	140 Å²	140	155.1 Å²	155.1	72%	0.718	76%	0.759	S	S	*	*			trans	-63.1	107.9	168.5	-58.1	174.8	0	0	0	108.2	E1067	E1067-I1069 VanDerWaalsContact C-N 3.31Å; E1067-I1069 PolarHBondContact O-N 2.95Å
1070	Y	28.4	Very low	28.6	Very low	212 Å²	212	153.7 Å²	153.7	83%	0.831	76%	0.756	S	S	*	*			trans	-105	106.8	169.8	-94.5	-89.6	0	0	0	108.9	C1068 E1072	C1068-Y1070 HydrophobicContact CB-CD2 4.19Å; C1068-Y1070 HydrophobicContact CB-CE2 4.26Å; C1068-Y1070 PolarHBondContact O-N 2.93Å; C1068-Y1070 VanDerWaalsContact O-N 3.09Å; Y1070-E1072 PolarHBondContact O-N 2.88Å; Y1070-E1072 VanDerWaalsContact O-N 3.15Å
1071	D	28.1	Very low	28.6	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	76%	0.758	S	S	*	*			trans	-71.3	102.5	168.4	-80	-51.5	0	0	0	109.6
1072	E	30.3	Very low	28.6	Very low	176 Å²	176	148.9 Å²	148.9	82%	0.822	76%	0.757	S	S	*	*			trans	-77.4	121.1	175.9	-168.9	170.5	-132.1	0	0	110	Y1070 K1074	Y1070-E1072 PolarHBondContact O-N 2.88Å; Y1070-E1072 VanDerWaalsContact O-N 3.15Å; E1072-K1074 PolarHBondContact O-N 3.14Å
1073	P	28.5	Very low	28.5	Very low	110 Å²	110	148.5 Å²	148.5	71%	0.714	77%	0.765	S	S	*	*			trans	-71.4	122.6	-174.3	27.8	-33.9	0	0	0	111.3	E1075	P1073-E1075 PolarHBondContact O-N 3.43Å
1074	K	29.8	Very low	28.3	Very low	202 Å²	202	149.1 Å²	149.1	88%	0.878	77%	0.768	S	S	*	*			trans	-75.1	86.8	179.5	-64.1	176.9	-177.4	173.9	0	111.5	E1072 E1076	E1072-K1074 PolarHBondContact O-N 3.14Å; K1074-E1076 PolarHBondContact O-N 2.67Å; K1074-E1076 VanDerWaalsContact O-N 3.08Å
1075	E	31.1	Very low	28.1	Very low	147 Å²	147	151.4 Å²	151.4	69%	0.687	77%	0.771	S	S	*	*			trans	-73.8	92.4	162.3	-70.6	-164.7	176.4	0	0	109.8	P1073 Y1077	P1073-E1075 PolarHBondContact O-N 3.43Å; E1075-Y1077 HydrophobicContact CB-CD2 4.15Å; E1075-Y1077 HydrophobicContact CB-CE2 3.96Å; E1075-Y1077 PolarHBondContact O-N 3.38Å; E1075-Y1077 WeakPolarHBondContact OE2-CE2 3.3Å
1076	E	29.7	Very low	28	Very low	183 Å²	183	153.7 Å²	153.7	86%	0.855	77%	0.772	S	S	*	*			trans	-73.7	86.9	179.3	-169.6	159.4	-138.6	0	0	110.4	K1074 D1078	K1074-E1076 PolarHBondContact O-N 2.67Å; K1074-E1076 VanDerWaalsContact O-N 3.08Å; E1076-D1078 VanDerWaalsContact C-N 3.29Å; E1076-D1078 PolarHBondContact O-N 3.1Å
1077	Y	28.3	Very low	28	Very low	182 Å²	182	158.1 Å²	158.1	71%	0.714	78%	0.783	S	S	*	*			trans	-70.3	82.6	178.3	-91.2	-93	0	0	0	112	E1075 S1079	E1075-Y1077 HydrophobicContact CB-CD2 4.15Å; E1075-Y1077 HydrophobicContact CB-CE2 3.96Å; E1075-Y1077 PolarHBondContact O-N 3.38Å; E1075-Y1077 WeakPolarHBondContact OE2-CE2 3.3Å; Y1077-S1079 PolarHBondContact O-N 3.4Å; Y1077-S1079 PolarHBondContact O-OG 3.21Å
1078	D	29.5	Very low	27.8	Very low	140 Å²	140	158.2 Å²	158.2	75%	0.749	78%	0.784	S	S	*	*			trans	-59.7	101.8	-178.6	-152.1	-3.8	0	0	0	110.9	E1076 I1080	E1076-D1078 VanDerWaalsContact C-N 3.29Å; E1076-D1078 PolarHBondContact O-N 3.1Å; D1078-I1080 PolarHBondContact O-N 3.42Å
1079	S	26.6	Very low	28.2	Very low	98 Å²	98	159.1 Å²	159.1	69%	0.685	79%	0.788	S	S	*	*			trans	-87.4	78	-163.7	-70.3	0	0	0	0	111	Y1077 S1081	Y1077-S1079 PolarHBondContact O-N 3.4Å; Y1077-S1079 PolarHBondContact O-OG 3.21Å; S1079-S1081 PolarHBondContact O-N 3.26Å; S1079-S1081 PolarHBondContact O-OG 2.97Å
1080	I	26.9	Very low	28.2	Very low	140 Å²	140	161.9 Å²	161.9	72%	0.718	80%	0.798	S	S	*	*			trans	-65.7	74	-177.9	-51.5	-179.8	0	0	0	111.7	D1078 T1082	D1078-I1080 PolarHBondContact O-N 3.42Å; I1080-T1082 VanDerWaalsContact C-N 3.35Å; I1080-T1082 HydrophobicContact CG2-CG2 4.24Å; I1080-T1082 PolarHBondContact O-N 3.31Å; I1080-T1082 VanDerWaalsContact O-N 3.1Å
1081	S	25.1	Very low	28.1	Very low	104 Å²	104	160 Å²	160	73%	0.727	80%	0.797	S	S	*	*			trans	-81.2	78.4	173.2	45	0	0	0	0	109.5	S1079 P1083	S1079-S1081 PolarHBondContact O-N 3.26Å; S1079-S1081 PolarHBondContact O-OG 2.97Å; S1081-P1083 VanDerWaalsContact O-CD 3.28Å; S1081-P1083 WeakPolarHBondContact O-CD 3.29Å; S1081-P1083 VanDerWaalsContact O-N 3.16Å
1082	T	27.8	Very low	28.1	Very low	123 Å²	123	161.1 Å²	161.1	76%	0.755	80%	0.797	S	S	*	*			trans	-61.3	115.2	177.2	28.6	0	0	0	0	110.5	I1080	I1080-T1082 VanDerWaalsContact C-N 3.35Å; I1080-T1082 HydrophobicContact CG2-CG2 4.24Å; I1080-T1082 PolarHBondContact O-N 3.31Å; I1080-T1082 VanDerWaalsContact O-N 3.1Å
1083	P	28.4	Very low	28.8	Very low	116 Å²	116	158.3 Å²	158.3	75%	0.753	79%	0.794	S	S	*	*			trans	-79.3	135.4	-167	29.6	-34.4	0	0	0	112.2	S1081 R1085	S1081-P1083 VanDerWaalsContact O-CD 3.28Å; S1081-P1083 WeakPolarHBondContact O-CD 3.29Å; S1081-P1083 VanDerWaalsContact O-N 3.16Å; P1083-R1085 PolarHBondContact O-N 3.22Å
1084	L	25.7	Very low	28.6	Very low	174 Å²	174	160.9 Å²	160.9	91%	0.911	80%	0.797	S	S	*	*			trans	-62.3	96.6	172.6	-83.4	163.9	0	0	0	110.6	Q1086	L1084-Q1086 PolarHBondContact O-N 2.93Å
1085	R	26.9	Very low	28.7	Very low	221 Å²	221	160.7 Å²	160.7	83%	0.834	80%	0.799	S	S	*	*			trans	-70	92.3	-173.7	-167.5	176.5	-171.8	176.9	4.2	111.3	P1083 R1087	P1083-R1085 PolarHBondContact O-N 3.22Å; R1085-R1087 PolarHBondContact O-N 3.23Å
1086	Q	25.5	Very low	28.4	Very low	188 Å²	188	161.8 Å²	161.8	88%	0.879	80%	0.804	S	S	*	*			trans	-52	111.7	171.1	-67.3	-178.8	-6.1	0	0	110.3	L1084	L1084-Q1086 PolarHBondContact O-N 2.93Å
1087	R	28.1	Very low	28.5	Very low	230 Å²	230	162.1 Å²	162.1	87%	0.868	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.1	119.2	165.9	-78	-170.2	171.8	-161.9	-1.2	108.6	R1085	R1085-R1087 PolarHBondContact O-N 3.23Å
1088	Q	25	Very low	28.3	Very low	179 Å²	179	163 Å²	163	84%	0.836	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.3	149.5	172.2	-70.9	175.9	-21.9	0	0	110.7	Q1090	Q1088-Q1090 PolarHBondContact O-N 3.48Å
1089	P	34	Very low	28.3	Very low	124 Å²	124	161.9 Å²	161.9	81%	0.805	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-76.8	123.7	-177.2	30.3	-34	0	0	0	111.7
1090	Q	29.4	Very low	28.3	Very low	197 Å²	197	162.5 Å²	162.5	92%	0.921	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-89.6	159	162.2	-79.9	-175.7	-36.7	0	0	111	Q1088	Q1088-Q1090 PolarHBondContact O-N 3.48Å
1091	Q	26	Very low	28.1	Very low	173 Å²	173	161.1 Å²	161.1	81%	0.808	81%	0.808	S	S	*	*			trans	-107.8	136.4	-156.4	-61	168.6	-11.3	0	0	112.7
1092	Q	27.6	Very low	28.2	Very low	177 Å²	177	162.8 Å²	162.8	83%	0.827	81%	0.808	S	S	*	*			trans	64.2	171.7	147.4	-71.4	-171.8	11.2	0	0	117.3
1093	P	44.7	Very low	28	Very low	117 Å²	117	163.3 Å²	163.3	76%	0.76	81%	0.811	S	S	*	*			cis	-116.8	175.3	-2.3	40.1	-27.5	0	0	0	115.8
1094	Q	25	Very low	27.8	Very low	164 Å²	164	162.5 Å²	162.5	77%	0.766	81%	0.808	S	S	*	*			trans	-53.3	141	177.2	-55.8	157.7	-4.1	0	0	113.8
1095	Q	30.8	Very low	27.8	Very low	197 Å²	197	160.6 Å²	160.6	92%	0.921	80%	0.799	S	S	*	*			trans	-134.1	141.4	135.1	-74.4	-161.6	-6.4	0	0	109.5
1096	Q	26.3	Very low	27.7	Very low	171 Å²	171	160 Å²	160	80%	0.799	80%	0.798	S	S	*	*			trans	-99.2	119.4	-177.1	-60.8	175.6	3.5	0	0	109.8
1097	H	30.5	Very low	27.7	Very low	189 Å²	189	156 Å²	156	88%	0.875	79%	0.791	S	S	*	*			trans	-139.4	137.9	155.4	-104	-86.7	0	0	0	110.3
1098	K	24.7	Very low	27.5	Very low	200 Å²	200	151.2 Å²	151.2	87%	0.87	79%	0.787	S	S	*	*			trans	-123.5	74	-155	-173.9	-171.9	175.8	-177.6	0	111.2
1099	T	30.2	Very low	27.5	Very low	118 Å²	118	152 Å²	152	72%	0.724	78%	0.784	S	S	*	*			trans	-133.6	78.7	-178.5	-41.8	0	0	0	0	112.6	C1101	T1099-C1101 PolarHBondContact O-N 3.21Å
1100	I	25	Very low	27.1	Very low	111 Å²	111	153.4 Å²	153.4	57%	0.569	79%	0.785	S	S	*	*			trans	31.2	92.2	136.2	-54.3	-175.6	0	0	0	115.5	Y1007	Y1007-I1100 HydrophobicContact CD1-CG2 4.13Å; Y1007-I1100 HydrophobicContact CD2-CG2 3.82Å; Y1007-I1100 HydrophobicContact CE1-CG2 3.62Å; Y1007-I1100 HydrophobicContact CE2-CG2 3.3Å; Y1007-I1100 HydrophobicContact CG-CG2 4.2Å; Y1007-I1100 WeakPolarHBondContact OH-CG2 3.46Å
1101	C	24.1	Very low	27	Very low	111 Å²	111	152.1 Å²	152.1	75%	0.75	77%	0.773	S	S	*	*			trans	-82	115.3	170.5	-58.1	0	0	0	0	110.9	Y1007 T1099	Y1007-C1101 VanDerWaalsContact OH-C 3.3Å; Y1007-C1101 PolarHBondContact OH-O 2.77Å; Y1007-C1101 VanDerWaalsContact OH-O 3.14Å; T1099-C1101 PolarHBondContact O-N 3.21Å
1102	N	26.2	Very low	26.9	Very low	139 Å²	139	146.8 Å²	146.8	74%	0.743	76%	0.764	S	S	*	*			trans	-92	126.4	171.3	-146	7.4	0	0	0	110.5	Y1007	Y1007-N1102 WeakPolarHBondContact OH-CA 3.38Å; Y1007-N1102 WeakPolarHBondContact OH-CB 3.42Å; Y1007-N1102 PolarHBondContact OH-N 3.28Å; Y1007-N1102 PolarHBondContact OH-OD1 2.74Å
1103	V	24.6	Very low	26.9	Very low	133 Å²	133	147.3 Å²	147.3	81%	0.806	76%	0.76	S	S	*	*			trans	-93.5	112.7	-175.2	176.4	0	0	0	0	110
1104	S	24.7	Very low	25.9	Very low	99 Å²	99	147.1 Å²	147.1	69%	0.692	76%	0.761	S	S	*	*			trans	-155.6	113.2	154.6	60.6	0	0	0	0	112.7
1105	N	24.4	Very low	25.9	Very low	135 Å²	135	147.5 Å²	147.5	72%	0.722	77%	0.767	S	S	*	*			trans	71.8	111.1	139.8	-66.6	4.2	0	0	0	121.3
1106	Y	25.1	Very low	25.7	Very low	208 Å²	208	143.2 Å²	143.2	82%	0.816	76%	0.759	S	S	*	*			trans	55.5	83.3	138.6	-62.9	-77.3	0	0	0	119	T1108	Y1106-T1108 PolarHBondContact O-N 3.44Å
1107	S	25	Very low	25.6	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	76%	0.759	S	S	*	*			trans	-70.8	103.3	147.8	55.6	0	0	0	0	110	Y1109	S1107-Y1109 PolarHBondContact O-N 2.71Å
1108	T	24.2	Very low	25.4	Very low	129 Å²	129	137 Å²	137	79%	0.791	75%	0.753	S	S	*	*			trans	-58.8	128.2	167.2	-55.5	0	0	0	0	109.6	Y1106 D1110	Y1106-T1108 PolarHBondContact O-N 3.44Å; T1108-D1110 PolarHBondContact O-N 3.18Å; T1108-D1110 VanDerWaalsContact O-N 3.14Å
1109	Y	26.2	Very low	25.4	Very low	195 Å²	195	136.3 Å²	136.3	77%	0.765	75%	0.75	S	S	*	*			trans	-75.5	101.4	173.7	-92.5	-94.1	0	0	0	109.8	S1107 Y1111	S1107-Y1109 PolarHBondContact O-N 2.71Å; Y1109-Y1111 PolarHBondContact O-N 2.7Å; Y1109-Y1111 VanDerWaalsContact O-N 3.12Å
1110	D	24.7	Very low	25.3	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	76%	0.756	S	S	*	*			trans	-75.7	93.9	179.2	-170.6	10	0	0	0	111	T1108 G1112	T1108-D1110 PolarHBondContact O-N 3.18Å; T1108-D1110 VanDerWaalsContact O-N 3.14Å; D1110-G1112 VanDerWaalsContact C-N 3.29Å; D1110-G1112 PolarHBondContact O-N 2.98Å
1111	Y	26.8	Very low	25.4	Very low	171 Å²	171	142.5 Å²	142.5	67%	0.671	77%	0.768	S	S	*	*			trans	-80.6	77.3	174.6	-97.8	-83.3	0	0	0	110.7	Y1109 Y1113	Y1109-Y1111 PolarHBondContact O-N 2.7Å; Y1109-Y1111 VanDerWaalsContact O-N 3.12Å; Y1111-Y1113 VanDerWaalsContact C-N 3.28Å; Y1111-Y1113 HydrophobicContact CD1-CD2 4.31Å; Y1111-Y1113 AromaticContact CD1-CE2 3.54Å; Y1111-Y1113 HydrophobicContact CD1-CE2 3.54Å; Y1111-Y1113 HydrophobicContact CE1-CE2 4.38Å; Y1111-Y1113 HydrophobicContact CG-CE2 4.18Å; Y1111-Y1113 PolarHBondContact O-N 2.83Å
1112	G	24.4	Very low	25.6	Very low	61 Å²	61	143.1 Å²	143.1	63%	0.629	76%	0.764	S	S	*	*			trans	-64.6	77.3	175.5	0	0	0	0	0	113.7	D1110 S1114	D1110-G1112 VanDerWaalsContact C-N 3.29Å; D1110-G1112 PolarHBondContact O-N 2.98Å; G1112-S1114 PolarHBondContact O-N 3.29Å
1113	Y	26.6	Very low	25.5	Very low	188 Å²	188	147.1 Å²	147.1	74%	0.737	77%	0.768	S	S	*	*			trans	-76.4	85.6	171.8	-83	-78.1	0	0	0	111.1	Y1111 L1115	Y1111-Y1113 VanDerWaalsContact C-N 3.28Å; Y1111-Y1113 HydrophobicContact CD1-CD2 4.31Å; Y1111-Y1113 AromaticContact CD1-CE2 3.54Å; Y1111-Y1113 HydrophobicContact CD1-CE2 3.54Å; Y1111-Y1113 HydrophobicContact CE1-CE2 4.38Å; Y1111-Y1113 HydrophobicContact CG-CE2 4.18Å; Y1111-Y1113 PolarHBondContact O-N 2.83Å; Y1113-L1115 PolarHBondContact O-N 3.35Å
1114	S	25.6	Very low	25.6	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	77%	0.767	S	S	*	*			trans	-55.2	109	169	-63.6	0	0	0	0	111	G1112 S1116	G1112-S1114 PolarHBondContact O-N 3.29Å; S1114-S1116 PolarHBondContact O-N 3.35Å
1115	L	24.7	Very low	25.7	Very low	172 Å²	172	151.6 Å²	151.6	90%	0.901	77%	0.769	S	S	*	*			trans	-71.8	72.8	176.9	-77	166.8	0	0	0	111.5	Y1113 S1117	Y1113-L1115 PolarHBondContact O-N 3.35Å; L1115-S1117 PolarHBondContact O-N 2.72Å
1116	S	25.3	Very low	25.7	Very low	107 Å²	107	152.5 Å²	152.5	75%	0.748	77%	0.773	S	S	*	*			trans	-65.3	112.4	167.5	57.1	0	0	0	0	109.6	S1114 P1118	S1114-S1116 PolarHBondContact O-N 3.35Å; S1116-P1118 WeakPolarHBondContact O-CD 3Å
1117	S	25.1	Very low	25.8	Very low	115 Å²	115	148 Å²	148	80%	0.804	77%	0.772	S	S	*	*			trans	-99.7	108.9	175.2	177.6	0	0	0	0	111.3	L1115	L1115-S1117 PolarHBondContact O-N 2.72Å
1118	P	25.2	Very low	25.7	Very low	114 Å²	114	150.6 Å²	150.6	74%	0.74	78%	0.776	S	S	*	*			trans	-102.8	101.1	162.8	34.6	-27.7	0	0	0	110.7	S1116	S1116-P1118 WeakPolarHBondContact O-CD 3Å
1119	K	26.2	Very low	25.7	Very low	187 Å²	187	149.1 Å²	149.1	81%	0.813	77%	0.772	S	S	*	*			trans	16.5	134.2	143.4	-58.8	176.2	-178.9	178.1	0	119.1
1120	H	26.9	Very low	25.6	Very low	182 Å²	182	146.3 Å²	146.3	84%	0.843	78%	0.781	S	S	*	*			trans	-7.3	126.1	148.1	-68.3	-99.5	0	0	0	116.7
1121	H	28	Very low	25.7	Very low	177 Å²	177	142.1 Å²	142.1	82%	0.819	76%	0.763	S	S	*	*			trans	-145.4	127.8	132.1	-98.9	-66.8	0	0	0	111.9
1122	D	28.5	Very low	25.8	Very low	124 Å²	124	142.5 Å²	142.5	66%	0.663	77%	0.771	S	S	*	*			trans	26	132.4	157.2	-56.1	-65.4	0	0	0	123.7	H1124	D1122-H1124 PolarHBondContact O-N 2.87Å; D1122-H1124 VanDerWaalsContact O-N 3.1Å
1123	R	23.6	Very low	25.9	Very low	223 Å²	223	146.9 Å²	146.9	84%	0.842	78%	0.778	S	S	*	*			trans	-71.4	93.6	170.1	-68.3	175.3	174.3	165.2	-3.1	111.3	H1125	R1123-H1125 PolarHBondContact O-N 2.94Å; R1123-H1125 VanDerWaalsContact O-N 3.16Å
1124	H	26.2	Very low	25.9	Very low	168 Å²	168	146.7 Å²	146.7	78%	0.778	78%	0.783	S	S	*	*			trans	-73	104.9	160.1	-81.5	-84	0	0	0	110.4	D1122 L1126	D1122-H1124 PolarHBondContact O-N 2.87Å; D1122-H1124 VanDerWaalsContact O-N 3.1Å; H1124-L1126 PolarHBondContact O-N 2.77Å
1125	H	26.4	Very low	25.9	Very low	158 Å²	158	146.7 Å²	146.7	73%	0.731	78%	0.781	S	S	*	*			trans	-68.4	92.3	171	-79.5	-106.7	0	0	0	109.9	R1123 S1127	R1123-H1125 PolarHBondContact O-N 2.94Å; R1123-H1125 VanDerWaalsContact O-N 3.16Å; H1125-S1127 PolarHBondContact O-N 3.49Å
1126	L	25.1	Very low	25.9	Very low	153 Å²	153	144.1 Å²	144.1	80%	0.801	78%	0.777	S	S	*	*			trans	-76.4	89.6	171.1	-74.6	173.8	0	0	0	110.1	H1124 L1128	H1124-L1126 PolarHBondContact O-N 2.77Å; L1126-L1128 VanDerWaalsContact C-N 3.29Å; L1126-L1128 PolarHBondContact O-N 3.46Å
1127	S	26.1	Very low	26	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	78%	0.781	S	S	*	*			trans	-65.5	83.3	170.3	-58.5	0	0	0	0	110.8	H1125 S1129	H1125-S1127 PolarHBondContact O-N 3.49Å; S1127-S1129 PolarHBondContact O-N 3.48Å
1128	L	23.7	Very low	26	Very low	160 Å²	160	145.9 Å²	145.9	84%	0.838	78%	0.776	S	S	*	*			trans	-67	101.3	174.5	-74.9	171.6	0	0	0	110.3	L1126 S1130	L1126-L1128 VanDerWaalsContact C-N 3.29Å; L1126-L1128 PolarHBondContact O-N 3.46Å; L1128-S1130 PolarHBondContact O-N 2.85Å
1129	S	24.7	Very low	26	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	78%	0.777	S	S	*	*			trans	-60.6	124.1	176.5	51.1	0	0	0	0	111.4	S1127 S1131	S1127-S1129 PolarHBondContact O-N 3.48Å; S1129-S1131 VanDerWaalsContact C-N 3.27Å; S1129-S1131 PolarHBondContact O-N 2.92Å
1130	S	24.4	Very low	25.9	Very low	136 Å²	136	147.3 Å²	147.3	95%	0.951	78%	0.778	S	S	*	*			trans	-75.8	71.7	-177.5	-49.4	0	0	0	0	113	L1128	L1128-S1130 PolarHBondContact O-N 2.85Å
1131	S	27.2	Very low	25.8	Very low	65 Å²	65	143.9 Å²	143.9	46%	0.455	77%	0.772	S	S	.	*			trans	-119.5	160.5	164	55.9	0	0	0	0	110.5	S1129	S1129-S1131 VanDerWaalsContact C-N 3.27Å; S1129-S1131 PolarHBondContact O-N 2.92Å
1132	H	28.1	Very low	25.7	Very low	178 Å²	178	143.8 Å²	143.8	82%	0.824	77%	0.774	S	S	*	*	S	Bend	trans	77.1	12.9	176.6	-40.1	-69.3	0	0	0	118.7
1133	I	27.4	Very low	25.5	Very low	154 Å²	154	148.3 Å²	148.3	79%	0.79	78%	0.783	S	S	*	*			trans	-118.9	55.2	163	-42.7	-177.3	0	0	0	111.5
1134	H	25.8	Very low	25.6	Very low	183 Å²	183	145.6 Å²	145.6	85%	0.847	78%	0.78	S	S	*	*			trans	-148.1	78.9	160.1	-84.3	-62.4	0	0	0	109.5	S1136	H1134-S1136 PolarHBondContact O-N 3.39Å
1135	P	25.6	Very low	25.6	Very low	112 Å²	112	147.3 Å²	147.3	73%	0.727	78%	0.78	S	S	*	*			trans	-65.1	117.7	162.1	28.6	-31.9	0	0	0	108.1	I1137	P1135-I1137 PolarHBondContact O-N 3.28Å
1136	S	24.8	Very low	25.6	Very low	118 Å²	118	147.2 Å²	147.2	83%	0.825	78%	0.784	S	S	*	*			trans	-63.6	100.8	-175.7	-56.5	0	0	0	0	111.3	H1134 S1138	H1134-S1136 PolarHBondContact O-N 3.39Å; S1136-S1138 VanDerWaalsContact C-N 3.31Å; S1136-S1138 PolarHBondContact O-N 2.99Å
1137	I	26.2	Very low	25.8	Very low	160 Å²	160	147.7 Å²	147.7	82%	0.821	78%	0.782	S	S	*	*			trans	-66.7	94	171.2	-59	177.3	0	0	0	107.6	P1135 S1139	P1135-I1137 PolarHBondContact O-N 3.28Å; I1137-S1139 PolarHBondContact O-N 3.49Å
1138	S	25.3	Very low	25.7	Very low	100 Å²	100	147.5 Å²	147.5	70%	0.699	78%	0.781	S	S	*	*			trans	-67.9	101.1	171.3	63	0	0	0	0	108.8	S1136 R1140	S1136-S1138 VanDerWaalsContact C-N 3.31Å; S1136-S1138 PolarHBondContact O-N 2.99Å; S1138-R1140 PolarHBondContact O-N 3.06Å
1139	S	25.8	Very low	25.8	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	78%	0.777	S	S	*	*			trans	-71.2	67.3	174.2	55.8	0	0	0	0	110.5	I1137 P1141	I1137-S1139 PolarHBondContact O-N 3.49Å; S1139-P1141 WeakPolarHBondContact O-CD 3.49Å
1140	R	24.8	Very low	25.8	Very low	222 Å²	222	144.1 Å²	144.1	84%	0.838	78%	0.775	S	S	*	*			trans	-61.1	117.2	156.1	-79	-171.7	171.1	-160.1	-2	106.2	S1138 M1142	S1138-R1140 PolarHBondContact O-N 3.06Å; R1140-M1142 PolarHBondContact O-N 3.08Å
1141	P	25	Very low	25.9	Very low	110 Å²	110	144.5 Å²	144.5	71%	0.714	77%	0.766	S	S	*	*			trans	-64.2	114.3	173.7	26.8	-32.1	0	0	0	107.5	S1139 Y1143	S1139-P1141 WeakPolarHBondContact O-CD 3.49Å; P1141-Y1143 PolarHBondContact O-N 3.42Å; P1141-Y1143 VanDerWaalsContact O-N 3.14Å
1142	M	24.6	Very low	25.8	Very low	174 Å²	174	147.1 Å²	147.1	86%	0.857	78%	0.78	S	S	*	*			trans	-62.9	115.8	160.1	-76.7	-176.3	61.8	0	0	106.3	R1140 E1144	R1140-M1142 PolarHBondContact O-N 3.08Å; M1142-E1144 PolarHBondContact O-N 3.13Å
1143	Y	24.5	Very low	25.6	Very low	220 Å²	220	150.2 Å²	150.2	86%	0.863	78%	0.784	S	S	*	*			trans	-65.8	85.9	160.4	-96.9	-97.4	0	0	0	106.9	P1141 R1145	P1141-Y1143 PolarHBondContact O-N 3.42Å; P1141-Y1143 VanDerWaalsContact O-N 3.14Å; Y1143-R1145 PolarHBondContact O-N 2.82Å
1144	E	27	Very low	25.5	Very low	165 Å²	165	149.3 Å²	149.3	77%	0.771	78%	0.781	S	S	*	*			trans	-68.6	78.7	165.3	-170.7	158.7	-133.8	0	0	107	M1142 D1146	M1142-E1144 PolarHBondContact O-N 3.13Å; E1144-D1146 PolarHBondContact O-N 3.41Å; E1144-D1146 VanDerWaalsContact O-N 3.13Å
1145	R	24.7	Very low	25.2	Very low	205 Å²	205	145.2 Å²	145.2	77%	0.774	77%	0.773	S	S	*	*			trans	-46.8	117.2	-179.6	174.6	-166.8	-61.9	153.4	0.3	108.4	Y1143 H1147	Y1143-R1145 PolarHBondContact O-N 2.82Å; R1145-H1147 PolarHBondContact O-N 3.13Å
1146	D	28	Very low	25.2	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	77%	0.773	S	S	*	*			trans	-41.1	100.3	-171.5	-64.7	-84	0	0	0	111.7	E1144 S1148	E1144-D1146 PolarHBondContact O-N 3.41Å; E1144-D1146 VanDerWaalsContact O-N 3.13Å; D1146-S1148 PolarHBondContact O-N 3.26Å
1147	H	27.6	Very low	25.2	Very low	162 Å²	162	148.4 Å²	148.4	75%	0.75	77%	0.774	S	S	*	*			trans	-74.4	87.6	176.7	-90.6	-48.4	0	0	0	106.9	R1145 V1149	R1145-H1147 PolarHBondContact O-N 3.13Å; H1147-V1149 PolarHBondContact O-N 3.47Å
1148	S	24.6	Very low	25.1	Very low	110 Å²	110	145.7 Å²	145.7	77%	0.769	77%	0.769	S	S	*	*			trans	-32.8	97.4	-176.9	57.7	0	0	0	0	111.1	D1146 G1150	D1146-S1148 PolarHBondContact O-N 3.26Å; S1148-G1150 PolarHBondContact O-N 3Å
1149	V	26.4	Very low	25.1	Very low	124 Å²	124	147.2 Å²	147.2	75%	0.752	77%	0.774	S	S	*	*			trans	-59.4	112.6	179	178.3	0	0	0	0	105.7	H1147 N1151	H1147-V1149 PolarHBondContact O-N 3.47Å; V1149-N1151 PolarHBondContact O-N 3.12Å
1150	G	24.1	Very low	25	Very low	63 Å²	63	148.9 Å²	148.9	65%	0.649	77%	0.774	S	S	*	*			trans	-56.8	109.7	-176.1	0	0	0	0	0	108.5	S1148 V1152	S1148-G1150 PolarHBondContact O-N 3Å; G1150-V1152 PolarHBondContact O-N 3.5Å
1151	N	26.6	Very low	25	Very low	144 Å²	144	144.5 Å²	144.5	77%	0.77	77%	0.767	S	S	*	*			trans	-50.9	108.9	-168.1	-82.6	-27.7	0	0	0	109.9	V1149 W1153	V1149-N1151 PolarHBondContact O-N 3.12Å; N1151-W1153 PolarHBondContact O-N 3.18Å
1152	V	25.7	Very low	25.1	Very low	121 Å²	121	146.8 Å²	146.8	73%	0.733	77%	0.768	S	S	*	*			trans	-66.4	116.5	166.4	175.7	0	0	0	0	105.6	G1150 N1154	G1150-V1152 PolarHBondContact O-N 3.5Å; V1152-N1154 PolarHBondContact O-N 3.08Å
1153	W	23.5	Very low	25.2	Very low	243 Å²	243	144.9 Å²	144.9	92%	0.92	76%	0.762	S	S	*	*			trans	-68.6	79.1	-178.7	-82.1	48.6	0	0	0	110.5	N1151 S1155	N1151-W1153 PolarHBondContact O-N 3.18Å; W1153-S1155 PolarHBondContact O-N 3.26Å
1154	N	24.2	Very low	25.5	Very low	135 Å²	135	141.4 Å²	141.4	72%	0.722	76%	0.758	S	S	*	*			trans	-62.1	114.7	157.3	-81.6	-9.7	0	0	0	107.2	V1152 S1156	V1152-N1154 PolarHBondContact O-N 3.08Å; N1154-S1156 PolarHBondContact O-N 2.78Å
1155	S	21.4	Very low	25.6	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	76%	0.763	S	S	*	*			trans	-74.6	67.7	-177.6	59.7	0	0	0	0	111.5	W1153 F1157	W1153-S1155 PolarHBondContact O-N 3.26Å; S1155-F1157 VanDerWaalsContact O-CD2 3.3Å; S1155-F1157 WeakPolarHBondContact O-CD2 3.23Å; S1155-F1157 PolarHBondContact O-N 2.82Å
1156	S	24.2	Very low	25.8	Very low	105 Å²	105	141 Å²	141	73%	0.734	77%	0.767	S	S	*	*			trans	-71.4	93.9	173.4	-63.2	0	0	0	0	109.6	N1154 S1158	N1154-S1156 PolarHBondContact O-N 2.78Å; S1156-S1158 PolarHBondContact O-N 2.98Å
1157	F	24.2	Very low	25.7	Very low	191 Å²	191	140 Å²	140	84%	0.838	77%	0.767	S	S	*	*			trans	-65.4	89.2	176.4	-78.2	-94.7	0	0	0	111.4	S1155	S1155-F1157 VanDerWaalsContact O-CD2 3.3Å; S1155-F1157 WeakPolarHBondContact O-CD2 3.23Å; S1155-F1157 PolarHBondContact O-N 2.82Å
1158	S	24.4	Very low	25.8	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	77%	0.767	S	S	*	*			trans	-88.2	110.8	163.6	56.2	0	0	0	0	109.7	S1156 N1160	S1156-S1158 PolarHBondContact O-N 2.98Å; S1158-N1160 VanDerWaalsContact C-N 3.26Å; S1158-N1160 PolarHBondContact O-N 2.8Å
1159	V	25.2	Very low	25.9	Very low	133 Å²	133	140.7 Å²	140.7	81%	0.806	77%	0.772	S	S	*	*			trans	-77.5	79.3	177.6	-176.4	0	0	0	0	109	N1161	V1159-N1161 PolarHBondContact O-N 3.4Å
1160	N	25.4	Very low	26	Very low	143 Å²	143	141 Å²	141	77%	0.765	77%	0.774	S	S	*	*			trans	-79.9	92.2	-177.6	-147.3	3.3	0	0	0	109.9	S1158 H1162	S1158-N1160 VanDerWaalsContact C-N 3.26Å; S1158-N1160 PolarHBondContact O-N 2.8Å; N1160-H1162 VanDerWaalsContact C-N 3.35Å; N1160-H1162 PolarHBondContact O-N 3.3Å
1161	N	24.3	Very low	26.1	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	78%	0.775	S	S	*	*			trans	-77	72.4	-164.5	-173.3	13.3	0	0	0	113.5	V1159 N1163	V1159-N1161 PolarHBondContact O-N 3.4Å; N1161-N1163 PolarHBondContact O-N 3.24Å
1162	H	27.1	Very low	26	Very low	158 Å²	158	143.4 Å²	143.4	73%	0.731	78%	0.779	S	S	*	*			trans	-95.7	84.7	177.3	-117.3	-46.3	0	0	0	112.7	N1160 N1164	N1160-H1162 VanDerWaalsContact C-N 3.35Å; N1160-H1162 PolarHBondContact O-N 3.3Å; H1162-N1164 PolarHBondContact O-N 2.96Å
1163	N	25.7	Very low	26.2	Very low	135 Å²	135	143.6 Å²	143.6	72%	0.722	78%	0.781	S	S	*	*			trans	-56.1	119.1	160.5	-90.2	-36.2	0	0	0	110.1	N1161	N1161-N1163 PolarHBondContact O-N 3.24Å
1164	N	30.4	Very low	26.3	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	77%	0.771	S	S	*	*			trans	-155	105.4	160.2	-104.7	-39.6	0	0	0	110.7	H1162 K1166	H1162-N1164 PolarHBondContact O-N 2.96Å; N1164-K1166 PolarHBondContact O-N 3.35Å
1165	N	29.2	Very low	26.3	Very low	165 Å²	165	138 Å²	138	88%	0.882	77%	0.773	S	S	*	*			trans	-69.6	118.2	178.4	-70.9	-41	0	0	0	110.8
1166	K	28.9	Very low	26.7	Very low	195 Å²	195	141.4 Å²	141.4	85%	0.848	78%	0.782	S	S	*	*			trans	-149	109.7	155.8	-126.8	170.7	-173.5	175.6	0	112.9	N1164	N1164-K1166 PolarHBondContact O-N 3.35Å
1167	T	27.6	Very low	26.7	Very low	136 Å²	136	143 Å²	143	83%	0.834	78%	0.783	S	S	*	*			trans	-73	125.8	171.9	48.2	0	0	0	0	110.9
1168	T	28.6	Very low	27	Very low	124 Å²	124	143.2 Å²	143.2	76%	0.761	78%	0.783	S	S	*	*			trans	-134.8	107.3	164.5	47.5	0	0	0	0	110.1
1169	N	26.2	Very low	27.2	Very low	163 Å²	163	143.2 Å²	143.2	87%	0.872	78%	0.783	S	S	*	*			trans	-68.5	131	171	-70.9	-31.6	0	0	0	110.3
1170	V	28.6	Very low	27.2	Very low	130 Å²	130	141.8 Å²	141.8	79%	0.788	78%	0.779	S	S	*	*			trans	-130.5	80.7	160.4	-172.5	0	0	0	0	109.6
1171	S	26.7	Very low	27.5	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	78%	0.783	S	S	*	*			trans	8.8	123.6	146	50.6	0	0	0	0	119.8
1172	N	25.4	Very low	27.5	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	78%	0.779	S	S	*	*			trans	-68.2	140.2	161.8	-67.2	-35.2	0	0	0	112.3
1173	T	28.4	Very low	27.6	Very low	125 Å²	125	141.5 Å²	141.5	77%	0.767	79%	0.789	S	S	*	*			trans	-129.5	91.8	167.3	42.6	0	0	0	0	109.9
1174	T	26.7	Very low	27.6	Very low	114 Å²	114	143.5 Å²	143.5	70%	0.699	79%	0.794	S	S	*	*				68.1	103	89.6	61.6	0	0	0	0	116.6
1175	N	24.6	Very low	27.4	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	79%	0.791	S	S	*	*			trans	59	126.8	142.2	-64.9	-29.9	0	0	0	122.2
1176	I	29.5	Very low	27.2	Very low	169 Å²	169	142.4 Å²	142.4	87%	0.867	79%	0.794	S	S	*	*				-171	107.9	117	-87.1	144.7	0	0	0	105.2
1177	N	23.6	Very low	27.1	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	78%	0.782	S	S	*	*			cis	87.3	101.8	46.3	-161.8	10.3	0	0	0	114.5
1178	K	30.2	Very low	27.1	Very low	196 Å²	196	138 Å²	138	85%	0.852	78%	0.781	S	S	*	*			trans	-174.6	116.2	150.5	-105.4	161.2	-173.8	176.9	0	113.5
1179	S	29	Very low	27	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	79%	0.787	S	S	*	*			trans	24.4	143.5	145.1	57.9	0	0	0	0	121.8
1180	S	24.9	Very low	27.1	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	79%	0.788	S	S	*	*			cis	-178.1	149.2	-11.1	48.2	0	0	0	0	105.9
1181	T	32.5	Very low	27	Very low	136 Å²	136	143.5 Å²	143.5	83%	0.834	79%	0.789	S	S	*	*				-156.1	162.9	55.2	43.2	0	0	0	0	113
1182	A	24.9	Very low	27.2	Very low	75 Å²	75	145.9 Å²	145.9	62%	0.62	79%	0.794	S	S	*	*			trans	-41.6	139.8	-174.1	0	0	0	0	0	119
1183	F	28.3	Very low	27.3	Very low	214 Å²	214	147.1 Å²	147.1	94%	0.939	79%	0.792	S	S	*	*				-144	141.5	97.2	-110.9	-81.7	0	0	0	110.5
1184	H	25.1	Very low	27.3	Very low	177 Å²	177	147.3 Å²	147.3	82%	0.819	79%	0.792	S	S	*	*			trans	-96	138.8	-178.6	-77	-91	0	0	0	111.7
1185	S	26	Very low	27.4	Very low	106 Å²	106	148.1 Å²	148.1	74%	0.741	80%	0.797	S	S	*	*				174.8	101.2	101.5	-167.8	0	0	0	0	111
1186	I	25.3	Very low	27.5	Very low	182 Å²	182	145.7 Å²	145.7	93%	0.933	79%	0.792	S	S	*	*			trans	-107.1	115.7	163.4	-63.3	176.8	0	0	0	106.1
1187	S	26	Very low	27.4	Very low	86 Å²	86	141.9 Å²	141.9	60%	0.601	79%	0.785	S	S	*	*			trans	-133.6	117.6	-177.5	-173.3	0	0	0	0	110.8
1188	N	28.6	Very low	27.6	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	79%	0.786	S	S	*	*			trans	59.1	66.4	155.9	-57.2	-10.1	0	0	0	118.1
1189	M	25.6	Very low	27.4	Very low	179 Å²	179	138.7 Å²	138.7	88%	0.882	78%	0.782	S	S	*	*			trans	-83.8	97.5	140.1	-80.1	179.1	60.7	0	0	109
1190	F	29.3	Very low	27.3	Very low	203 Å²	203	139.4 Å²	139.4	89%	0.89	79%	0.786	S	S	*	*			trans	-178.4	91.7	154.5	-95.4	-57	0	0	0	109.2
1191	N	27.4	Very low	27.3	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	79%	0.787	S	S	*	*			trans	-157.8	33.6	163.2	-136.4	-12.6	0	0	0	113.1	K1193	N1191-K1193 PolarHBondContact O-N 2.96Å
1192	D	30	Very low	26.8	Very low	146 Å²	146	143 Å²	143	78%	0.781	79%	0.785	S	S	*	*			trans	-72.7	96.6	178.2	-66.3	-54.3	0	0	0	110.6	V1194	D1192-V1194 PolarHBondContact O-N 3.48Å
1193	K	27	Very low	26.7	Very low	187 Å²	187	146.3 Å²	146.3	81%	0.813	79%	0.791	S	S	*	*			trans	-67.6	94	166.7	-89.1	-172	171.8	-177.8	0	109.5	N1191 T1195	N1191-K1193 PolarHBondContact O-N 2.96Å; K1193-T1195 VanDerWaalsContact C-N 3.31Å; K1193-T1195 PolarHBondContact O-N 3.27Å
1194	V	28.5	Very low	26.5	Very low	128 Å²	128	142.2 Å²	142.2	78%	0.776	78%	0.777	S	S	*	*			trans	-68	87.6	171	-176.8	0	0	0	0	109.7	D1192 S1196	D1192-V1194 PolarHBondContact O-N 3.48Å; V1194-S1196 PolarHBondContact O-N 3.47Å; V1194-S1196 VanDerWaalsContact O-N 3.13Å
1195	T	29.1	Very low	26.6	Very low	131 Å²	131	138.6 Å²	138.6	80%	0.804	77%	0.77	S	S	*	*			trans	-76.7	89.3	163.4	45.4	0	0	0	0	108.9	K1193 A1197	K1193-T1195 VanDerWaalsContact C-N 3.31Å; K1193-T1195 PolarHBondContact O-N 3.27Å; T1195-A1197 PolarHBondContact O-N 3.15Å
1196	S	26.1	Very low	26.4	Very low	96 Å²	96	139.4 Å²	139.4	67%	0.671	78%	0.775	S	S	*	*			trans	-68	91	178	55.7	0	0	0	0	111.5	V1194 V1198	V1194-S1196 PolarHBondContact O-N 3.47Å; V1194-S1196 VanDerWaalsContact O-N 3.13Å; S1196-V1198 PolarHBondContact O-N 2.73Å
1197	A	27.9	Very low	26.3	Very low	88 Å²	88	138 Å²	138	73%	0.727	77%	0.77	S	S	*	*			trans	-67.7	113.5	167.2	0	0	0	0	0	109.3	T1195 N1199	T1195-A1197 PolarHBondContact O-N 3.15Å; A1197-N1199 PolarHBondContact O-N 3.03Å; A1197-N1199 VanDerWaalsContact O-N 3.16Å
1198	V	27.1	Very low	26.2	Very low	123 Å²	123	140.1 Å²	140.1	75%	0.745	78%	0.779	S	S	*	*			trans	-78.4	100.2	-178	179.4	0	0	0	0	109.3	S1196 C1200	S1196-V1198 PolarHBondContact O-N 2.73Å; V1198-C1200 PolarHBondContact O-N 3.1Å; V1198-C1200 VanDerWaalsContact O-N 3.16Å
1199	N	27	Very low	26.2	Very low	145 Å²	145	141 Å²	141	78%	0.775	78%	0.782	S	S	*	*			trans	-72.3	104.2	171.6	-80.8	-10.6	0	0	0	110.1	A1197 I1201	A1197-N1199 PolarHBondContact O-N 3.03Å; A1197-N1199 VanDerWaalsContact O-N 3.16Å; N1199-I1201 PolarHBondContact O-N 2.83Å
1200	C	26	Very low	26.4	Very low	119 Å²	119	136.5 Å²	136.5	80%	0.804	77%	0.766	S	S	*	*			trans	-68.6	96.5	174.1	-66	0	0	0	0	110.9	V1198 Q1202	V1198-C1200 PolarHBondContact O-N 3.1Å; V1198-C1200 VanDerWaalsContact O-N 3.16Å; C1200-Q1202 PolarHBondContact O-N 3.32Å
1201	I	24.7	Very low	26.3	Very low	147 Å²	147	135.1 Å²	135.1	75%	0.754	76%	0.759	S	S	*	*			trans	-75.2	89.1	174.6	-61.2	173.8	0	0	0	108.9	N1199 I1203	N1199-I1201 PolarHBondContact O-N 2.83Å; I1201-I1203 HydrophobicContact CG2-CD1 4.37Å; I1201-I1203 HydrophobicContact CG2-CG1 3.94Å; I1201-I1203 PolarHBondContact O-N 3.04Å
1202	Q	23.8	Very low	26.1	Very low	166 Å²	166	133.1 Å²	133.1	78%	0.776	76%	0.757	S	S	*	*			trans	-86.6	91.8	175.5	-173	172.2	0.7	0	0	110.5	C1200 I1204	C1200-Q1202 PolarHBondContact O-N 3.32Å; Q1202-I1204 HydrophobicContact CG-CD1 4.48Å; Q1202-I1204 HydrophobicContact CG-CG1 4.38Å; Q1202-I1204 PolarHBondContact O-N 3.11Å
1203	I	21.1	Very low	26	Very low	146 Å²	146	132.3 Å²	132.3	75%	0.749	76%	0.758	S	S	*	*			trans	-75.1	116.6	174.4	-59.1	171.3	0	0	0	109.2	I1201	I1201-I1203 HydrophobicContact CG2-CD1 4.37Å; I1201-I1203 HydrophobicContact CG2-CG1 3.94Å; I1201-I1203 PolarHBondContact O-N 3.04Å
1204	I	24.1	Very low	25.8	Very low	127 Å²	127	130.4 Å²	130.4	65%	0.651	76%	0.755	S	S	*	*			trans	-126	122.9	161.9	-61.5	-178.6	0	0	0	106.9	Q1202	Q1202-I1204 HydrophobicContact CG-CD1 4.48Å; Q1202-I1204 HydrophobicContact CG-CG1 4.38Å; Q1202-I1204 PolarHBondContact O-N 3.11Å
1205	P	27.4	Very low	25.7	Very low	102 Å²	102	130.5 Å²	130.5	66%	0.662	76%	0.756	S	S	*	*			trans	-85.1	119.6	-166.7	31.5	-34.6	0	0	0	113.4	N1207	P1205-N1207 VanDerWaalsContact C-N 3.34Å; P1205-N1207 PolarHBondContact O-N 3.02Å
1206	S	22.9	Very low	25.5	Very low	122 Å²	122	131 Å²	131	85%	0.853	75%	0.754	S	S	*	*			trans	-88.4	61.5	174.6	-57.1	0	0	0	0	112.8	V1208	S1206-V1208 PolarHBondContact O-N 3.16Å; S1206-V1208 VanDerWaalsContact O-N 3.1Å
1207	N	22.4	Very low	25.4	Very low	154 Å²	154	133 Å²	133	82%	0.824	76%	0.762	S	S	*	*			trans	-78.1	84.3	174.4	-86.3	1.1	0	0	0	112	P1205	P1205-N1207 VanDerWaalsContact C-N 3.34Å; P1205-N1207 PolarHBondContact O-N 3.02Å
1208	V	23.8	Very low	25.3	Very low	130 Å²	130	135.2 Å²	135.2	79%	0.788	77%	0.766	S	S	*	*			trans	-141.8	97.2	154.9	-172.6	0	0	0	0	110.6	S1206	S1206-V1208 PolarHBondContact O-N 3.16Å; S1206-V1208 VanDerWaalsContact O-N 3.1Å
1209	I	28.6	Very low	25.3	Very low	171 Å²	171	134.7 Å²	134.7	88%	0.877	76%	0.764	S	S	*	*			trans	-114.4	120.9	155.1	-65.7	169.3	0	0	0	104.9
1210	P	30	Very low	25.2	Very low	84 Å²	84	131.5 Å²	131.5	55%	0.545	75%	0.753	S	S	.	*				-153.6	-176.9	122.2	44.2	-27.9	0	0	0	112.9
1211	F	26.5	Very low	25.1	Very low	173 Å²	173	131.5 Å²	131.5	76%	0.759	75%	0.749	S	S	*	*			cis	-136.6	153.4	2.9	-106.9	-61.4	0	0	0	110.3
1212	S	24.3	Very low	25.1	Very low	110 Å²	110	128.9 Å²	128.9	77%	0.769	74%	0.74	S	S	*	*			trans	-84.5	150.2	170.7	48.4	0	0	0	0	112.5
1213	T	27.2	Very low	25.2	Very low	130 Å²	130	125.1 Å²	125.1	80%	0.798	73%	0.729	S	S	*	*			trans	-116.7	137.7	170.8	-61.9	0	0	0	0	109.8
1214	I	23.6	Very low	25.3	Very low	147 Å²	147	123.3 Å²	123.3	75%	0.754	73%	0.725	S	S	*	*			trans	-94.6	130.8	-178.6	-60.2	167.4	0	0	0	109.2
1215	T	26	Very low	25.3	Very low	130 Å²	130	122.6 Å²	122.6	80%	0.798	73%	0.726	S	S	*	*			trans	-143.8	145.4	168.8	-53.2	0	0	0	0	110.3
1216	N	25.2	Very low	25.2	Very low	141 Å²	141	124 Å²	124	75%	0.754	73%	0.733	S	S	*	*			trans	-76.5	145.4	-165.4	-70.9	-40.5	0	0	0	114.1	T1218	N1216-T1218 PolarHBondContact O-N 3.16Å; N1216-T1218 VanDerWaalsContact O-N 3.16Å
1217	V	23.9	Very low	25.5	Very low	138 Å²	138	125.1 Å²	125.1	84%	0.836	73%	0.728	S	S	*	*			trans	-62	113.4	174.7	179.5	0	0	0	0	110.5
1218	T	25.2	Very low	25.7	Very low	134 Å²	134	122.5 Å²	122.5	82%	0.822	72%	0.722	S	S	*	*			trans	-120.5	135.3	163.5	-43	0	0	0	0	108	N1216	N1216-T1218 PolarHBondContact O-N 3.16Å; N1216-T1218 VanDerWaalsContact O-N 3.16Å
1219	T	26.6	Very low	25.8	Very low	113 Å²	113	125.5 Å²	125.5	69%	0.693	72%	0.724	S	S	*	*			trans	-90.8	154.2	-160.4	39.4	0	0	0	0	114.7
1220	S	25	Very low	25.8	Very low	77 Å²	77	123.1 Å²	123.1	54%	0.538	71%	0.713	S	S	.	*			trans	59.9	83.1	165.4	56.1	0	0	0	0	116.8	T1222	S1220-T1222 PolarHBondContact O-N 2.97Å; S1220-T1222 VanDerWaalsContact O-N 3.08Å
1221	T	25.4	Very low	25.6	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	73%	0.725	S	S	*	*			trans	-73.8	91.3	162.1	33.5	0	0	0	0	111	T1223	T1221-T1223 PolarHBondContact O-N 3.28Å
1222	T	24.3	Very low	25.8	Very low	92 Å²	92	124.2 Å²	124.2	56%	0.564	72%	0.722	S	S	*	*			trans	-55.8	123.3	171.8	-48.8	0	0	0	0	110	S1220 T1224	S1220-T1222 PolarHBondContact O-N 2.97Å; S1220-T1222 VanDerWaalsContact O-N 3.08Å; T1222-T1224 PolarHBondContact O-N 2.97Å; T1222-T1224 VanDerWaalsContact O-N 3.08Å
1223	T	24.9	Very low	26	Very low	87 Å²	87	126.8 Å²	126.8	53%	0.534	73%	0.728	S	S	.	*			trans	-88.9	75.1	-175.1	-55.9	0	0	0	0	111	T1221 T1225	T1221-T1223 PolarHBondContact O-N 3.28Å; T1223-T1225 PolarHBondContact O-N 3.02Å; T1223-T1225 VanDerWaalsContact O-N 3.11Å
1224	T	23.3	Very low	26.1	Very low	108 Å²	108	126.2 Å²	126.2	66%	0.663	72%	0.723	S	S	*	*			trans	-70.9	100.2	-179.3	-50.6	0	0	0	0	111	T1222 T1226	T1222-T1224 PolarHBondContact O-N 2.97Å; T1222-T1224 VanDerWaalsContact O-N 3.08Å; T1224-T1226 PolarHBondContact O-N 2.8Å
1225	T	25.7	Very low	26.2	Very low	111 Å²	111	122.4 Å²	122.4	68%	0.681	72%	0.72	S	S	*	*			trans	-95	79.7	177.5	34.8	0	0	0	0	111.2	T1223 I1227	T1223-T1225 PolarHBondContact O-N 3.02Å; T1223-T1225 VanDerWaalsContact O-N 3.11Å; T1225-I1227 PolarHBondContact O-N 2.76Å
1226	T	24.9	Very low	26.2	Very low	131 Å²	131	124 Å²	124	80%	0.804	72%	0.719	S	S	*	*			trans	-76.2	99.2	176.7	3.5	0	0	0	0	111	T1224	T1224-T1226 PolarHBondContact O-N 2.8Å
1227	I	28.5	Very low	26.1	Very low	147 Å²	147	127.8 Å²	127.8	75%	0.754	72%	0.724	S	S	*	*			trans	-93.9	128.6	175.4	-59.5	177.2	0	0	0	109.6	T1225	T1225-I1227 PolarHBondContact O-N 2.76Å
1228	S	27.4	Very low	26.2	Very low	99 Å²	99	130.5 Å²	130.5	69%	0.692	73%	0.725	S	S	*	*			trans	-75.4	143	-177.1	58.6	0	0	0	0	113.1	N1230	S1228-N1230 PolarHBondContact O-N 3.1Å
1229	K	24.9	Very low	26.2	Very low	193 Å²	193	130 Å²	130	84%	0.839	72%	0.722	S	S	*	*			trans	-74.4	85.3	175.7	-73	-176	177.1	179.1	0	111	N1231	K1229-N1231 PolarHBondContact O-N 3.2Å; K1229-N1231 VanDerWaalsContact O-N 3.14Å
1230	N	28.8	Very low	26.2	Very low	120 Å²	120	130 Å²	130	64%	0.642	73%	0.727	S	S	*	*			trans	-84.2	86.2	179.4	-149.8	-15.8	0	0	0	110.7	S1228 N1232	S1228-N1230 PolarHBondContact O-N 3.1Å; N1230-N1232 PolarHBondContact O-N 2.75Å; N1230-N1232 PolarHBondContact OD1-ND2 3.11Å
1231	N	27	Very low	26.3	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	74%	0.739	S	S	*	*			trans	-71	63	-175.8	-78.2	-2.9	0	0	0	113.5	K1229 N1233	K1229-N1231 PolarHBondContact O-N 3.2Å; K1229-N1231 VanDerWaalsContact O-N 3.14Å; N1231-N1233 PolarHBondContact O-N 3.13Å
1232	N	30.1	Very low	26.5	Very low	131 Å²	131	135.8 Å²	135.8	70%	0.701	74%	0.741	S	S	*	*			trans	-90.8	75.7	175.5	-69.9	-48.2	0	0	0	111.9	N1230 V1234	N1230-N1232 PolarHBondContact O-N 2.75Å; N1230-N1232 PolarHBondContact OD1-ND2 3.11Å; N1232-V1234 PolarHBondContact O-N 3.15Å
1233	N	29	Very low	26.5	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	76%	0.755	S	S	*	*			trans	-72.8	114.6	156	-93.6	-7.3	0	0	0	109	N1231	N1231-N1233 PolarHBondContact O-N 3.13Å
1234	V	28.3	Very low	26.7	Very low	117 Å²	117	141.4 Å²	141.4	71%	0.709	77%	0.765	S	S	*	*			trans	-168.4	121.8	139.5	140.9	0	0	0	0	106.6	N1232	N1232-V1234 PolarHBondContact O-N 3.15Å
1235	G	26	Very low	26.8	Very low	67 Å²	67	141.6 Å²	141.6	69%	0.691	77%	0.771	S	S	*	*			trans	-85.4	129.6	174.5	0	0	0	0	0	110.8
1236	H	26.3	Very low	26.8	Very low	164 Å²	164	141.9 Å²	141.9	76%	0.759	78%	0.776	S	S	*	*			trans	-101	107.3	164	-81.5	-70.4	0	0	0	109.5	F1238	H1236-F1238 PolarHBondContact O-N 2.86Å; H1236-F1238 VanDerWaalsContact O-N 3.15Å
1237	Y	23.5	Very low	26.7	Very low	220 Å²	220	143.5 Å²	143.5	86%	0.863	78%	0.776	S	S	*	*			trans	-63	110.6	171.6	-74.3	-97.3	0	0	0	109.9
1238	F	24.9	Very low	26.5	Very low	195 Å²	195	143 Å²	143	86%	0.855	78%	0.78	S	S	*	*			trans	-105.6	99.9	155.8	-92.2	-82.7	0	0	0	108.2	H1236 S1240	H1236-F1238 PolarHBondContact O-N 2.86Å; H1236-F1238 VanDerWaalsContact O-N 3.15Å; F1238-S1240 VanDerWaalsContact C-N 3.28Å; F1238-S1240 PolarHBondContact O-N 2.8Å
1239	T	25.3	Very low	26.4	Very low	125 Å²	125	142.9 Å²	142.9	77%	0.767	78%	0.776	S	S	*	*			trans	-73.7	82.5	170.3	49.3	0	0	0	0	109	Q1241	T1239-Q1241 PolarHBondContact O-N 2.85Å
1240	S	27.2	Very low	26.3	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	77%	0.769	S	S	*	*			trans	-65.1	118.5	166.6	55.3	0	0	0	0	108.8	F1238	F1238-S1240 VanDerWaalsContact C-N 3.28Å; F1238-S1240 PolarHBondContact O-N 2.8Å
1241	Q	26.3	Very low	26.1	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.794	77%	0.774	S	S	*	*			trans	-60.7	138.2	-176.1	-62.3	170.6	-91.2	0	0	112	T1239 Q1243	T1239-Q1241 PolarHBondContact O-N 2.85Å; Q1241-Q1243 PolarHBondContact O-N 3.24Å; Q1241-Q1243 VanDerWaalsContact O-N 3.17Å
1242	D	29.4	Very low	25.9	Very low	147 Å²	147	144.2 Å²	144.2	79%	0.786	78%	0.776	S	S	*	*			trans	35.7	68.7	139.2	-48.8	-39.1	0	0	0	116.9
1243	Q	25.6	Very low	25.7	Very low	183 Å²	183	145.9 Å²	145.9	86%	0.855	78%	0.779	S	S	*	*			trans	-71.3	130	138.6	-76.1	-148.1	-20	0	0	107.5	Q1241 S1245	Q1241-Q1243 PolarHBondContact O-N 3.24Å; Q1241-Q1243 VanDerWaalsContact O-N 3.17Å; Q1243-S1245 PolarHBondContact O-N 3.25Å
1244	P	28.9	Very low	25.4	Very low	115 Å²	115	146.5 Å²	146.5	75%	0.747	78%	0.777	S	S	*	*			trans	-60.5	138.3	179	26.9	-34.2	0	0	0	108.5	C1246	P1244-C1246 PolarHBondContact O-N 3.45Å
1245	S	25.7	Very low	25.2	Very low	112 Å²	112	146.1 Å²	146.1	78%	0.783	78%	0.779	S	S	*	*			trans	-54.4	105.5	178.8	46.7	0	0	0	0	109.5	Q1243 M1247	Q1243-S1245 PolarHBondContact O-N 3.25Å; S1245-M1247 PolarHBondContact O-N 3.48Å
1246	C	23.8	Very low	25.2	Very low	116 Å²	116	146.7 Å²	146.7	78%	0.784	78%	0.777	S	S	*	*			trans	-64.3	94.7	169.5	47.2	0	0	0	0	106.2	P1244 T1248	P1244-C1246 PolarHBondContact O-N 3.45Å; C1246-T1248 PolarHBondContact O-N 2.99Å
1247	M	23.8	Very low	25.1	Very low	165 Å²	165	147.5 Å²	147.5	81%	0.813	78%	0.781	S	S	*	*			trans	-49.9	115.5	168.9	-82.8	-169	166.7	0	0	106.1	S1245 T1249	S1245-M1247 PolarHBondContact O-N 3.48Å; M1247-T1249 PolarHBondContact O-N 2.85Å
1248	T	25	Very low	25.3	Very low	136 Å²	136	143.8 Å²	143.8	83%	0.834	78%	0.776	S	S	*	*			trans	-63	83.9	163	36.1	0	0	0	0	105.7	C1246 S1250	C1246-T1248 PolarHBondContact O-N 2.99Å; T1248-S1250 PolarHBondContact O-N 2.78Å
1249	T	23.5	Very low	25.3	Very low	98 Å²	98	139.2 Å²	139.2	60%	0.601	77%	0.769	S	S	*	*			trans	-56.8	98.2	168.9	36.5	0	0	0	0	104.6	M1247 F1251	M1247-T1249 PolarHBondContact O-N 2.85Å; T1249-F1251 VanDerWaalsContact C-N 3.27Å; T1249-F1251 WeakPolarHBondContact O-CD2 3.33Å; T1249-F1251 PolarHBondContact O-N 2.97Å
1250	S	23.8	Very low	25.4	Very low	100 Å²	100	139.1 Å²	139.1	70%	0.699	77%	0.773	S	S	*	*			trans	-57.4	103.3	172.6	178.3	0	0	0	0	105	T1248 R1252	T1248-S1250 PolarHBondContact O-N 2.78Å; S1250-R1252 PolarHBondContact O-N 3.09Å
1251	F	25.2	Very low	25.4	Very low	170 Å²	170	138.5 Å²	138.5	75%	0.746	77%	0.769	S	S	*	*			trans	-69	66.1	163.3	-78.9	-89.6	0	0	0	107.2	T1249 H1253	T1249-F1251 VanDerWaalsContact C-N 3.27Å; T1249-F1251 WeakPolarHBondContact O-CD2 3.33Å; T1249-F1251 PolarHBondContact O-N 2.97Å; F1251-H1253 PolarHBondContact O-N 3.48Å
1252	R	22.9	Very low	25.4	Very low	220 Å²	220	135.4 Å²	135.4	83%	0.83	77%	0.766	S	S	*	*				-47.7	90.2	129.5	-85.6	-173	166.5	-174.5	-3.1	105.5	S1250 Q1254	S1250-R1252 PolarHBondContact O-N 3.09Å; R1252-Q1254 PolarHBondContact O-N 2.85Å
1253	H	24.9	Very low	25.3	Very low	165 Å²	165	136.3 Å²	136.3	76%	0.764	77%	0.769	S	S	*	*			trans	-47.6	102.6	143.9	-81.4	-93.5	0	0	0	105	F1251 S1255	F1251-H1253 PolarHBondContact O-N 3.48Å; H1253-S1255 PolarHBondContact O-N 2.84Å; H1253-S1255 VanDerWaalsContact O-N 3.12Å
1254	Q	23.4	Very low	25.4	Very low	179 Å²	179	136.1 Å²	136.1	84%	0.836	77%	0.768	S	S	*	*			trans	-50.9	124.2	156.2	-72.4	-175.4	-7.7	0	0	104.2	R1252 A1256	R1252-Q1254 PolarHBondContact O-N 2.85Å; Q1254-A1256 VanDerWaalsContact C-N 3.25Å; Q1254-A1256 PolarHBondContact O-N 3.03Å
1255	S	24.3	Very low	25.3	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	77%	0.773	S	S	*	*			trans	-58.2	98.5	177.1	38	0	0	0	0	106.7	H1253 Q1257	H1253-S1255 PolarHBondContact O-N 2.84Å; H1253-S1255 VanDerWaalsContact O-N 3.12Å; S1255-Q1257 VanDerWaalsContact C-N 3.29Å; S1255-Q1257 PolarHBondContact O-N 2.81Å
1256	A	25.1	Very low	25.4	Very low	80 Å²	80	139.1 Å²	139.1	66%	0.661	77%	0.77	S	S	*	*			trans	-57.6	104.1	172.1	0	0	0	0	0	104.7	Q1254 N1258	Q1254-A1256 VanDerWaalsContact C-N 3.25Å; Q1254-A1256 PolarHBondContact O-N 3.03Å; A1256-N1258 VanDerWaalsContact C-N 3.3Å; A1256-N1258 PolarHBondContact O-N 3.4Å
1257	Q	25.3	Very low	25.6	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	77%	0.771	S	S	*	*			trans	-59.9	106.8	170.2	-70.9	-178.4	-19.2	0	0	103.8	S1255 S1259	S1255-Q1257 VanDerWaalsContact C-N 3.29Å; S1255-Q1257 PolarHBondContact O-N 2.81Å; Q1257-S1259 PolarHBondContact O-N 3Å
1258	N	27	Very low	25.7	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	77%	0.771	S	S	*	*			trans	-66.7	81.5	175	-81.7	-23.1	0	0	0	106.6	A1256 S1260	A1256-N1258 VanDerWaalsContact C-N 3.3Å; A1256-N1258 PolarHBondContact O-N 3.4Å; N1258-S1260 WeakPolarHBondContact O-CA 3.45Å; N1258-S1260 PolarHBondContact O-N 2.85Å; N1258-S1260 PolarHBondContact O-OG 2.9Å
1259	S	25.4	Very low	25.7	Very low	100 Å²	100	139.3 Å²	139.3	70%	0.699	77%	0.773	S	S	*	*			trans	-49.9	106.5	179.6	46.6	0	0	0	0	106.3	Q1257 S1261	Q1257-S1259 PolarHBondContact O-N 3Å; S1259-S1261 PolarHBondContact O-N 3.35Å
1260	S	26.5	Very low	25.9	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	78%	0.781	S	S	*	*			trans	-80.3	72.5	-155.3	-47.4	0	0	0	0	109.6	N1258 S1262	N1258-S1260 WeakPolarHBondContact O-CA 3.45Å; N1258-S1260 PolarHBondContact O-N 2.85Å; N1258-S1260 PolarHBondContact O-OG 2.9Å; S1260-S1262 PolarHBondContact O-N 3.15Å
1261	S	26.6	Very low	26.1	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	79%	0.788	S	S	*	*			trans	-72.4	76.9	-171.4	55.8	0	0	0	0	110.7	S1259 I1263	S1259-S1261 PolarHBondContact O-N 3.35Å; S1261-I1263 PolarHBondContact O-N 3.01Å
1262	S	28.2	Very low	26	Very low	106 Å²	106	143 Å²	143	74%	0.741	79%	0.794	S	S	*	*			trans	40.3	68.2	146.6	60.5	0	0	0	0	114.4	S1260 Q1264	S1260-S1262 PolarHBondContact O-N 3.15Å; S1262-Q1264 PolarHBondContact O-N 3.25Å
1263	I	26.5	Very low	26.3	Very low	165 Å²	165	142.4 Å²	142.4	85%	0.846	79%	0.793	S	S	*	*			trans	-63.6	98.5	156.6	-63.4	-179.2	0	0	0	105.8	S1261 Q1265	S1261-I1263 PolarHBondContact O-N 3.01Å; I1263-Q1265 PolarHBondContact O-N 2.83Å; I1263-Q1265 VanDerWaalsContact O-N 3.09Å
1264	Q	26.9	Very low	26.7	Very low	180 Å²	180	140 Å²	140	84%	0.841	79%	0.792	S	S	*	*			trans	-52.7	113	-178.6	-173.2	173.8	5.7	0	0	108.7	S1262 P1266	S1262-Q1264 PolarHBondContact O-N 3.25Å; Q1264-P1266 WeakPolarHBondContact O-CD 3.28Å; Q1264-P1266 VanDerWaalsContact O-N 3.15Å
1265	Q	26.6	Very low	26.8	Very low	179 Å²	179	138.9 Å²	138.9	84%	0.836	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-57.7	121.4	-177.7	-78.9	-175.6	-30.8	0	0	109.2	I1263	I1263-Q1265 PolarHBondContact O-N 2.83Å; I1263-Q1265 VanDerWaalsContact O-N 3.09Å
1266	P	28.4	Very low	27.3	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.5	136.7	171.8	26.5	-32.8	0	0	0	108.3	Q1264 S1268	Q1264-P1266 WeakPolarHBondContact O-CD 3.28Å; Q1264-P1266 VanDerWaalsContact O-N 3.15Å; P1266-S1268 PolarHBondContact O-N 3.41Å
1267	P	28.3	Very low	27.4	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.1	135.1	-171.6	22	-33	0	0	0	111.4	M1269	P1267-M1269 PolarHBondContact O-N 3.48Å; P1267-M1269 VanDerWaalsContact O-N 3.13Å
1268	S	26.6	Very low	27.5	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	80%	0.798	S	S	*	*			trans	-67.3	107.3	-171.7	34.9	0	0	0	0	112.1	P1266 P1270	P1266-S1268 PolarHBondContact O-N 3.41Å; S1268-P1270 WeakPolarHBondContact O-CD 3.09Å
1269	M	23.6	Very low	27.6	Very low	180 Å²	180	137 Å²	137	89%	0.887	79%	0.791	S	S	*	*			trans	-62	124.7	169.6	-79.7	-160.4	-68.2	0	0	110.5	P1267	P1267-M1269 PolarHBondContact O-N 3.48Å; P1267-M1269 VanDerWaalsContact O-N 3.13Å
1270	P	28.6	Very low	27.7	Very low	117 Å²	117	140 Å²	140	76%	0.76	80%	0.799	S	S	*	*			trans	-73.7	144	177.5	29.6	-34	0	0	0	111.8	S1268 L1272	S1268-P1270 WeakPolarHBondContact O-CD 3.09Å; P1270-L1272 PolarHBondContact O-N 3.26Å
1271	L	26.8	Very low	27.7	Very low	163 Å²	163	142 Å²	142	85%	0.853	80%	0.795	S	S	*	*			trans	-69.3	113.7	-178.5	-70.5	161.7	0	0	0	111.8	Y1273	L1271-Y1273 PolarHBondContact O-N 3.47Å
1272	L	24.8	Very low	27.8	Very low	164 Å²	164	144 Å²	144	86%	0.859	80%	0.803	S	S	*	*			trans	-77.2	111.8	172.1	-76.6	164.3	0	0	0	111.1	P1270	P1270-L1272 PolarHBondContact O-N 3.26Å
1273	Y	28.9	Very low	27.7	Very low	208 Å²	208	143.7 Å²	143.7	82%	0.816	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-84	156.6	166.8	-95.2	-99.7	0	0	0	111.4	L1271	L1271-Y1273 PolarHBondContact O-N 3.47Å
1274	P	33.1	Very low	27.7	Very low	115 Å²	115	147.7 Å²	147.7	75%	0.747	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-91.3	160.9	-156.6	35.4	-36.6	0	0	0	115.6
1275	L	25.9	Very low	27.6	Very low	156 Å²	156	146.6 Å²	146.6	82%	0.817	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.1	155.5	170	-89	79.1	0	0	0	112.6
1276	P	35.2	Very low	27.8	Very low	125 Å²	125	149.3 Å²	149.3	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-80.6	153.4	-176.6	33.1	-36.3	0	0	0	114.1
1277	V	27.2	Very low	27.6	Very low	130 Å²	130	151.9 Å²	151.9	79%	0.788	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.3	128.5	177.4	178.4	0	0	0	0	111.1	T1279	V1277-T1279 HydrophobicContact CG1-CG2 4.21Å
1278	S	27.2	Very low	27.5	Very low	114 Å²	114	151.9 Å²	151.9	80%	0.797	81%	0.814	S	S	*	*			trans	-87.9	109.5	168	56.3	0	0	0	0	111.1
1279	T	28.5	Very low	27.4	Very low	102 Å²	102	151.1 Å²	151.1	63%	0.626	80%	0.804	S	S	*	*			trans	-89.7	104.4	-178.3	52.4	0	0	0	0	112.5	V1277	V1277-T1279 HydrophobicContact CG1-CG2 4.21Å
1280	N	26.3	Very low	27.7	Very low	161 Å²	161	150.8 Å²	150.8	86%	0.861	81%	0.805	S	S	*	*			trans	-107.8	89.2	166.5	-85.3	-16.8	0	0	0	110.4
1281	H	26.9	Very low	27.6	Very low	166 Å²	166	152.5 Å²	152.5	77%	0.769	81%	0.806	S	S	*	*			trans	-98.2	106.5	172.3	-77.9	-75	0	0	0	110.9
1282	T	29.2	Very low	27.5	Very low	140 Å²	140	149.3 Å²	149.3	86%	0.859	80%	0.797	S	S	*	*			trans	-105.1	67.7	168.7	47	0	0	0	0	110.9	R1284	T1282-R1284 PolarHBondContact O-N 3.42Å
1283	S	26.3	Very low	27.7	Very low	100 Å²	100	147.8 Å²	147.8	70%	0.699	80%	0.797	S	S	*	*			trans	-73.6	105.8	175.3	52.8	0	0	0	0	111.2	L1285	S1283-L1285 PolarHBondContact O-N 2.85Å
1284	R	26.7	Very low	27.5	Very low	249 Å²	249	143 Å²	143	94%	0.94	79%	0.794	S	S	*	*			trans	-74.2	118	166.6	-77.1	-172.9	171.2	-168.5	-2.5	109.7	T1282	T1282-R1284 PolarHBondContact O-N 3.42Å
1285	L	25.3	Very low	27.3	Very low	157 Å²	157	146 Å²	146	82%	0.822	80%	0.802	S	S	*	*			trans	-79.4	142.5	171.3	-76.9	157.7	0	0	0	110.3	S1283	S1283-L1285 PolarHBondContact O-N 2.85Å
1286	Y	29.4	Very low	27.4	Very low	236 Å²	236	145.9 Å²	145.9	93%	0.925	80%	0.802	S	S	*	*			trans	-115.3	156.9	148.8	-104	-85.9	0	0	0	108.9
1287	Q	24.5	Very low	27	Very low	165 Å²	165	151.1 Å²	151.1	77%	0.771	81%	0.806	S	S	*	*			trans	-124.6	128.9	-146.2	-180	-179.5	-0.4	0	0	111.9
1288	S	26.6	Very low	27	Very low	125 Å²	125	154.2 Å²	154.2	87%	0.874	81%	0.809	S	S	*	*			trans	-138.8	133.2	159.6	54.2	0	0	0	0	108.9
1289	T	25.2	Very low	27.1	Very low	100 Å²	100	157.2 Å²	157.2	61%	0.613	81%	0.81	S	S	*	*			trans	-119.2	117.5	-157.7	-50.6	0	0	0	0	111.2
1290	I	28.4	Very low	27	Very low	174 Å²	174	159 Å²	159	89%	0.892	82%	0.815	S	S	*	*			trans	-131.8	145.2	157	-60.9	-175.6	0	0	0	107.7
1291	I	27.3	Very low	27.2	Very low	152 Å²	152	158.2 Å²	158.2	78%	0.779	81%	0.809	S	S	*	*			trans	-90.9	148.9	-151.9	-65.3	164.6	0	0	0	112.9
1292	S	24.6	Very low	27.3	Very low	96 Å²	96	155.7 Å²	155.7	67%	0.671	81%	0.807	S	S	*	*			trans	-65.5	164.6	177.8	-43.1	0	0	0	0	113.7
1293	P	28.6	Very low	27.1	Very low	132 Å²	132	156 Å²	156	86%	0.857	79%	0.792	S	S	*	*				-112.9	134.9	115.5	31.6	-34	0	0	0	111.7
1294	S	24.2	Very low	27.4	Very low	109 Å²	109	156.6 Å²	156.6	76%	0.762	79%	0.794	S	S	*	*			trans	-98.3	129.7	-179.4	50.8	0	0	0	0	111.7
1295	I	29.4	Very low	27.4	Very low	176 Å²	176	149.4 Å²	149.4	90%	0.903	78%	0.782	S	S	*	*			trans	-129.6	147.9	161.7	-61.9	-177.4	0	0	0	107.8
1296	D	28.8	Very low	27.5	Very low	155 Å²	155	153.5 Å²	153.5	83%	0.829	79%	0.788	S	S	*	*			trans	-69	150.7	-148.9	-88	-63.1	0	0	0	119	K1298	D1296-K1298 PolarHBondContact O-N 2.93Å
1297	R	25.8	Very low	27.5	Very low	235 Å²	235	151.5 Å²	151.5	89%	0.887	78%	0.784	S	S	*	*			trans	-67.8	123.9	163.5	-68.6	174.1	171.1	177.1	-2.5	110.5
1298	K	28.5	Very low	27.7	Very low	194 Å²	194	153 Å²	153	84%	0.843	79%	0.791	S	S	*	*			trans	-129.6	112	146	-71.1	-171.6	178.2	176.3	0	109.5	D1296	D1296-K1298 PolarHBondContact O-N 2.93Å
1299	Q	27.8	Very low	27.7	Very low	177 Å²	177	153.3 Å²	153.3	83%	0.827	79%	0.787	S	S	*	*			trans	-68.4	132.5	173.6	-72.8	176.8	-39.9	0	0	109.8
1300	I	26.9	Very low	27.6	Very low	141 Å²	141	154 Å²	154	72%	0.723	79%	0.792	S	S	*	*			trans	-130.6	113.9	162.4	-57.6	-178.9	0	0	0	106.9	P1019	P1019-I1300 HydrophobicContact CG-CG2 4.47Å
1301	I	30.6	Very low	27.4	Very low	143 Å²	143	151.3 Å²	151.3	73%	0.733	79%	0.786	S	S	*	*			trans	-104.6	141.3	177.8	-71.5	178.1	0	0	0	107.4
1302	P	28.6	Very low	27.3	Very low	113 Å²	113	150.1 Å²	150.1	73%	0.734	79%	0.786	S	S	*	*			trans	-78.7	159.1	-155.8	29.1	-37.2	0	0	0	116.2
1303	R	25.3	Very low	27.5	Very low	146 Å²	146	151.1 Å²	151.1	55%	0.551	79%	0.788	S	S	*	*			trans	-75.9	140	169.2	-102.8	-165.5	165.6	154.3	-4.8	112.2	P1019 G1020 L1021	P1019-R1303 PolarHBondContact O-NH1 3.36Å; G1020-R1303 VanDerWaalsContact C-CZ 3.47Å; G1020-R1303 WeakPolarHBondContact O-CG 3Å; G1020-R1303 PolarHBondContact O-NE 3.15Å; L1021-R1303 PolarHBondContact O-NE 2.65Å; L1021-R1303 PolarHBondContact O-NH2 3.22Å
1304	P	32.4	Very low	27.3	Very low	114 Å²	114	152.3 Å²	152.3	74%	0.74	79%	0.787	S	S	*	*			trans	-106.4	168.8	160.1	38	-31.2	0	0	0	113.3
1305	S	27.1	Very low	27.4	Very low	97 Å²	97	155.6 Å²	155.6	68%	0.678	79%	0.788	S	S	*	*			trans	76.9	104.5	161.7	-162.9	0	0	0	0	119.4
1306	Y	27.7	Very low	27	Very low	244 Å²	244	153.4 Å²	153.4	96%	0.957	78%	0.778	S	S	*	*				-112.3	122.9	125.2	-84.7	-87.1	0	0	0	107.4
1307	K	30	Very low	26.9	Very low	193 Å²	193	154.4 Å²	154.4	84%	0.839	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-98.1	127.9	164.9	-85.1	-170.5	172.9	-174.8	0	108.3
1308	Q	27.3	Very low	26.6	Very low	196 Å²	196	147.7 Å²	147.7	92%	0.916	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-85.9	143.6	175.6	-151.3	164.3	6.2	0	0	109.9
1309	V	26.5	Very low	26.4	Very low	132 Å²	132	145.6 Å²	145.6	80%	0.8	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-82.8	131.4	-167.1	177	0	0	0	0	111.5
1310	T	24.8	Very low	26.3	Very low	115 Å²	115	144.8 Å²	144.8	71%	0.706	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-76.8	125.5	171.3	-38.1	0	0	0	0	109.9	T1312	T1310-T1312 PolarHBondContact O-N 3.33Å
1311	P	23.9	Very low	26.3	Very low	117 Å²	117	146 Å²	146	76%	0.76	76%	0.758	S	S	*	*			trans	-76.3	107.3	-179.3	29.7	-33.4	0	0	0	111.2
1312	T	24.8	Very low	26	Very low	128 Å²	128	148.4 Å²	148.4	79%	0.785	76%	0.759	S	S	*	*			trans	-84.4	113.8	170.7	50.8	0	0	0	0	110.8	T1310	T1310-T1312 PolarHBondContact O-N 3.33Å
1313	T	29	Very low	25.9	Very low	117 Å²	117	150.9 Å²	150.9	72%	0.718	76%	0.76	S	S	*	*			trans	-129.8	81.1	166.4	53	0	0	0	0	110.1	F1315	T1313-F1315 PolarHBondContact O-N 3.2Å
1314	N	23.6	Very low	25.9	Very low	156 Å²	156	150.8 Å²	150.8	83%	0.834	77%	0.77	S	S	*	*			trans	-69.6	119.5	162.6	-69.7	-4.3	0	0	0	107.9
1315	F	26.1	Very low	25.6	Very low	179 Å²	179	152.8 Å²	152.8	79%	0.785	77%	0.77	S	S	*	*			trans	-127.7	104.2	158.9	-93.1	-76.8	0	0	0	108.6	T1313	T1313-F1315 PolarHBondContact O-N 3.2Å
1316	D	22.3	Very low	25.5	Very low	129 Å²	129	153.8 Å²	153.8	69%	0.69	78%	0.777	S	S	*	*			trans	-76.4	131.6	174.8	-163.5	-29.5	0	0	0	108.9	S1318	D1316-S1318 PolarHBondContact OD1-N 2.99Å; D1316-S1318 PolarHBondContact OD1-OG 2.8Å
1317	F	25.2	Very low	25.6	Very low	176 Å²	176	148.1 Å²	148.1	77%	0.772	77%	0.768	S	S	*	*			trans	-135.4	76.3	173	-99.1	-72.4	0	0	0	109.4	M1319	F1317-M1319 PolarHBondContact O-N 2.89Å; F1317-M1319 VanDerWaalsContact O-N 3.09Å
1318	S	21.2	Very low	25.4	Very low	94 Å²	94	146.5 Å²	146.5	66%	0.657	77%	0.767	S	S	*	*			trans	-68.5	101.3	175.2	-15.5	0	0	0	0	109.8	D1316	D1316-S1318 PolarHBondContact OD1-N 2.99Å; D1316-S1318 PolarHBondContact OD1-OG 2.8Å
1319	M	24.2	Very low	25.4	Very low	151 Å²	151	142.5 Å²	142.5	74%	0.744	76%	0.758	S	S	*	*			trans	-119.2	95.6	177.7	-107.7	-77.9	-79.7	0	0	110	F1317 H1321	F1317-M1319 PolarHBondContact O-N 2.89Å; F1317-M1319 VanDerWaalsContact O-N 3.09Å; M1319-H1321 PolarHBondContact O-N 2.85Å
1320	H	24.7	Very low	25.3	Very low	159 Å²	159	141.4 Å²	141.4	74%	0.736	76%	0.756	S	S	*	*			trans	-65.4	119.3	175.1	-71.3	-95.8	0	0	0	110.6
1321	H	27	Very low	25.4	Very low	167 Å²	167	141.7 Å²	141.7	77%	0.773	76%	0.76	S	S	*	*			trans	-133.7	108.7	158.9	-101	45	0	0	0	109.6	M1319	M1319-H1321 PolarHBondContact O-N 2.85Å
1322	Y	23.4	Very low	25.6	Very low	194 Å²	194	143.8 Å²	143.8	76%	0.761	76%	0.764	S	S	*	*			trans	-71.3	129.4	170.5	-85.9	-98.9	0	0	0	109.9
1323	H	27.6	Very low	25.6	Very low	164 Å²	164	142.9 Å²	142.9	76%	0.759	76%	0.763	S	S	*	*			trans	-142.1	112.5	152	-114	54.8	0	0	0	110.2	H1325	H1323-H1325 PolarHBondContact O-N 3.37Å
1324	N	24.5	Very low	25.6	Very low	144 Å²	144	143.3 Å²	143.3	77%	0.77	77%	0.765	S	S	*	*			trans	-79.2	109.8	178.7	-73.4	-21	0	0	0	109.9
1325	H	27.6	Very low	25.6	Very low	156 Å²	156	144 Å²	144	72%	0.722	77%	0.766	S	S	*	*			trans	-118.1	101.9	160.3	-77.5	-67.4	0	0	0	109.8	H1323 T1327	H1323-H1325 PolarHBondContact O-N 3.37Å; H1325-T1327 PolarHBondContact O-N 3.3Å
1326	S	24.7	Very low	25.6	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	76%	0.764	S	S	*	*			trans	-80.1	76	-179	56.1	0	0	0	0	111.6	I1328	S1326-I1328 PolarHBondContact O-N 3.08Å
1327	T	28.5	Very low	25.8	Very low	126 Å²	126	144.2 Å²	144.2	77%	0.773	77%	0.773	S	S	*	*			trans	-80.9	100.8	165.2	49.1	0	0	0	0	109.4	H1325	H1325-T1327 PolarHBondContact O-N 3.3Å
1328	I	26.1	Very low	25.8	Very low	158 Å²	158	143.7 Å²	143.7	81%	0.81	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-60.1	123.6	173.7	-61.3	171.3	0	0	0	108.3	S1326 S1330	S1326-I1328 PolarHBondContact O-N 3.08Å; I1328-S1330 PolarHBondContact O-N 3.07Å
1329	P	26.9	Very low	26	Very low	113 Å²	113	147.7 Å²	147.7	73%	0.734	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-72.5	123.2	-178.1	28.3	-33.4	0	0	0	110.6
1330	S	24.5	Very low	25.9	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-63.6	125	169.7	52.5	0	0	0	0	109.8	I1328 L1332	I1328-S1330 PolarHBondContact O-N 3.07Å; S1330-L1332 PolarHBondContact O-N 2.87Å
1331	P	28.4	Very low	26	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-68.6	118.1	-176.1	27.1	-33.8	0	0	0	110.4	S1333	P1331-S1333 PolarHBondContact O-N 2.81Å; P1331-S1333 VanDerWaalsContact O-N 3.09Å
1332	L	27.2	Very low	26.1	Very low	161 Å²	161	145.4 Å²	145.4	84%	0.843	79%	0.792	S	S	*	*			trans	-70.5	104.9	171.2	-155.9	81	0	0	0	108	S1330 T1334	S1330-L1332 PolarHBondContact O-N 2.87Å; L1332-T1334 PolarHBondContact O-N 3.17Å; L1332-T1334 PolarHBondContact O-OG1 3.24Å
1333	S	25.2	Very low	26.4	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	80%	0.798	S	S	*	*			trans	-55.5	105.4	178	-74.8	0	0	0	0	110	P1331 M1335	P1331-S1333 PolarHBondContact O-N 2.81Å; P1331-S1333 VanDerWaalsContact O-N 3.09Å; S1333-M1335 PolarHBondContact O-N 3.14Å
1334	T	27.8	Very low	26.4	Very low	125 Å²	125	145.4 Å²	145.4	77%	0.767	80%	0.801	S	S	*	*			trans	-73.3	83.6	179.4	-50.3	0	0	0	0	108	L1332 L1336	L1332-T1334 PolarHBondContact O-N 3.17Å; L1332-T1334 PolarHBondContact O-OG1 3.24Å; T1334-L1336 VanDerWaalsContact C-N 3.28Å; T1334-L1336 PolarHBondContact O-N 3.36Å
1335	M	24	Very low	26.5	Very low	172 Å²	172	149.2 Å²	149.2	85%	0.847	81%	0.805	S	S	*	*			trans	-59.4	99.8	163.2	-83.8	-162.7	71.4	0	0	107.2	S1333 L1337	S1333-M1335 PolarHBondContact O-N 3.14Å; M1335-L1337 PolarHBondContact O-N 2.99Å; M1335-L1337 VanDerWaalsContact O-N 3.14Å
1336	L	27.7	Very low	26.5	Very low	145 Å²	145	147.6 Å²	147.6	76%	0.759	81%	0.806	S	S	*	*			trans	-47.5	122.3	170.8	-77	161.6	0	0	0	107.8	T1334 L1338	T1334-L1336 VanDerWaalsContact C-N 3.28Å; T1334-L1336 PolarHBondContact O-N 3.36Å; L1336-L1338 VanDerWaalsContact C-N 3.26Å; L1336-L1338 PolarHBondContact O-N 3.26Å
1337	L	25.8	Very low	26.7	Very low	166 Å²	166	149.5 Å²	149.5	87%	0.869	80%	0.802	S	S	*	*			trans	-61.3	99.4	165.6	-83.8	96.1	0	0	0	107	M1335 Q1339	M1335-L1337 PolarHBondContact O-N 2.99Å; M1335-L1337 VanDerWaalsContact O-N 3.14Å; L1337-Q1339 PolarHBondContact O-N 3.32Å
1338	L	25.1	Very low	26.6	Very low	165 Å²	165	150.6 Å²	150.6	86%	0.864	80%	0.802	S	S	*	*			trans	-59.1	92.4	163.1	-77.8	167.3	0	0	0	106.5	L1336 S1340	L1336-L1338 VanDerWaalsContact C-N 3.26Å; L1336-L1338 PolarHBondContact O-N 3.26Å; L1338-S1340 PolarHBondContact O-N 3.32Å
1339	Q	24.7	Very low	26.8	Very low	178 Å²	178	148.8 Å²	148.8	83%	0.832	80%	0.798	S	S	*	*			trans	-56.7	108.5	172.5	-73.6	-172.6	-14	0	0	106.8	L1337 P1341	L1337-Q1339 PolarHBondContact O-N 3.32Å; Q1339-P1341 WeakPolarHBondContact O-CD 3.38Å; Q1339-P1341 VanDerWaalsContact O-N 3.08Å
1340	S	23.1	Very low	26.8	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	80%	0.801	S	S	*	*			trans	-52.1	118.2	175.7	35.1	0	0	0	0	108	L1338 K1342	L1338-S1340 PolarHBondContact O-N 3.32Å; S1340-K1342 PolarHBondContact O-N 2.81Å
1341	P	26.6	Very low	27	Very low	118 Å²	118	150.5 Å²	150.5	77%	0.766	80%	0.801	S	S	*	*			trans	-54.8	131	-172.9	-29.4	36	0	0	0	110.2	Q1339 L1343	Q1339-P1341 WeakPolarHBondContact O-CD 3.38Å; Q1339-P1341 VanDerWaalsContact O-N 3.08Å; P1341-L1343 VanDerWaalsContact C-N 3.27Å; P1341-L1343 PolarHBondContact O-N 3.4Å
1342	K	29.2	Very low	26.9	Very low	208 Å²	208	150 Å²	150	90%	0.904	80%	0.801	S	S	*	*			trans	-63.8	90	179.4	-72.3	178.2	179.4	175.1	0	109.2	S1340 K1344	S1340-K1342 PolarHBondContact O-N 2.81Å; K1342-K1344 PolarHBondContact O-N 2.78Å
1343	L	28.8	Very low	27	Very low	167 Å²	167	147.9 Å²	147.9	87%	0.874	80%	0.797	S	S	*	*			trans	-53	108	173.9	-81.6	164.3	0	0	0	108.3	P1341 R1345	P1341-L1343 VanDerWaalsContact C-N 3.27Å; P1341-L1343 PolarHBondContact O-N 3.4Å; L1343-R1345 PolarHBondContact O-N 3.14Å
1344	K	28.5	Very low	27	Very low	191 Å²	191	150.6 Å²	150.6	83%	0.83	80%	0.803	S	S	*	*			trans	-59.4	111.1	166.9	-92	-174.6	170.5	-177.5	0	106.6	K1342 T1346	K1342-K1344 PolarHBondContact O-N 2.78Å; K1344-T1346 PolarHBondContact O-N 2.96Å
1345	R	26.2	Very low	27.1	Very low	224 Å²	224	151 Å²	151	85%	0.845	81%	0.805	S	S	*	*			trans	-64.2	98.3	177.8	-174.2	-178.1	-170.6	177.4	1.5	108.5	L1343 E1347	L1343-R1345 PolarHBondContact O-N 3.14Å; R1345-E1347 PolarHBondContact O-N 3.26Å
1346	T	28.6	Very low	27.1	Very low	122 Å²	122	146.4 Å²	146.4	75%	0.748	80%	0.802	S	S	*	*			trans	-66.7	115.1	174.8	-39	0	0	0	0	108.4	K1344 L1348	K1344-T1346 PolarHBondContact O-N 2.96Å; T1346-L1348 PolarHBondContact O-N 3.31Å
1347	E	28.2	Very low	27	Very low	159 Å²	159	146.5 Å²	146.5	74%	0.743	80%	0.801	S	S	*	*			trans	-78	103.3	-179.7	-65.2	-176.2	155	0	0	109.2	R1345 T1349	R1345-E1347 PolarHBondContact O-N 3.26Å; E1347-T1349 VanDerWaalsContact C-N 3.31Å; E1347-T1349 PolarHBondContact O-N 3.26Å
1348	L	26.6	Very low	26.9	Very low	149 Å²	149	142.3 Å²	142.3	78%	0.78	80%	0.798	S	S	*	*			trans	-75.3	83.5	175.6	-72.4	169.7	0	0	0	109.9	T1346 N1350	T1346-L1348 PolarHBondContact O-N 3.31Å; L1348-N1350 VanDerWaalsContact C-N 3.33Å; L1348-N1350 PolarHBondContact O-N 3.05Å
1349	T	29.5	Very low	27.1	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	79%	0.793	S	S	*	*			trans	-73.3	84.2	173	53.9	0	0	0	0	110.4	E1347 S1351	E1347-T1349 VanDerWaalsContact C-N 3.31Å; E1347-T1349 PolarHBondContact O-N 3.26Å; T1349-S1351 VanDerWaalsContact C-N 3.3Å; T1349-S1351 PolarHBondContact O-N 3.37Å
1350	N	27.7	Very low	27.1	Very low	149 Å²	149	142 Å²	142	80%	0.797	80%	0.796	S	S	*	*			trans	-71.6	82.8	172.9	-71.7	-7.7	0	0	0	110.5	L1348 S1352	L1348-N1350 VanDerWaalsContact C-N 3.33Å; L1348-N1350 PolarHBondContact O-N 3.05Å; N1350-S1352 PolarHBondContact O-N 3.48Å
1351	S	27.4	Very low	27.3	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	80%	0.799	S	S	*	*			trans	-76	107.9	170.6	53.4	0	0	0	0	110.4	T1349	T1349-S1351 VanDerWaalsContact C-N 3.3Å; T1349-S1351 PolarHBondContact O-N 3.37Å
1352	S	26.1	Very low	27.2	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-61.3	143.2	171	-59.6	0	0	0	0	111.3	N1350	N1350-S1352 PolarHBondContact O-N 3.48Å
1353	P	29.4	Very low	27.1	Very low	116 Å²	116	144 Å²	144	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.3	140.2	179.9	31.4	-34.5	0	0	0	112.4	T1355	P1353-T1355 PolarHBondContact O-N 3.05Å
1354	D	26.2	Very low	26.9	Very low	168 Å²	168	143.6 Å²	143.6	90%	0.898	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-65.3	126.2	169.9	-83.9	-57.9	0	0	0	111.7
1355	T	28.8	Very low	26.7	Very low	133 Å²	133	142.7 Å²	142.7	82%	0.816	80%	0.797	S	S	*	*			trans	-115.4	75.3	163.8	57.8	0	0	0	0	109.6	P1353 I1357	P1353-T1355 PolarHBondContact O-N 3.05Å; T1355-I1357 PolarHBondContact O-N 3.09Å
1356	G	23.9	Very low	26.6	Very low	75 Å²	75	141 Å²	141	77%	0.773	80%	0.799	S	S	*	*			trans	-70.2	112.8	177.3	0	0	0	0	0	112.1
1357	I	26.4	Very low	26.3	Very low	147 Å²	147	141.3 Å²	141.3	75%	0.754	80%	0.801	S	S	*	*			trans	-127	99.2	160.4	-59.1	-178.7	0	0	0	107	T1355 I1359	T1355-I1357 PolarHBondContact O-N 3.09Å; I1357-I1359 HydrophobicContact CG2-CD1 4.4Å; I1357-I1359 HydrophobicContact CG2-CG1 4.01Å
1358	G	22.9	Very low	26.2	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	81%	0.805	S	S	*	*			trans	-77.6	134.6	166.3	0	0	0	0	0	109.7
1359	I	29.4	Very low	26	Very low	145 Å²	145	139.7 Å²	139.7	74%	0.744	81%	0.808	S	S	*	*			trans	-127	110.3	168.2	-49.6	-179.7	0	0	0	106.4	I1357	I1357-I1359 HydrophobicContact CG2-CD1 4.4Å; I1357-I1359 HydrophobicContact CG2-CG1 4.01Å
1360	E	25.5	Very low	25.7	Very low	192 Å²	192	140 Å²	140	90%	0.897	81%	0.814	S	S	*	*			trans	-76.9	122.2	177.8	-63	176.1	142.9	0	0	109
1361	S	28.4	Very low	25.7	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	82%	0.82	S	S	*	*			trans	-129.2	68.4	177.5	68.9	0	0	0	0	111.1	Y1363	S1361-Y1363 PolarHBondContact O-N 3.23Å
1362	T	24.1	Very low	25.5	Very low	125 Å²	125	139.1 Å²	139.1	77%	0.767	83%	0.827	S	S	*	*			trans	-65.4	121.4	162.8	46.6	0	0	0	0	109.7
1363	Y	25.7	Very low	25.5	Very low	233 Å²	233	137.4 Å²	137.4	91%	0.914	83%	0.827	S	S	*	*			trans	-149.7	132.8	154.6	-122	-79	0	0	0	110.5	S1361	S1361-Y1363 PolarHBondContact O-N 3.23Å
1364	D	25.5	Very low	25.3	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	83%	0.831	S	S	*	*			trans	-82.3	159.9	-167.2	-85.9	-61.4	0	0	0	114.9
1365	Q	23.7	Very low	25.1	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.804	83%	0.832	S	S	*	*			trans	-74.7	136.2	177.7	-62.2	172.2	-7.2	0	0	111.8
1366	Q	25.4	Very low	25	Very low	189 Å²	189	139.1 Å²	139.1	88%	0.883	83%	0.829	S	S	*	*			trans	-129.8	107.1	148.6	-72.1	-164.9	-3.6	0	0	109.7
1367	T	21.7	Very low	25.1	Very low	128 Å²	128	141.4 Å²	141.4	79%	0.785	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-92.7	118.9	175	48.9	0	0	0	0	110.4
1368	T	25.5	Very low	25.1	Very low	137 Å²	137	142.4 Å²	142.4	84%	0.84	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-101	144	174.5	-44	0	0	0	0	110.5
1369	T	23.3	Very low	25.2	Very low	138 Å²	138	145.4 Å²	145.4	85%	0.847	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-85.1	164.4	-162.7	27.4	0	0	0	0	116
1370	C	22.4	Very low	25	Very low	126 Å²	126	145 Å²	145	85%	0.851	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-80.8	153.3	-166.9	-51.8	0	0	0	0	114.4
1371	T	28.6	Very low	24.9	Very low	151 Å²	151	145.5 Å²	145.5	93%	0.926	83%	0.834	S	S	*	*			trans	-128.3	137.9	151	40.4	0	0	0	0	109.3
1372	G	23.2	Very low	24.7	Very low	88 Å²	88	149 Å²	149	91%	0.907	84%	0.837	S	S	*	*			trans	-110.1	146.6	-176.5	0	0	0	0	0	112.7
1373	G	25.7	Very low	24.8	Very low	74 Å²	74	151.2 Å²	151.2	76%	0.763	84%	0.838	S	S	*	*			trans	-125.9	139.1	170.3	0	0	0	0	0	110.4
1374	S	25	Very low	24.7	Very low	121 Å²	121	145.3 Å²	145.3	85%	0.846	83%	0.831	S	S	*	*			trans	-87.7	147.2	-176.2	46.3	0	0	0	0	113
1375	F	22.6	Very low	24.6	Very low	207 Å²	207	146.4 Å²	146.4	91%	0.908	84%	0.836	S	S	*	*			trans	-81.5	142.8	174.4	-76.5	-100.3	0	0	0	111.8
1376	T	26.6	Very low	24.5	Very low	124 Å²	124	143.5 Å²	143.5	76%	0.761	83%	0.834	S	S	*	*			trans	-122	133.9	159.3	44.8	0	0	0	0	109.4
1377	P	26	Very low	24.4	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-82.3	130.1	-176.6	31.6	-33.4	0	0	0	111.6
1378	L	25.7	Very low	24.4	Very low	168 Å²	168	137.8 Å²	137.8	88%	0.88	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-95.1	120.2	173.4	-85.8	164.7	0	0	0	110.9
1379	N	25.1	Very low	24.3	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-65.5	131.4	177.3	-74.3	-38.5	0	0	0	111.4	Y1381	N1379-Y1381 PolarHBondContact O-N 2.7Å
1380	T	25.8	Very low	24.3	Very low	135 Å²	135	140.4 Å²	140.4	83%	0.828	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.9	117.9	175.7	-49.4	0	0	0	0	110.2	H1382	T1380-H1382 PolarHBondContact O-N 2.93Å
1381	Y	23.7	Very low	24.3	Very low	204 Å²	204	138.7 Å²	138.7	80%	0.8	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.9	122.9	179.7	-89	-106.9	0	0	0	111.8	N1379	N1379-Y1381 PolarHBondContact O-N 2.7Å
1382	H	23.6	Very low	24	Very low	186 Å²	186	138.2 Å²	138.2	86%	0.861	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.4	116.6	164.4	-92.9	-98	0	0	0	110.1	T1380	T1380-H1382 PolarHBondContact O-N 2.93Å
1383	H	26.6	Very low	24	Very low	173 Å²	173	145.9 Å²	145.9	80%	0.801	81%	0.814	S	S	*	*			trans	-87.6	108.9	166.4	-85.4	-77.9	0	0	0	110.8
1384	S	22.4	Very low	24.4	Very low	109 Å²	109	147 Å²	147	76%	0.762	81%	0.81	S	S	*	*			trans	-83.8	134.2	165	44.8	0	0	0	0	110.5
1385	L	23.9	Very low	24.9	Very low	179 Å²	179	146.9 Å²	146.9	94%	0.937	81%	0.806	S	S	*	*			trans	-133.4	164.3	163.4	-82	177.2	0	0	0	109.8
1386	S	22.2	Very low	24.8	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	79%	0.792	S	S	*	*			trans	-138.7	174.4	-142.3	-169	0	0	0	0	114.1
1387	S	23	Very low	24.8	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	79%	0.794	S	S	*	*			trans	69.7	136.3	-179.2	74.3	0	0	0	0	115.6
1388	S	22.1	Very low	24.7	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	79%	0.791	S	S	*	*			cis	78.7	99.9	15.7	92.5	0	0	0	0	117.1
1389	N	23.7	Very low	24.8	Very low	155 Å²	155	145 Å²	145	83%	0.829	79%	0.786	S	S	*	*				-167.6	170.5	116.1	-101.1	-37.1	0	0	0	113.7
1390	M	22.3	Very low	24.7	Very low	175 Å²	175	143.6 Å²	143.6	86%	0.862	79%	0.786	S	S	*	*			trans	-88.3	156.2	-169.3	-49.4	167.4	-73.5	0	0	113.2
1391	A	22.9	Very low	24.9	Very low	91 Å²	91	146 Å²	146	75%	0.752	79%	0.788	S	S	*	*				174.2	139.1	108.7	0	0	0	0	0	111.9
1392	V	21.8	Very low	25	Very low	140 Å²	140	143.9 Å²	143.9	85%	0.848	79%	0.785	S	S	*	*			trans	-130.7	129.9	167.4	173.1	0	0	0	0	108.1
1393	W	22.8	Very low	25.1	Very low	249 Å²	249	144.9 Å²	144.9	94%	0.943	79%	0.787	S	S	*	*			trans	-132.4	140	168.7	-92.3	64.5	0	0	0	110.1
1394	S	34.9	Very low	25.1	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	79%	0.787	S	S	*	*			trans	-90.9	-172	169.2	61.9	0	0	0	0	109
1395	P	35.1	Very low	25.3	Very low	118 Å²	118	149.8 Å²	149.8	77%	0.766	79%	0.793	S	S	*	*			cis	-126	-157.7	3.8	30.5	-3.9	0	0	0	111.2
1396	S	21.6	Very low	25.4	Very low	86 Å²	86	150.3 Å²	150.3	60%	0.601	79%	0.791	S	S	*	*			cis	179.8	177.5	37.4	63.3	0	0	0	0	113
1397	Q	25	Very low	25.7	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	79%	0.794	S	S	*	*			trans	70.4	147	158.1	-67.3	175.8	17.7	0	0	119.4
1398	H	24.4	Very low	25.9	Very low	158 Å²	158	152.9 Å²	152.9	73%	0.731	80%	0.796	S	S	*	*			cis	-165.6	169.2	-35.5	-133.7	-90.6	0	0	0	109.8
1399	H	28	Very low	26	Very low	166 Å²	166	157.1 Å²	157.1	77%	0.769	81%	0.808	S	S	*	*			trans	72.4	127.5	165.7	-83	87.7	0	0	0	119.9
1400	C	22.4	Very low	26.1	Very low	113 Å²	113	156 Å²	156	76%	0.764	81%	0.807	S	S	*	*			trans	-118.8	155.7	164.9	-64.6	0	0	0	0	109.1
1401	Q	30.5	Very low	26.4	Very low	186 Å²	186	153.7 Å²	153.7	87%	0.869	80%	0.802	S	S	*	*			trans	-134.7	131.3	149.8	-75.6	-169.9	-16.7	0	0	108.3
1402	Q	26	Very low	26.5	Very low	159 Å²	159	155.2 Å²	155.2	74%	0.743	81%	0.805	S	S	*	*			trans	-103.1	142.3	-177.5	-67.1	173.2	-70.4	0	0	110.5
1403	F	26.6	Very low	26.7	Very low	206 Å²	206	153.9 Å²	153.9	90%	0.904	80%	0.802	S	S	*	*			trans	-112.4	130.1	164.8	-90.9	-88.5	0	0	0	109.7
1404	N	26.6	Very low	26.9	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	80%	0.795	S	S	*	*			trans	-88.1	142.6	175.2	-73.8	-34.9	0	0	0	111.1
1405	R	25.8	Very low	26.4	Very low	238 Å²	238	151.8 Å²	151.8	90%	0.898	80%	0.803	S	S	*	*			trans	-131.8	144.9	151.5	-80.6	-170.7	170.3	-174.7	-2.8	108.6
1406	Q	26.1	Very low	26.1	Very low	190 Å²	190	152.3 Å²	152.3	89%	0.888	80%	0.799	S	S	*	*			trans	-111.5	106.3	-177.1	-68.2	167	-66	0	0	108.5	S1408	Q1406-S1408 PolarHBondContact O-N 2.95Å
1407	D	28.9	Very low	26.4	Very low	156 Å²	156	155.9 Å²	155.9	83%	0.834	81%	0.811	S	S	*	*			trans	-79.7	114.3	173	-67.3	-45.7	0	0	0	109.6	M1409	D1407-M1409 PolarHBondContact O-N 2.84Å
1408	S	26.5	Very low	26.5	Very low	109 Å²	109	155.3 Å²	155.3	76%	0.762	81%	0.808	S	S	*	*			trans	-74.2	106.3	-177.3	54.5	0	0	0	0	111.4	Q1406 T1410	Q1406-S1408 PolarHBondContact O-N 2.95Å; S1408-T1410 PolarHBondContact O-N 3Å; S1408-T1410 VanDerWaalsContact O-N 3.12Å
1409	M	24.2	Very low	26.5	Very low	186 Å²	186	153.2 Å²	153.2	92%	0.916	81%	0.811	S	S	*	*			trans	-67.3	106.7	170.3	-77.9	-167.3	170.3	0	0	111.2	D1407 T1411	D1407-M1409 PolarHBondContact O-N 2.84Å; M1409-T1411 PolarHBondContact O-N 3.08Å
1410	T	26.8	Very low	26.4	Very low	131 Å²	131	151.7 Å²	151.7	80%	0.804	81%	0.808	S	S	*	*			trans	-74.2	104	162.4	47.2	0	0	0	0	109.5	S1408	S1408-T1410 PolarHBondContact O-N 3Å; S1408-T1410 VanDerWaalsContact O-N 3.12Å
1411	T	26.8	Very low	26.5	Very low	126 Å²	126	150.7 Å²	150.7	77%	0.773	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-65.2	128	170.9	35.7	0	0	0	0	110.2	M1409 S1413	M1409-T1411 PolarHBondContact O-N 3.08Å; T1411-S1413 PolarHBondContact O-N 2.82Å
1412	P	25.9	Very low	26.3	Very low	123 Å²	123	151.8 Å²	151.8	80%	0.799	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.9	127.2	179	28	-33.3	0	0	0	110.1	T1414	P1412-T1414 PolarHBondContact O-N 2.94Å
1413	S	26.7	Very low	26.3	Very low	113 Å²	113	151.2 Å²	151.2	79%	0.79	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.3	124.9	177.6	42.5	0	0	0	0	110.9	T1411 M1415	T1411-S1413 PolarHBondContact O-N 2.82Å; S1413-M1415 PolarHBondContact O-N 3.29Å
1414	T	25.6	Very low	26.3	Very low	130 Å²	130	146.9 Å²	146.9	80%	0.798	80%	0.797	S	S	*	*			trans	-66.8	104.5	173	46.4	0	0	0	0	109.9	P1412 N1416	P1412-T1414 PolarHBondContact O-N 2.94Å; T1414-N1416 PolarHBondContact O-N 3.09Å
1415	M	25.7	Very low	26.3	Very low	173 Å²	173	145.2 Å²	145.2	85%	0.852	80%	0.797	S	S	*	*			trans	-65.6	119.4	164.2	-70.8	-166.8	72.7	0	0	108.8	S1413 N1417	S1413-M1415 PolarHBondContact O-N 3.29Å; M1415-N1417 PolarHBondContact O-N 2.92Å
1416	N	28.3	Very low	26.8	Very low	129 Å²	129	139.3 Å²	139.3	69%	0.69	79%	0.79	S	S	*	*			trans	-65	119	171.7	-82.2	-20.9	0	0	0	109.2	T1414 H1418	T1414-N1416 PolarHBondContact O-N 3.09Å; N1416-H1418 PolarHBondContact O-N 2.94Å
1417	N	27.2	Very low	26.8	Very low	160 Å²	160	137 Å²	137	86%	0.856	78%	0.783	S	S	*	*			trans	-68.4	82.2	171.1	-78.7	-21.8	0	0	0	110	M1415 S1419	M1415-N1417 PolarHBondContact O-N 2.92Å; N1417-S1419 PolarHBondContact O-N 2.88Å
1418	H	26.8	Very low	26.9	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.745	78%	0.784	S	S	*	*			trans	-66.3	102.9	160.8	-84.7	-76.6	0	0	0	108.2	N1416 I1420	N1416-H1418 PolarHBondContact O-N 2.94Å; H1418-I1420 PolarHBondContact O-N 3.1Å
1419	S	25.1	Very low	26.9	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	79%	0.785	S	S	*	*			trans	-66.3	93.8	174.1	52.7	0	0	0	0	109.7	N1417 S1421	N1417-S1419 PolarHBondContact O-N 2.88Å; S1419-S1421 PolarHBondContact O-N 3.01Å
1420	I	25.8	Very low	27.1	Very low	135 Å²	135	142.5 Å²	142.5	69%	0.692	78%	0.784	S	S	*	*			trans	-68.7	98.6	170.6	-60.1	175.2	0	0	0	107.5	H1418 Y1422	H1418-I1420 PolarHBondContact O-N 3.1Å; I1420-Y1422 HydrophobicContact CG2-CD2 4.46Å; I1420-Y1422 HydrophobicContact CG2-CE2 4.36Å; I1420-Y1422 PolarHBondContact O-N 2.86Å
1421	S	24.4	Very low	27.3	Very low	92 Å²	92	143.2 Å²	143.2	64%	0.643	78%	0.782	S	S	*	*			trans	-68.4	112	167.8	48.7	0	0	0	0	108.8	S1419 D1423	S1419-S1421 PolarHBondContact O-N 3.01Å; S1421-D1423 VanDerWaalsContact C-N 3.27Å; S1421-D1423 PolarHBondContact O-N 2.95Å
1422	Y	25.6	Very low	27.3	Very low	208 Å²	208	142.8 Å²	142.8	82%	0.816	78%	0.784	S	S	*	*			trans	-72.1	84.1	170.8	-81.8	-93.3	0	0	0	109.8	I1420 S1424	I1420-Y1422 HydrophobicContact CG2-CD2 4.46Å; I1420-Y1422 HydrophobicContact CG2-CE2 4.36Å; I1420-Y1422 PolarHBondContact O-N 2.86Å; Y1422-S1424 PolarHBondContact O-N 2.92Å
1423	D	27.3	Very low	27.3	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	79%	0.786	S	S	*	*			trans	-63.1	106	161.9	-87.1	-39.2	0	0	0	108.3	S1421 S1425	S1421-D1423 VanDerWaalsContact C-N 3.27Å; S1421-D1423 PolarHBondContact O-N 2.95Å; D1423-S1425 PolarHBondContact O-N 3.4Å
1424	S	26	Very low	27.3	Very low	115 Å²	115	147 Å²	147	80%	0.804	79%	0.79	S	S	*	*			trans	-79.9	68.7	-175.3	40	0	0	0	0	110.7	Y1422 P1426	Y1422-S1424 PolarHBondContact O-N 2.92Å; S1424-P1426 VanDerWaalsContact O-CD 3.25Å; S1424-P1426 WeakPolarHBondContact O-CD 3.2Å
1425	S	26	Very low	27.2	Very low	112 Å²	112	148.9 Å²	148.9	78%	0.783	79%	0.794	S	S	*	*			trans	-71.3	113.3	169.8	-173	0	0	0	0	110.1	D1423 D1427	D1423-S1425 PolarHBondContact O-N 3.4Å; S1425-D1427 PolarHBondContact O-N 3.02Å
1426	P	36.6	Very low	27.3	Very low	115 Å²	115	145.9 Å²	145.9	75%	0.747	79%	0.786	S	S	*	*			trans	-95.1	97.5	-176.8	34.4	-25.2	0	0	0	110.1	S1424	S1424-P1426 VanDerWaalsContact O-CD 3.25Å; S1424-P1426 WeakPolarHBondContact O-CD 3.2Å
1427	D	27.6	Very low	27.1	Very low	141 Å²	141	146.6 Å²	146.6	75%	0.754	80%	0.795	S	S	*	*			trans	-168.2	88.3	157.2	-103.3	-26.7	0	0	0	112.5	S1425	S1425-D1427 PolarHBondContact O-N 3.02Å
1428	K	29.2	Very low	26.9	Very low	194 Å²	194	147.4 Å²	147.4	84%	0.843	79%	0.791	S	S	*	*			trans	-141.9	100.9	158.3	-73.9	-162.6	175.4	179.6	0	110.5	F1430	K1428-F1430 PolarHBondContact O-N 3.14Å; K1428-F1430 VanDerWaalsContact O-N 3.13Å
1429	H	27.7	Very low	26.8	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.787	79%	0.794	S	S	*	*			trans	-57.7	111.9	171.2	-79.5	-98.5	0	0	0	110.9	N1431	H1429-N1431 PolarHBondContact O-N 3.18Å
1430	F	29.1	Very low	26.9	Very low	203 Å²	203	146.4 Å²	146.4	89%	0.89	79%	0.794	S	S	*	*			trans	-78	102.1	164.7	-89.9	-90.9	0	0	0	109.4	K1428 S1432	K1428-F1430 PolarHBondContact O-N 3.14Å; K1428-F1430 VanDerWaalsContact O-N 3.13Å; F1430-S1432 PolarHBondContact O-N 3.49Å
1431	N	29.7	Very low	26.9	Very low	146 Å²	146	148.1 Å²	148.1	78%	0.781	80%	0.799	S	S	*	*			trans	-62.1	129.4	171.3	-78.5	-25.2	0	0	0	110.2	H1429 C1433	H1429-N1431 PolarHBondContact O-N 3.18Å; N1431-C1433 PolarHBondContact O-N 3.05Å; N1431-C1433 VanDerWaalsContact O-N 3.17Å
1432	S	28	Very low	26.9	Very low	116 Å²	116	150.9 Å²	150.9	81%	0.811	81%	0.806	S	S	*	*			trans	-73.1	105.3	-173.9	54.1	0	0	0	0	112.2	F1430 K1434	F1430-S1432 PolarHBondContact O-N 3.49Å; S1432-K1434 PolarHBondContact O-N 3.41Å; S1432-K1434 VanDerWaalsContact O-N 3.14Å
1433	C	25.9	Very low	27.1	Very low	124 Å²	124	148 Å²	148	84%	0.838	81%	0.805	S	S	*	*			trans	-63.8	111.3	171.2	-71.6	0	0	0	0	110.8	N1431 L1435	N1431-C1433 PolarHBondContact O-N 3.05Å; N1431-C1433 VanDerWaalsContact O-N 3.17Å; C1433-L1435 PolarHBondContact O-N 2.89Å; C1433-L1435 VanDerWaalsContact O-N 3.11Å
1434	K	24.8	Very low	27	Very low	202 Å²	202	148.4 Å²	148.4	88%	0.878	80%	0.802	S	S	*	*			trans	-82.4	86.6	-173.7	-166.3	177.6	-174.4	179.5	0	110.7	S1432 T1436	S1432-K1434 PolarHBondContact O-N 3.41Å; S1432-K1434 VanDerWaalsContact O-N 3.14Å; K1434-T1436 PolarHBondContact O-N 3.02Å
1435	L	25.3	Very low	27.1	Very low	168 Å²	168	150.7 Å²	150.7	88%	0.88	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-59.6	122.3	178.4	-94	157.4	0	0	0	111.7	C1433	C1433-L1435 PolarHBondContact O-N 2.89Å; C1433-L1435 VanDerWaalsContact O-N 3.11Å
1436	T	26.9	Very low	27.3	Very low	111 Å²	111	151.5 Å²	151.5	68%	0.681	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.7	127.8	178.9	47.4	0	0	0	0	111.3	K1434 F1438	K1434-T1436 PolarHBondContact O-N 3.02Å; T1436-F1438 PolarHBondContact O-N 3.5Å
1437	T	24.3	Very low	26.8	Very low	144 Å²	144	153.9 Å²	153.9	88%	0.883	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.1	123.7	175.8	33.2	0	0	0	0	112.2
1438	F	23.1	Very low	26.9	Very low	176 Å²	176	153.8 Å²	153.8	77%	0.772	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-95.6	133.1	163.8	-80.4	-87.3	0	0	0	109.9	T1436	T1436-F1438 PolarHBondContact O-N 3.5Å
1439	P	24.8	Very low	26.8	Very low	124 Å²	124	150.8 Å²	150.8	81%	0.805	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.6	121.1	177.5	31.1	-32.4	0	0	0	110.9
1440	V	27.3	Very low	26.9	Very low	130 Å²	130	147.8 Å²	147.8	79%	0.788	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-98.2	128.3	168.7	-178.8	0	0	0	0	108.2
1441	Q	24.8	Very low	26.9	Very low	172 Å²	172	144.9 Å²	144.9	80%	0.804	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-79.3	128.1	-178.2	-69	179.1	-64	0	0	111.3	N1443	Q1441-N1443 PolarHBondContact O-N 3.29Å; Q1441-N1443 VanDerWaalsContact O-N 3.09Å
1442	N	26.2	Very low	26.9	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	79%	0.79	S	S	*	*			trans	-74.4	94.3	174.3	-72.6	-15.7	0	0	0	110.7	H1444	N1442-H1444 PolarHBondContact O-N 3.46Å
1443	N	28.3	Very low	26.9	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	79%	0.789	S	S	*	*			trans	-76.7	103	163.9	-76.8	-16.1	0	0	0	109.2	Q1441 L1445	Q1441-N1443 PolarHBondContact O-N 3.29Å; Q1441-N1443 VanDerWaalsContact O-N 3.09Å; N1443-L1445 PolarHBondContact O-N 3.14Å
1444	H	25.7	Very low	27	Very low	156 Å²	156	145.4 Å²	145.4	72%	0.722	78%	0.781	S	S	*	*			trans	-56.5	132.8	166.8	-95.1	-113.5	0	0	0	110.2	N1442 D1446	N1442-H1444 PolarHBondContact O-N 3.46Å; H1444-D1446 IonicContact ND1-OD1 3.87Å
1445	L	28.1	Very low	27.1	Very low	164 Å²	164	141.5 Å²	141.5	86%	0.859	78%	0.775	S	S	*	*			trans	-126.4	89	173.9	-115.1	165	0	0	0	107.4	N1443 L1447	N1443-L1445 PolarHBondContact O-N 3.14Å; L1445-L1447 PolarHBondContact O-N 3.41Å; L1445-L1447 VanDerWaalsContact O-N 3.08Å
1446	D	29.3	Very low	27.3	Very low	129 Å²	129	138.9 Å²	138.9	69%	0.69	77%	0.765	S	S	*	*			trans	-68.7	105.4	-175.1	-62.8	-42.4	0	0	0	110.3	H1444 I1448	H1444-D1446 IonicContact ND1-OD1 3.87Å; D1446-I1448 PolarHBondContact O-N 3.12Å
1447	L	26.6	Very low	27.3	Very low	165 Å²	165	139.6 Å²	139.6	86%	0.864	77%	0.77	S	S	*	*			trans	-79.9	85.9	-176.6	-167.4	72.3	0	0	0	110.7	L1445 T1449	L1445-L1447 PolarHBondContact O-N 3.41Å; L1445-L1447 VanDerWaalsContact O-N 3.08Å; L1447-T1449 PolarHBondContact O-N 2.98Å
1448	I	31	Very low	27.6	Very low	139 Å²	139	139.1 Å²	139.1	71%	0.713	77%	0.767	S	S	*	*			trans	-59.7	116.6	-177.9	-62.6	173.5	0	0	0	111.3	D1446 T1450	D1446-I1448 PolarHBondContact O-N 3.12Å; I1448-T1450 HydrophobicContact CG2-CG2 4.4Å; I1448-T1450 PolarHBondContact O-N 3Å
1449	T	25.3	Very low	27.9	Very low	130 Å²	130	136.7 Å²	136.7	80%	0.798	77%	0.767	S	S	*	*			trans	-85	85.8	179.2	50.2	0	0	0	0	112.4	L1447	L1447-T1449 PolarHBondContact O-N 2.98Å
1450	T	29.8	Very low	27.8	Very low	107 Å²	107	137.4 Å²	137.4	66%	0.656	77%	0.769	S	S	*	*			trans	-135	80.4	167.5	50.6	0	0	0	0	111.7	I1448 T1452	I1448-T1450 HydrophobicContact CG2-CG2 4.4Å; I1448-T1450 PolarHBondContact O-N 3Å; T1450-T1452 VanDerWaalsContact C-N 3.25Å; T1450-T1452 PolarHBondContact O-N 3.05Å
1451	T	29.8	Very low	27.9	Very low	142 Å²	142	137.3 Å²	137.3	87%	0.871	77%	0.769	S	S	*	*			trans	-78.8	69.3	177	-26.8	0	0	0	0	111.2	I1453	T1451-I1453 PolarHBondContact O-N 2.81Å
1452	T	29.8	Very low	28	Very low	112 Å²	112	135.6 Å²	135.6	69%	0.687	77%	0.77	S	S	*	*			trans	-63.6	124	176.6	-53.3	0	0	0	0	110.3	T1450 I1454	T1450-T1452 VanDerWaalsContact C-N 3.25Å; T1450-T1452 PolarHBondContact O-N 3.05Å; T1452-I1454 PolarHBondContact O-N 3.05Å
1453	I	27.6	Very low	28.1	Very low	155 Å²	155	137 Å²	137	80%	0.795	77%	0.772	S	S	*	*			trans	-74.4	99.1	-179.2	-56.8	177.4	0	0	0	109.1	T1451	T1451-I1453 PolarHBondContact O-N 2.81Å
1454	I	29.4	Very low	28	Very low	130 Å²	130	136.8 Å²	136.8	67%	0.667	77%	0.771	S	S	*	*			trans	-93.4	100.4	175.8	-60	179.6	0	0	0	109.3	T1452 T1456	T1452-I1454 PolarHBondContact O-N 3.05Å; I1454-T1456 VanDerWaalsContact C-N 3.3Å; I1454-T1456 HydrophobicContact CG2-CG2 3.91Å; I1454-T1456 PolarHBondContact O-N 3.06Å
1455	T	24.9	Very low	28.3	Very low	121 Å²	121	138.2 Å²	138.2	74%	0.742	78%	0.777	S	S	*	*			trans	-79.9	70.9	176.1	-48.5	0	0	0	0	111	T1457	T1455-T1457 PolarHBondContact O-N 3.16Å; T1455-T1457 VanDerWaalsContact O-N 3.17Å
1456	T	29.8	Very low	28.2	Very low	112 Å²	112	137.2 Å²	137.2	69%	0.687	77%	0.771	S	S	*	*			trans	-73.7	102.9	175.7	30.7	0	0	0	0	112.3	I1454 T1458	I1454-T1456 VanDerWaalsContact C-N 3.3Å; I1454-T1456 HydrophobicContact CG2-CG2 3.91Å; I1454-T1456 PolarHBondContact O-N 3.06Å; T1456-T1458 PolarHBondContact O-N 3.03Å
1457	T	28.4	Very low	28.1	Very low	127 Å²	127	136 Å²	136	78%	0.779	77%	0.773	S	S	*	*			trans	-67.2	106.2	164.2	20.8	0	0	0	0	110.7	T1455 T1459	T1455-T1457 PolarHBondContact O-N 3.16Å; T1455-T1457 VanDerWaalsContact O-N 3.17Å; T1457-T1459 PolarHBondContact O-N 2.82Å
1458	T	29.7	Very low	28.1	Very low	133 Å²	133	133.2 Å²	133.2	82%	0.816	77%	0.767	S	S	*	*			trans	-77.5	88.3	178.6	32.1	0	0	0	0	112.3	T1456 T1460	T1456-T1458 PolarHBondContact O-N 3.03Å; T1458-T1460 PolarHBondContact O-N 3.1Å
1459	T	28.7	Very low	27.9	Very low	125 Å²	125	137.5 Å²	137.5	77%	0.767	77%	0.774	S	S	*	*			trans	-66.5	126.5	165.3	43.2	0	0	0	0	110.9	T1457 T1461	T1457-T1459 PolarHBondContact O-N 2.82Å; T1459-T1461 PolarHBondContact O-N 3.2Å
1460	T	23.9	Very low	28	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	78%	0.775	S	S	*	*			trans	-74.9	113.2	179.3	48.8	0	0	0	0	112	T1458	T1458-T1460 PolarHBondContact O-N 3.1Å
1461	T	29.8	Very low	28.1	Very low	128 Å²	128	141.6 Å²	141.6	79%	0.785	78%	0.782	S	S	*	*			trans	-121.8	112.4	164.8	46.2	0	0	0	0	110.4	T1459	T1459-T1461 PolarHBondContact O-N 3.2Å
1462	T	25.8	Very low	28	Very low	136 Å²	136	143.4 Å²	143.4	83%	0.834	78%	0.781	S	S	*	*			trans	-79.3	117.4	177.1	48.4	0	0	0	0	110.9
1463	H	28.5	Very low	28	Very low	179 Å²	179	148.2 Å²	148.2	83%	0.829	79%	0.788	S	S	*	*			trans	-122.3	109	164.5	-110.5	-64	0	0	0	111.1
1464	N	27.1	Very low	28.2	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	79%	0.787	S	S	*	*			trans	-70.9	134.7	163.1	-66.9	-44.9	0	0	0	108.6
1465	H	30.6	Very low	28	Very low	186 Å²	186	149.8 Å²	149.8	86%	0.861	80%	0.797	S	S	*	*			trans	-144.7	145.7	149.3	-116.1	-83	0	0	0	110.1
1466	I	26.8	Very low	28.4	Very low	142 Å²	142	153.2 Å²	153.2	73%	0.728	80%	0.804	S	S	*	*			trans	-116.4	137.6	-161.7	-72.5	172.2	0	0	0	110.8
1467	S	26.4	Very low	28.6	Very low	103 Å²	103	161 Å²	161	72%	0.72	83%	0.83	S	S	*	*			trans	73.8	135.7	155.2	76.7	0	0	0	0	122.3
1468	S	26.6	Very low	28.6	Very low	107 Å²	107	162.8 Å²	162.8	75%	0.748	83%	0.832	S	S	*	*				121.7	152.9	119.8	78.9	0	0	0	0	117
1469	R	27.6	Very low	28.6	Very low	229 Å²	229	164.3 Å²	164.3	86%	0.864	83%	0.833	S	S	*	*			trans	65.7	88.5	172	-67.9	-172.8	169.4	179.6	-2.9	118.3
1470	N	27.7	Very low	28.5	Very low	153 Å²	153	166.5 Å²	166.5	82%	0.818	84%	0.837	S	S	*	*				6.6	123.3	116.5	-52.6	-0.8	0	0	0	115.9
1471	Q	31.4	Very low	28.8	Very low	170 Å²	170	168.1 Å²	168.1	79%	0.794	84%	0.835	S	S	*	*			trans	-124.4	133.9	140	-73.9	-169.7	-13.9	0	0	108.4
1472	Q	26.8	Very low	28.8	Very low	181 Å²	181	170.6 Å²	170.6	85%	0.846	84%	0.838	S	S	*	*			trans	-86.5	132.7	177.6	-64.2	155.4	-88.8	0	0	108.5
1473	Y	31.3	Very low	29	Very low	213 Å²	213	172.9 Å²	172.9	84%	0.835	84%	0.839	S	S	*	*			trans	-104.8	119.5	153.8	-79.3	-84.1	0	0	0	107.4
1474	A	31.8	Very low	29	Very low	95 Å²	95	172.4 Å²	172.4	79%	0.785	84%	0.839	S	S	*	*			trans	-88.9	163.7	-172.7	0	0	0	0	0	111.6
1475	Y	25.4	Very low	29.1	Very low	222 Å²	222	174.7 Å²	174.7	87%	0.871	85%	0.845	S	S	*	*			trans	-65.2	148.8	179.4	-68.1	-99.3	0	0	0	112.7
1476	Q	32.3	Very low	29	Very low	193 Å²	193	173.8 Å²	173.8	90%	0.902	84%	0.844	S	S	*	*			trans	-124	147.2	141.3	-157.1	160.6	2.1	0	0	107
1477	F	34	Very low	29.2	Very low	277 Å²	277	176.6 Å²	176.6	100%	1.215	85%	0.854	S	S	*	*			trans	-75.8	0	-164	-83.5	-96.3	0	0	0	114.2

Retrieved 1,477 of 1,477 residues in 1486.3 ms (Link to these results)

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