A0A077Z639_TRITR Loading...

Notch and Ank 2 and EGF and NOD domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z639, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,345 aa.

						>A0A077Z639_TRITR|A0A077Z639
METILLRCPPGVVGQYCEEVVSPCHLNPCHNGGICAYAGFDDGRLEVTCLCPAGTSGNNCEINNDDCYTGACYHNGTCVDRVDSFDCICPPGFGGERCEVQTNECPSSPCSSEGTVKCIQMDNNFSCVCRAGYTGYRCDVLLDFCSQKPCSNNGTCVGFLRVCICQQGYKGEFCDEKIPEACVSKPCLNEGECLPGRSPFELYFCDCLAGTFGKNCGFKHLTNCLVNGCFNGGTCESRKGAFVCHCPPHFTGAQCQLRDTSFIEDAKIRSDINTVALGSNLLNDSHKKYICFINKCHIKANNGFCNPECNSYLCGFDGIDCAGDLQPFRQCYKREYCANVFRNELCDPQCNTEDCLFDGFDCLKIENEYIHNSEKYCEVYAGDGSCNEECNMTTYNFDSGDCLTDEQRFSGQLTGRIVAIVAVSSAEFKVDLGRFLIVLGNLLQAIIRVDTDKQGRKMIYQWNSKFGSVVGKYSIARLKMRTVETPSIKFPSAKFPHSTLVVLTVHKIPYNNASSFTNSSRVTDFLSVDSVKRIIKRQLGYEIQSVGTDHGNEGGGKGTMLLTITVLFICTMCITHCIILVPTNRRVRIARWVPPAELEMTERAGTSHTTTLSEPAEIQRSEILVPALISPENKSEKDHDENEKVVEISNKLLMAWLKWNYTADSHCCDLSCEEEREDEFQNTVAILPKEDLNCFLIKSANDSFSNPETQCRIIDELISSGADVNNRHGLHMSTPLITAVKNKQIAAIELLLRRGADPNLKDLGGRTALHHAVSVDCSGIVELLLNSGRCLLEEKDLDGCTAALLAAKRGKECFPIFCLLVDCDANLTTEDGEGKQEANGNAISARSCTHWAAQNNDLLILNLLWLRDALCHSQDSLGRNALFLAASKNCVQAVEFLDARGFDREARDFLNCTPLFVAKNNGYNAVTKLLKARQPKAIQLDENSRWMVMEKLAKEWKKELGMNKKETWMVDHSQTVKIANSTSSGLRGQENVIDAMGSHKIASPEVLPDTQLFQHAEMSNLQCGIFVDTSLHDFEKQFSHSSVSKFPDWVQRSDYMPDLPFIFQDKFQSQLWKLGSVGESSRIVSESNPRPDNINLFPDLNSEYASNYSEVYKPDERILSFPDFLGAHNDQFNRQISDVSQIGALQLLIPTNSSDVLALDVPCSFEKASIFHRLESGSESSDSTLANLASYFSSMRDSNSTVSENKATCFTENSAKQNEEKYLGICPRDAEDLYELSITNAADDCTILVSEEQATDITYGDSMEKPTEKTCLDNSQMATDFFGVSSAAMNLDLGGPSVAYSSPSFVPVSNVLRSTLGTEKMRQGRYIKKAWPKNTRYPTSSNRKQ
					

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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	36	Very low	57.1	Low	239 Å²	239	142.5 Å²	142.5	100%	1.177	76%	0.757	S	S	*	*				0	136.5	0	-68.1	172.6	179.3	0	0	106.4
2	E	39.1	Very low	58.3	Low	201 Å²	201	133.7 Å²	133.7	94%	0.939	71%	0.713	S	S	*	*			trans	-82.1	138.8	177.4	-63.7	167.8	133.8	0	0	109
3	T	42	Very low	59.2	Low	132 Å²	132	128.8 Å²	128.8	81%	0.81	69%	0.69	S	S	*	*			trans	-129.3	132.8	179.5	-46.8	0	0	0	0	108.9
4	I	55.1	Low	59.7	Low	159 Å²	159	122.1 Å²	122.1	82%	0.815	67%	0.667	S	S	*	*			trans	-76	140.5	-170	-61.8	164.1	0	0	0	110.6
5	L	51.2	Low	60.3	Low	164 Å²	164	124.1 Å²	124.1	86%	0.859	67%	0.67	S	S	*	*			trans	-109.2	119.4	-177.9	-154.1	156.4	0	0	0	109.3
6	L	61.1	Low	61.5	Low	120 Å²	120	127.2 Å²	127.2	63%	0.628	67%	0.671	S	S	*	*			trans	-79.1	162.3	-179.4	-120.6	76.7	0	0	0	112
7	R	71.2	Confident	62.3	Low	245 Å²	245	121.4 Å²	121.4	93%	0.925	64%	0.643	S	S	*	*			trans	-127.7	118.2	178.3	-155.7	179.3	-164.4	-168.7	4.3	110.5
8	C	72.4	Confident	63.2	Low	45 Å²	45	120.6 Å²	120.6	30%	0.304	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-83.7	154.7	-171.4	-61	0	0	0	0	114.1	V12 C17	C8-V12 HydrophobicContact CB-CG2 4.35Å; C8-V12 WeakPolarHBondContact CB-O 3.46Å; C8-C17 WeakPolarHBondContact CA-SG 3.38Å; C8-C17 HydrophobicContact CB-CB 3.71Å; C8-C17 WeakPolarHBondContact CB-SG 3.4Å; C8-C17 WeakPolarHBondContact SG-CA 3.33Å; C8-C17 WeakPolarHBondContact SG-CB 3.4Å; C8-C17 CovalentContact SG-SG 2.04Å; C8-C17 PolarHBondContact SG-SG 2.94Å
9	P	73.1	Confident	63.2	Low	81 Å²	81	120.6 Å²	120.6	53%	0.526	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-61.5	157.8	167.5	-22	33	0	0	0	113.3	G11 V12	P9-G11 PolarHBondContact O-N 3.26Å; P9-V12 HydrophobicContact CB-CG2 4.06Å; P9-V12 HydrophobicContact CG-CG2 4.17Å; P9-V12 WeakPolarHBondContact O-CG2 3.31Å; P9-V12 PolarHBondContact O-N 3.3Å
10	P	64.7	Low	63.1	Low	137 Å²	137	120.7 Å²	120.7	89%	0.89	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	137.3	171.6	-21.6	33.5	0	0	0	111.8
11	G	61.9	Low	63.1	Low	44 Å²	44	117.4 Å²	117.4	45%	0.454	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	89.4	-6.7	-179.6	0	0	0	0	0	115.5	P9 V21	P9-G11 PolarHBondContact O-N 3.26Å; G11-V21 PolarHBondContact O-N 3.32Å
12	V	72.4	Confident	64.4	Low	37 Å²	37	109.2 Å²	109.2	22%	0.224	59%	0.587	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.9	142.9	172.9	-69.5	0	0	0	0	113.3	C8 P9 C17 E19 V20	C8-V12 HydrophobicContact CB-CG2 4.35Å; C8-V12 WeakPolarHBondContact CB-O 3.46Å; P9-V12 HydrophobicContact CB-CG2 4.06Å; P9-V12 HydrophobicContact CG-CG2 4.17Å; P9-V12 WeakPolarHBondContact O-CG2 3.31Å; P9-V12 PolarHBondContact O-N 3.3Å; V12-C17 HydrophobicContact CG2-CB 4.11Å; V12-E19 CarbonylContact C-O 3.54Å; V12-E19 WeakPolarHBondContact CA-O 3.07Å; V12-V20 HydrophobicContact CG1-CG2 4.12Å
13	V	69.8	Low	65.6	Low	70 Å²	70	101 Å²	101	42%	0.424	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.5	-172	179.2	-62.1	0	0	0	0	110.4	C17 E18 E19 V21	V13-C17 CarbonylContact O-C 3.55Å; V13-C17 VanDerWaalsContact O-C 3.26Å; V13-C17 VanDerWaalsContact O-CA 3.29Å; V13-C17 WeakPolarHBondContact O-CA 3.27Å; V13-E18 PolarHBondContact O-N 2.87Å; V13-E19 HydrophobicContact CG2-CB 3.79Å; V13-E19 PolarHBondContact N-O 3.23Å; V13-E19 PolarHBondContact O-N 3.42Å; V13-V21 HydrophobicContact CB-CG2 4.45Å; V13-V21 HydrophobicContact CG1-CG2 3.83Å; V13-V21 HydrophobicContact CG2-CG2 3.85Å
14	G	66.2	Low	67.2	Low	35 Å²	35	96.1 Å²	96.1	36%	0.361	52%	0.522	S	S	.	.	S	Bend	trans	98.2	175.7	-173.2	0	0	0	0	0	113.6	Y16 E18	G14-Y16 VanDerWaalsContact C-N 3.3Å; G14-Y16 PolarHBondContact O-N 3.33Å; G14-E18 WeakPolarHBondContact CA-OE2 3.03Å
15	Q	68.9	Low	68.1	Low	152 Å²	152	95.5 Å²	95.5	71%	0.71	52%	0.516	S	S	*	.	S	Bend	trans	-75.7	-21.1	-174.5	-174.5	169.8	3	0	0	112.9	E18	Q15-E18 PolarHBondContact N-OE2 2.88Å
16	Y	78.4	Confident	69.1	Low	174 Å²	174	94.9 Å²	94.9	68%	0.682	51%	0.512	S	S	*	.	S	Bend	trans	-123.2	11.9	179.9	-57.8	-80.4	0	0	0	112.5	G14 E18	G14-Y16 VanDerWaalsContact C-N 3.3Å; G14-Y16 PolarHBondContact O-N 3.33Å; Y16-E18 VanDerWaalsContact C-OE2 3.28Å; Y16-E18 WeakPolarHBondContact CA-OE2 3.46Å; Y16-E18 WeakPolarHBondContact CD2-OE1 3.1Å; Y16-E18 PolarHBondContact N-OE2 3.46Å
17	C	76.6	Confident	69.7	Low	29 Å²	29	95.3 Å²	95.3	20%	0.196	52%	0.515	C	S	.	.	S	Bend	trans	64.1	39	-175.3	-45.8	0	0	0	0	113.5	C8 V12 V13	C8-C17 WeakPolarHBondContact CA-SG 3.38Å; C8-C17 HydrophobicContact CB-CB 3.71Å; C8-C17 WeakPolarHBondContact CB-SG 3.4Å; C8-C17 WeakPolarHBondContact SG-CA 3.33Å; C8-C17 WeakPolarHBondContact SG-CB 3.4Å; C8-C17 CovalentContact SG-SG 2.04Å; C8-C17 PolarHBondContact SG-SG 2.94Å; V12-C17 HydrophobicContact CG2-CB 4.11Å; V13-C17 CarbonylContact O-C 3.55Å; V13-C17 VanDerWaalsContact O-C 3.26Å; V13-C17 VanDerWaalsContact O-CA 3.29Å; V13-C17 WeakPolarHBondContact O-CA 3.27Å
18	E	77.1	Confident	70.3	Confident	107 Å²	107	85.2 Å²	85.2	50%	0.5	48%	0.481	S	S	.	.			trans	-95.2	-17.7	-170.5	67.9	-86.3	-128.4	0	0	115.1	V13 G14 Q15 Y16	V13-E18 PolarHBondContact O-N 2.87Å; G14-E18 WeakPolarHBondContact CA-OE2 3.03Å; Q15-E18 PolarHBondContact N-OE2 2.88Å; Y16-E18 VanDerWaalsContact C-OE2 3.28Å; Y16-E18 WeakPolarHBondContact CA-OE2 3.46Å; Y16-E18 WeakPolarHBondContact CD2-OE1 3.1Å; Y16-E18 PolarHBondContact N-OE2 3.46Å
19	E	63.2	Low	71	Confident	120 Å²	120	84 Å²	84	56%	0.561	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.6	-175.9	-60.9	-176.4	147.9	0	0	111.3	V12 V13	V12-E19 CarbonylContact C-O 3.54Å; V12-E19 WeakPolarHBondContact CA-O 3.07Å; V13-E19 HydrophobicContact CG2-CB 3.79Å; V13-E19 PolarHBondContact N-O 3.23Å; V13-E19 PolarHBondContact O-N 3.42Å
20	V	62.4	Low	71.7	Confident	123 Å²	123	84.8 Å²	84.8	75%	0.745	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	126.3	175.9	-179	0	0	0	0	110.5	V12 S22	V12-V20 HydrophobicContact CG1-CG2 4.12Å; V20-S22 PolarHBondContact O-N 2.74Å
21	V	62	Low	72.6	Confident	51 Å²	51	81.3 Å²	81.3	31%	0.309	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-80.5	119	178.6	-175.9	0	0	0	0	110.1	G11 V13 H25	G11-V21 PolarHBondContact O-N 3.32Å; V13-V21 HydrophobicContact CB-CG2 4.45Å; V13-V21 HydrophobicContact CG1-CG2 3.83Å; V13-V21 HydrophobicContact CG2-CG2 3.85Å; V21-H25 HydrophobicContact CG1-CB 3.91Å
22	S	63.5	Low	73.5	Confident	67 Å²	67	82.4 Å²	82.4	47%	0.469	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-60.9	139	174.5	175	0	0	0	0	111.5	V20 C24 H25	V20-S22 PolarHBondContact O-N 2.74Å; S22-C24 PolarHBondContact O-N 2.88Å; S22-C24 PolarHBondContact OG-N 3.34Å; S22-H25 WeakPolarHBondContact O-CB 3.42Å; S22-H25 PolarHBondContact O-N 3.25Å
23	P	64.7	Low	74	Confident	30 Å²	30	81.3 Å²	81.3	20%	0.195	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-62	-28	176.5	27.4	-35.5	0	0	0	112.4	H25 L26 Y37 L45 V47	P23-H25 PolarHBondContact O-N 3.17Å; P23-L26 PolarHBondContact O-N 2.86Å; P23-Y37 HydrophobicContact CG-CD2 4.13Å; P23-L45 HydrophobicContact CB-CB 4.33Å; P23-L45 HydrophobicContact CB-CD2 4.01Å; P23-L45 HydrophobicContact CG-CB 4.49Å; P23-L45 HydrophobicContact CG-CD2 3.72Å; P23-V47 HydrophobicContact CB-CG2 3.81Å; P23-V47 HydrophobicContact CG-CG2 4.12Å
24	C	75.9	Confident	74.8	Confident	28 Å²	28	83.5 Å²	83.5	19%	0.189	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-67.4	-12.1	174.8	-64.2	0	0	0	0	113.7	S22 L26 N27 C35	S22-C24 PolarHBondContact O-N 2.88Å; S22-C24 PolarHBondContact OG-N 3.34Å; C24-L26 PolarHBondContact O-N 2.78Å; C24-L26 VanDerWaalsContact O-N 3.13Å; C24-N27 PolarHBondContact O-N 3.14Å; C24-N27 PolarHBondContact O-OD1 2.92Å; C24-C35 WeakPolarHBondContact CA-SG 3.23Å; C24-C35 HydrophobicContact CB-CB 3.72Å; C24-C35 WeakPolarHBondContact CB-SG 3.3Å; C24-C35 WeakPolarHBondContact SG-CB 3.38Å; C24-C35 CovalentContact SG-SG 2.04Å; C24-C35 PolarHBondContact SG-SG 3.28Å
25	H	72.6	Confident	75.6	Confident	146 Å²	146	83.4 Å²	83.4	68%	0.676	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-64.8	-11.2	173.5	-169.4	-83.7	0	0	0	113.2	V21 S22 P23	V21-H25 HydrophobicContact CG1-CB 3.91Å; S22-H25 WeakPolarHBondContact O-CB 3.42Å; S22-H25 PolarHBondContact O-N 3.25Å; P23-H25 PolarHBondContact O-N 3.17Å
26	L	72.5	Confident	76.1	Confident	151 Å²	151	77.9 Å²	77.9	79%	0.791	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-89.2	0.3	171.2	-66.6	173.7	0	0	0	113.6	P23 C24	P23-L26 PolarHBondContact O-N 2.86Å; C24-L26 PolarHBondContact O-N 2.78Å; C24-L26 VanDerWaalsContact O-N 3.13Å
27	N	75.2	Confident	75.8	Confident	130 Å²	130	75.6 Å²	75.6	70%	0.695	42%	0.424	S	S	*	.			trans	43.7	58.2	-174.6	-64.3	-19.6	0	0	0	113.4	C24 C29	C24-N27 PolarHBondContact O-N 3.14Å; C24-N27 PolarHBondContact O-OD1 2.92Å; N27-C29 PolarHBondContact O-N 3.1Å; N27-C29 VanDerWaalsContact O-N 3.16Å
28	P	83.2	Confident	75.4	Confident	32 Å²	32	76.6 Å²	76.6	21%	0.208	44%	0.435	C	S	.	.			trans	-70.2	-9.1	-175.1	29.5	-35.2	0	0	0	114.3	V47 N59	P28-V47 HydrophobicContact CG-CG1 3.84Å; P28-N59 VanDerWaalsContact O-CB 3.31Å; P28-N59 WeakPolarHBondContact O-CB 3.25Å; P28-N59 VanDerWaalsContact O-CG 3.31Å; P28-N59 PolarHBondContact O-ND2 3.35Å
29	C	87.8	Confident	74.8	Confident	20 Å²	20	72.3 Å²	72.3	14%	0.135	42%	0.419	C	S	.	.			trans	-99.9	130.5	-179.9	-48.8	0	0	0	0	111	N27 G33 C35 C49 N59	N27-C29 PolarHBondContact O-N 3.1Å; N27-C29 VanDerWaalsContact O-N 3.16Å; C29-G33 WeakPolarHBondContact CB-O 3.15Å; C29-C35 WeakPolarHBondContact SG-CA 3.37Å; C29-C35 VanDerWaalsContact SG-CB 3.59Å; C29-C49 WeakPolarHBondContact CA-SG 3.32Å; C29-C49 HydrophobicContact CB-CB 3.76Å; C29-C49 WeakPolarHBondContact CB-SG 3.42Å; C29-C49 VanDerWaalsContact SG-CA 3.6Å; C29-C49 WeakPolarHBondContact SG-CB 3.41Å; C29-C49 CovalentContact SG-SG 2.03Å; C29-C49 PolarHBondContact SG-SG 3.37Å; C29-N59 CarbonylContact C-O 3.49Å; C29-N59 WeakPolarHBondContact CA-O 3.47Å
30	H	87.1	Confident	74.8	Confident	98 Å²	98	72.8 Å²	72.8	45%	0.454	42%	0.42	S	S	.	.			trans	-93.1	173.9	177.7	-61.1	-77	0	0	0	111.4	G32 G33 N59	H30-G32 PolarHBondContact O-N 2.8Å; H30-G33 PolarHBondContact O-N 2.04Å; H30-N59 PolarHBondContact N-O 3.49Å
31	N	83.3	Confident	74.4	Confident	64 Å²	64	72.7 Å²	72.7	34%	0.342	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	31.9	168.8	-54.5	-21.8	0	0	0	115.9	P52 T55 C60 V82	N31-P52 WeakPolarHBondContact O-CG 3.46Å; N31-T55 HydrophobicContact CB-CG2 3.65Å; N31-C60 PolarHBondContact ND2-O 2.97Å; N31-V82 HydrophobicContact CB-CG2 4.17Å
32	G	79.8	Confident	74.1	Confident	67 Å²	67	78.2 Å²	78.2	69%	0.691	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	5.3	-179	0	0	0	0	0	115.6	H30	H30-G32 PolarHBondContact O-N 2.8Å
33	G	84.5	Confident	73.7	Confident	13 Å²	13	78.2 Å²	78.2	13%	0.134	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-57.2	136.7	177.6	0	0	0	0	0	113.9	C29 H30 L50	C29-G33 WeakPolarHBondContact CB-O 3.15Å; H30-G33 PolarHBondContact O-N 2.04Å; G33-L50 CarbonylContact C-O 3.18Å; G33-L50 WeakPolarHBondContact CA-O 3.43Å
34	I	85.2	Confident	73.5	Confident	116 Å²	116	86.5 Å²	86.5	60%	0.595	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	117.8	-177.8	-56.7	173.7	0	0	0	109.3	A36 L50	I34-A36 PolarHBondContact O-N 2.94Å; I34-L50 HydrophobicContact CB-CB 4.29Å; I34-L50 PolarHBondContact N-O 2.64Å; I34-L50 PolarHBondContact O-N 3.29Å
35	C	84.8	Confident	72.8	Confident	34 Å²	34	89 Å²	89	23%	0.23	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.8	178	-176.8	0	0	0	0	112	C24 C29 V47	C24-C35 WeakPolarHBondContact CA-SG 3.23Å; C24-C35 HydrophobicContact CB-CB 3.72Å; C24-C35 WeakPolarHBondContact CB-SG 3.3Å; C24-C35 WeakPolarHBondContact SG-CB 3.38Å; C24-C35 CovalentContact SG-SG 2.04Å; C24-C35 PolarHBondContact SG-SG 3.28Å; C29-C35 WeakPolarHBondContact SG-CA 3.37Å; C29-C35 VanDerWaalsContact SG-CB 3.59Å; C35-V47 WeakPolarHBondContact SG-CG1 3.38Å
36	A	79.3	Confident	72.6	Confident	36 Å²	36	87.3 Å²	87.3	30%	0.298	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.9	172.8	0	0	0	0	0	110.9	I34 V47 T48	I34-A36 PolarHBondContact O-N 2.94Å; A36-V47 WeakPolarHBondContact O-CA 3.29Å; A36-T48 PolarHBondContact N-O 3.09Å; A36-T48 PolarHBondContact O-N 3.41Å
37	Y	71.9	Confident	72.7	Confident	125 Å²	125	82.3 Å²	82.3	49%	0.49	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	119.2	170.6	170.5	-104.3	0	0	0	109.3	P23 G39 F40 L45	P23-Y37 HydrophobicContact CG-CD2 4.13Å; Y37-G39 WeakPolarHBondContact CE2-O 3.26Å; Y37-G39 VanDerWaalsContact OH-C 3.31Å; Y37-G39 PolarHBondContact OH-O 3.43Å; Y37-F40 WeakPolarHBondContact OH-CB 3.45Å; Y37-F40 WeakPolarHBondContact OH-CD2 3.38Å; Y37-F40 PolarHBondContact OH-N 3.33Å; Y37-L45 HydrophobicContact CD2-CD2 4.49Å; Y37-L45 HydrophobicContact CE2-CB 4.39Å; Y37-L45 HydrophobicContact CE2-CD2 4.06Å; Y37-L45 HydrophobicContact CE2-CG 4.3Å
38	A	67.2	Low	73.2	Confident	51 Å²	51	79.3 Å²	79.3	42%	0.421	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-37	-174.1	0	0	0	0	0	112.5	E46 T48	A38-E46 HydrophobicContact CB-CB 4.13Å; A38-E46 HydrophobicContact CB-CG 3.97Å; A38-E46 PolarHBondContact N-O 2.88Å; A38-T48 WeakPolarHBondContact CB-OG1 3.25Å
39	G	65.5	Low	73.4	Confident	17 Å²	17	78.3 Å²	78.3	18%	0.175	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-176.9	-178.5	0	0	0	0	0	114.5	Y37 E46	Y37-G39 WeakPolarHBondContact CE2-O 3.26Å; Y37-G39 VanDerWaalsContact OH-C 3.31Å; Y37-G39 PolarHBondContact OH-O 3.43Å; G39-E46 PolarHBondContact O-N 3.17Å
40	F	61.8	Low	73.4	Confident	130 Å²	130	82.5 Å²	82.5	57%	0.57	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	105	170	-134.2	-59.1	0	0	0	105.9	Y37 R44 L45	Y37-F40 WeakPolarHBondContact OH-CB 3.45Å; Y37-F40 WeakPolarHBondContact OH-CD2 3.38Å; Y37-F40 PolarHBondContact OH-N 3.33Å; F40-R44 WeakPolarHBondContact CA-O 3.46Å; F40-R44 WeakPolarHBondContact CD1-O 3.49Å; F40-L45 HydrophobicContact CD2-CD1 4.45Å; F40-L45 HydrophobicContact CD2-CG 3.99Å; F40-L45 HydrophobicContact CE1-CD1 3.94Å; F40-L45 HydrophobicContact CE1-CG 4.32Å; F40-L45 HydrophobicContact CE2-CD1 3.65Å; F40-L45 HydrophobicContact CE2-CD2 4.18Å; F40-L45 HydrophobicContact CE2-CG 3.62Å; F40-L45 HydrophobicContact CG-CG 4.5Å; F40-L45 HydrophobicContact CZ-CD1 3.36Å; F40-L45 HydrophobicContact CZ-CG 3.82Å
41	D	55.2	Low	73.4	Confident	120 Å²	120	80.2 Å²	80.2	64%	0.642	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.8	-176.8	-152	-3.8	0	0	0	111.2	G43 R44	D41-G43 PolarHBondContact O-N 2.97Å; D41-R44 PolarHBondContact N-O 2.98Å; D41-R44 PolarHBondContact O-N 3.39Å
42	D	56.1	Low	73.4	Confident	167 Å²	167	79.6 Å²	79.6	89%	0.893	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.5	38	-171.6	-145.8	22.6	0	0	0	115.8
43	G	54.6	Low	73.6	Confident	68 Å²	68	79.2 Å²	79.2	70%	0.701	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	8.5	178.3	0	0	0	0	0	116.2	D41	D41-G43 PolarHBondContact O-N 2.97Å
44	R	59.5	Low	73.4	Confident	204 Å²	204	79.1 Å²	79.1	77%	0.77	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	149.6	169.5	-71.6	178.7	169.1	178.7	-3.8	110.8	F40 D41	F40-R44 WeakPolarHBondContact CA-O 3.46Å; F40-R44 WeakPolarHBondContact CD1-O 3.49Å; D41-R44 PolarHBondContact N-O 2.98Å; D41-R44 PolarHBondContact O-N 3.39Å
45	L	62.6	Low	73.6	Confident	81 Å²	81	74.2 Å²	74.2	42%	0.424	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	128.2	164.5	-71.3	86.2	0	0	0	108.2	P23 Y37 F40	P23-L45 HydrophobicContact CB-CB 4.33Å; P23-L45 HydrophobicContact CB-CD2 4.01Å; P23-L45 HydrophobicContact CG-CB 4.49Å; P23-L45 HydrophobicContact CG-CD2 3.72Å; Y37-L45 HydrophobicContact CD2-CD2 4.49Å; Y37-L45 HydrophobicContact CE2-CB 4.39Å; Y37-L45 HydrophobicContact CE2-CD2 4.06Å; Y37-L45 HydrophobicContact CE2-CG 4.3Å; F40-L45 HydrophobicContact CD2-CD1 4.45Å; F40-L45 HydrophobicContact CD2-CG 3.99Å; F40-L45 HydrophobicContact CE1-CD1 3.94Å; F40-L45 HydrophobicContact CE1-CG 4.32Å; F40-L45 HydrophobicContact CE2-CD1 3.65Å; F40-L45 HydrophobicContact CE2-CD2 4.18Å; F40-L45 HydrophobicContact CE2-CG 3.62Å; F40-L45 HydrophobicContact CG-CG 4.5Å; F40-L45 HydrophobicContact CZ-CD1 3.36Å; F40-L45 HydrophobicContact CZ-CG 3.82Å
46	E	68.6	Low	73.6	Confident	109 Å²	109	74.6 Å²	74.6	51%	0.509	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.8	174.8	-165.5	176.9	-148.5	0	0	110.3	A38 G39	A38-E46 HydrophobicContact CB-CB 4.13Å; A38-E46 HydrophobicContact CB-CG 3.97Å; A38-E46 PolarHBondContact N-O 2.88Å; G39-E46 PolarHBondContact O-N 3.17Å
47	V	74.5	Confident	74	Confident	47 Å²	47	74.3 Å²	74.3	29%	0.285	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.6	-176.4	-179.1	0	0	0	0	108.5	P23 P28 C35 A36	P23-V47 HydrophobicContact CB-CG2 3.81Å; P23-V47 HydrophobicContact CG-CG2 4.12Å; P28-V47 HydrophobicContact CG-CG1 3.84Å; C35-V47 WeakPolarHBondContact SG-CG1 3.38Å; A36-V47 WeakPolarHBondContact O-CA 3.29Å
48	T	84	Confident	74.6	Confident	66 Å²	66	75 Å²	75	41%	0.405	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.2	173.2	-57.9	0	0	0	0	109	A36 A38	A36-T48 PolarHBondContact N-O 3.09Å; A36-T48 PolarHBondContact O-N 3.41Å; A38-T48 WeakPolarHBondContact CB-OG1 3.25Å
49	C	87.4	Confident	75.5	Confident	11 Å²	11	75.6 Å²	75.6	7%	0.074	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.8	174.1	-62.5	0	0	0	0	110.3	C29 C60	C29-C49 WeakPolarHBondContact CA-SG 3.32Å; C29-C49 HydrophobicContact CB-CB 3.76Å; C29-C49 WeakPolarHBondContact CB-SG 3.42Å; C29-C49 VanDerWaalsContact SG-CA 3.6Å; C29-C49 WeakPolarHBondContact SG-CB 3.41Å; C29-C49 CovalentContact SG-SG 2.03Å; C29-C49 PolarHBondContact SG-SG 3.37Å; C49-C60 VanDerWaalsContact CB-SG 3.55Å
50	L	88.8	Confident	76.6	Confident	108 Å²	108	74.8 Å²	74.8	57%	0.565	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.2	169.5	-62.4	173.4	0	0	0	108.3	G33 I34	G33-L50 CarbonylContact C-O 3.18Å; G33-L50 WeakPolarHBondContact CA-O 3.43Å; I34-L50 HydrophobicContact CB-CB 4.29Å; I34-L50 PolarHBondContact N-O 2.64Å; I34-L50 PolarHBondContact O-N 3.29Å
51	C	87.9	Confident	77.9	Confident	51 Å²	51	73 Å²	73	35%	0.345	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-88.2	134.9	-170.3	-55.7	0	0	0	0	112.1	T55 C60	C51-T55 WeakPolarHBondContact CB-OG1 3.38Å; C51-C60 WeakPolarHBondContact CA-SG 3.45Å; C51-C60 HydrophobicContact CB-CB 3.77Å; C51-C60 WeakPolarHBondContact CB-SG 3.04Å; C51-C60 WeakPolarHBondContact SG-CA 3.28Å; C51-C60 WeakPolarHBondContact SG-CB 3.13Å; C51-C60 CovalentContact SG-SG 2.04Å; C51-C60 PolarHBondContact SG-SG 2.87Å
52	P	81.8	Confident	79.4	Confident	50 Å²	50	71.2 Å²	71.2	33%	0.325	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-67	170.9	171	29.3	-35.3	0	0	0	111.6	N31 T55	N31-P52 WeakPolarHBondContact O-CG 3.46Å; P52-T55 VanDerWaalsContact CD-OG1 3.24Å; P52-T55 WeakPolarHBondContact CD-OG1 3.35Å; P52-T55 HydrophobicContact CG-CG2 4.01Å; P52-T55 PolarHBondContact O-N 2.86Å; P52-T55 PolarHBondContact O-OG1 3.04Å
53	A	83.6	Confident	80.7	Confident	60 Å²	60	65.1 Å²	65.1	50%	0.496	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	159.8	167	0	0	0	0	0	111.1	T55 D83	A53-T55 PolarHBondContact O-N 2.97Å; A53-T55 VanDerWaalsContact O-N 3.1Å; A53-D83 HydrophobicContact CB-CB 4.42Å; A53-D83 VanDerWaalsContact CB-CG 3.47Å; A53-D83 WeakPolarHBondContact CB-OD1 2.95Å; A53-D83 WeakPolarHBondContact CB-OD2 3.46Å
54	G	81.8	Confident	82.3	Confident	10 Å²	10	65.1 Å²	65.1	10%	0.103	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	-14.3	-166.7	0	0	0	0	0	116.3	N63 N64 D83	G54-N63 PolarHBondContact O-OD1 2.97Å; G54-N64 VanDerWaalsContact O-CB 3.29Å; G54-N64 WeakPolarHBondContact O-CB 3.38Å; G54-N64 PolarHBondContact O-N 2.67Å; G54-N64 PolarHBondContact O-ND2 2.72Å; G54-N64 VanDerWaalsContact O-ND2 3.15Å; G54-D83 PolarHBondContact N-OD1 3.46Å; G54-D83 VanDerWaalsContact N-OD1 3.16Å
55	T	87.8	Confident	83.5	Confident	14 Å²	14	61.2 Å²	61.2	9%	0.086	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	157.5	-169.8	70.6	0	0	0	0	115.3	N31 C51 P52 A53 I62 V82	N31-T55 HydrophobicContact CB-CG2 3.65Å; C51-T55 WeakPolarHBondContact CB-OG1 3.38Å; P52-T55 VanDerWaalsContact CD-OG1 3.24Å; P52-T55 WeakPolarHBondContact CD-OG1 3.35Å; P52-T55 HydrophobicContact CG-CG2 4.01Å; P52-T55 PolarHBondContact O-N 2.86Å; P52-T55 PolarHBondContact O-OG1 3.04Å; A53-T55 PolarHBondContact O-N 2.97Å; A53-T55 VanDerWaalsContact O-N 3.1Å; T55-I62 CarbonylContact C-O 3.49Å; T55-I62 VanDerWaalsContact CA-O 3.32Å; T55-I62 WeakPolarHBondContact CA-O 3.39Å; T55-I62 WeakPolarHBondContact CB-O 3.34Å; T55-V82 HydrophobicContact CG2-CG1 3.69Å; T55-V82 HydrophobicContact CG2-CG2 4.46Å
56	S	86.6	Confident	84.6	Confident	42 Å²	42	59.8 Å²	59.8	29%	0.294	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	179.2	176	64	0	0	0	0	112.7	C60 E61 I62 N64	S56-C60 CarbonylContact O-C 3.41Å; S56-C60 VanDerWaalsContact O-C 3.24Å; S56-C60 VanDerWaalsContact O-CA 3.27Å; S56-C60 WeakPolarHBondContact O-CA 3.43Å; S56-E61 PolarHBondContact O-N 3.4Å; S56-I62 PolarHBondContact N-O 3.34Å; S56-I62 WeakPolarHBondContact O-CB 3.44Å; S56-I62 PolarHBondContact O-N 2.87Å; S56-I62 WeakPolarHBondContact OG-CB 3.08Å; S56-I62 WeakPolarHBondContact OG-CG2 3.34Å; S56-N64 PolarHBondContact OG-OD1 2.81Å
57	G	86.3	Confident	85.5	Confident	29 Å²	29	56.5 Å²	56.5	30%	0.299	33%	0.333	S	S	.	.	S	Bend	trans	99.8	169	-173.4	0	0	0	0	0	113.5	N59 C60 E61	G57-N59 VanDerWaalsContact C-N 3.33Å; G57-C60 PolarHBondContact O-N 3.48Å; G57-E61 VanDerWaalsContact C-OE2 3.27Å; G57-E61 WeakPolarHBondContact CA-OE1 3.32Å; G57-E61 WeakPolarHBondContact CA-OE2 3.46Å
58	N	84.9	Confident	86.1	Confident	139 Å²	139	60 Å²	60	74%	0.743	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-29	-175.2	-76.4	-5.6	0	0	0	112.8	E61	N58-E61 PolarHBondContact N-OE1 3.16Å; N58-E61 PolarHBondContact N-OE2 2.89Å
59	N	86.8	Confident	86	Confident	65 Å²	65	63.9 Å²	63.9	35%	0.348	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	13.5	177.8	-71.7	17.2	0	0	0	111.1	P28 C29 H30 G57 E61	P28-N59 VanDerWaalsContact O-CB 3.31Å; P28-N59 WeakPolarHBondContact O-CB 3.25Å; P28-N59 VanDerWaalsContact O-CG 3.31Å; P28-N59 PolarHBondContact O-ND2 3.35Å; C29-N59 CarbonylContact C-O 3.49Å; C29-N59 WeakPolarHBondContact CA-O 3.47Å; H30-N59 PolarHBondContact N-O 3.49Å; G57-N59 VanDerWaalsContact C-N 3.33Å; N59-E61 VanDerWaalsContact C-OE2 3.28Å; N59-E61 VanDerWaalsContact CA-OE2 3.26Å; N59-E61 WeakPolarHBondContact CA-OE2 3.13Å; N59-E61 WeakPolarHBondContact CB-OE2 3.15Å; N59-E61 PolarHBondContact N-OE2 3.18Å; N59-E61 PolarHBondContact O-N 2.93Å
60	C	88.5	Confident	85.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	39%	0.385	C	S	.	.	S	Bend	trans	58.7	30.5	-171.7	-40.5	0	0	0	0	113.2	N31 C49 C51 S56 G57 I62	N31-C60 PolarHBondContact ND2-O 2.97Å; C49-C60 VanDerWaalsContact CB-SG 3.55Å; C51-C60 WeakPolarHBondContact CA-SG 3.45Å; C51-C60 HydrophobicContact CB-CB 3.77Å; C51-C60 WeakPolarHBondContact CB-SG 3.04Å; C51-C60 WeakPolarHBondContact SG-CA 3.28Å; C51-C60 WeakPolarHBondContact SG-CB 3.13Å; C51-C60 CovalentContact SG-SG 2.04Å; C51-C60 PolarHBondContact SG-SG 2.87Å; S56-C60 CarbonylContact O-C 3.41Å; S56-C60 VanDerWaalsContact O-C 3.24Å; S56-C60 VanDerWaalsContact O-CA 3.27Å; S56-C60 WeakPolarHBondContact O-CA 3.43Å; G57-C60 PolarHBondContact O-N 3.48Å; C60-I62 VanDerWaalsContact C-N 3.32Å; C60-I62 PolarHBondContact O-N 3.19Å
61	E	88.1	Confident	85.5	Confident	93 Å²	93	60.5 Å²	60.5	44%	0.435	36%	0.359	S	S	.	.			trans	-74.7	-16.1	-175	69.7	-80.3	-167.5	0	0	114.3	S56 G57 N58 N59	S56-E61 PolarHBondContact O-N 3.4Å; G57-E61 VanDerWaalsContact C-OE2 3.27Å; G57-E61 WeakPolarHBondContact CA-OE1 3.32Å; G57-E61 WeakPolarHBondContact CA-OE2 3.46Å; N58-E61 PolarHBondContact N-OE1 3.16Å; N58-E61 PolarHBondContact N-OE2 2.89Å; N59-E61 VanDerWaalsContact C-OE2 3.28Å; N59-E61 VanDerWaalsContact CA-OE2 3.26Å; N59-E61 WeakPolarHBondContact CA-OE2 3.13Å; N59-E61 WeakPolarHBondContact CB-OE2 3.15Å; N59-E61 PolarHBondContact N-OE2 3.18Å; N59-E61 PolarHBondContact O-N 2.93Å
62	I	87.2	Confident	85.6	Confident	82 Å²	82	59 Å²	59	42%	0.421	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.9	178.3	-51.8	173.3	0	0	0	108.1	T55 S56 C60	T55-I62 CarbonylContact C-O 3.49Å; T55-I62 VanDerWaalsContact CA-O 3.32Å; T55-I62 WeakPolarHBondContact CA-O 3.39Å; T55-I62 WeakPolarHBondContact CB-O 3.34Å; S56-I62 PolarHBondContact N-O 3.34Å; S56-I62 WeakPolarHBondContact O-CB 3.44Å; S56-I62 PolarHBondContact O-N 2.87Å; S56-I62 WeakPolarHBondContact OG-CB 3.08Å; S56-I62 WeakPolarHBondContact OG-CG2 3.34Å; C60-I62 VanDerWaalsContact C-N 3.32Å; C60-I62 PolarHBondContact O-N 3.19Å
63	N	84.6	Confident	85.8	Confident	38 Å²	38	62 Å²	62	20%	0.203	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	138.9	158.2	-157.1	62.2	0	0	0	108.2	G54 D80 R81 V82	G54-N63 PolarHBondContact O-OD1 2.97Å; N63-D80 PolarHBondContact ND2-OD1 2.69Å; N63-D80 VanDerWaalsContact ND2-OD1 3.11Å; N63-D80 PolarHBondContact ND2-OD2 3.45Å; N63-R81 PolarHBondContact ND2-O 2.78Å; N63-V82 WeakPolarHBondContact OD1-CA 3.08Å; N63-V82 WeakPolarHBondContact OD1-CG2 3.37Å
64	N	86.8	Confident	85.8	Confident	69 Å²	69	63.7 Å²	63.7	37%	0.369	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-89.6	127.5	175.6	-50.7	-34.3	0	0	0	107.3	G54 S56 D66	G54-N64 VanDerWaalsContact O-CB 3.29Å; G54-N64 WeakPolarHBondContact O-CB 3.38Å; G54-N64 PolarHBondContact O-N 2.67Å; G54-N64 PolarHBondContact O-ND2 2.72Å; G54-N64 VanDerWaalsContact O-ND2 3.15Å; S56-N64 PolarHBondContact OG-OD1 2.81Å; N64-D66 PolarHBondContact O-N 2.88Å; N64-D66 VanDerWaalsContact O-N 3.12Å
65	D	85.1	Confident	85.8	Confident	121 Å²	121	70.9 Å²	70.9	65%	0.647	39%	0.387	S	S	*	.			trans	-66.4	108.6	-172.8	-171.4	-5.7	0	0	0	112	C67 D80	D65-C67 VanDerWaalsContact C-N 3.31Å; D65-C67 VanDerWaalsContact OD1-CB 3.3Å; D65-C67 WeakPolarHBondContact OD1-CB 3.2Å; D65-C67 PolarHBondContact OD1-N 3.3Å; D65-D80 WeakPolarHBondContact CA-OD1 3.49Å
66	D	85.4	Confident	85.7	Confident	52 Å²	52	70.9 Å²	70.9	28%	0.278	39%	0.39	S	S	.	.			trans	-83.5	-1.5	-179.4	-79.9	-43.7	0	0	0	113.1	N64 D80 D83 S84	N64-D66 PolarHBondContact O-N 2.88Å; N64-D66 VanDerWaalsContact O-N 3.12Å; D66-D80 PolarHBondContact N-OD1 2.9Å; D66-D80 VanDerWaalsContact N-OD1 3.11Å; D66-D83 VanDerWaalsContact OD2-C 3.32Å; D66-D83 VanDerWaalsContact OD2-CA 3.23Å; D66-D83 WeakPolarHBondContact OD2-CA 3.4Å; D66-D83 PolarHBondContact OD2-N 3.19Å; D66-S84 WeakPolarHBondContact CB-O 3.4Å; D66-S84 PolarHBondContact OD2-N 3.28Å
67	C	88.8	Confident	85.8	Confident	39 Å²	39	73.1 Å²	73.1	26%	0.264	40%	0.402	S	S	.	.			trans	-80.6	120	180	-76.8	0	0	0	0	113.6	D65 C78	D65-C67 VanDerWaalsContact C-N 3.31Å; D65-C67 VanDerWaalsContact OD1-CB 3.3Å; D65-C67 WeakPolarHBondContact OD1-CB 3.2Å; D65-C67 PolarHBondContact OD1-N 3.3Å; C67-C78 VanDerWaalsContact CA-SG 3.53Å; C67-C78 HydrophobicContact CB-CB 3.84Å; C67-C78 WeakPolarHBondContact CB-SG 3.49Å; C67-C78 VanDerWaalsContact SG-C 3.52Å; C67-C78 WeakPolarHBondContact SG-CB 3.13Å; C67-C78 CovalentContact SG-SG 2.04Å; C67-C78 PolarHBondContact SG-SG 2.93Å
68	Y	87	Confident	86.1	Confident	120 Å²	120	73.5 Å²	73.5	47%	0.471	40%	0.4	S	S	.	.			trans	-117.1	164.5	176.4	62.2	-86.8	0	0	0	113.5	G70 A71 F85 R97	Y68-G70 PolarHBondContact O-N 2.86Å; Y68-G70 VanDerWaalsContact O-N 3.16Å; Y68-A71 HydrophobicContact CD1-CB 4.01Å; Y68-A71 HydrophobicContact CD2-CB 4.3Å; Y68-A71 HydrophobicContact CE1-CB 3.94Å; Y68-A71 HydrophobicContact CE2-CB 4.23Å; Y68-A71 HydrophobicContact CG-CB 4.19Å; Y68-A71 WeakPolarHBondContact O-CB 3.39Å; Y68-A71 PolarHBondContact O-N 3.33Å; Y68-F85 HydrophobicContact CE1-CD1 4.43Å; Y68-F85 AromaticContact CE1-CE1 3.72Å; Y68-F85 HydrophobicContact CE1-CE1 3.72Å; Y68-F85 HydrophobicContact CE1-CZ 4.13Å; Y68-R97 PolarHBondContact OH-NH2 3.26Å
69	T	80.3	Confident	86.4	Confident	149 Å²	149	68.9 Å²	68.9	91%	0.914	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	114.5	177	16.9	0	0	0	0	110.6
70	G	80.3	Confident	86.3	Confident	47 Å²	47	68.4 Å²	68.4	49%	0.485	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	8.6	-172.5	0	0	0	0	0	114.9	Y68 C72 R97	Y68-G70 PolarHBondContact O-N 2.86Å; Y68-G70 VanDerWaalsContact O-N 3.16Å; G70-C72 PolarHBondContact O-N 3.15Å; G70-R97 PolarHBondContact O-NH2 2.79Å
71	A	86	Confident	86.2	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.008	39%	0.393	C	S	.	.	S	Bend	trans	-54.5	-41.7	170.3	0	0	0	0	0	111.7	Y68 C78 F85 R97	Y68-A71 HydrophobicContact CD1-CB 4.01Å; Y68-A71 HydrophobicContact CD2-CB 4.3Å; Y68-A71 HydrophobicContact CE1-CB 3.94Å; Y68-A71 HydrophobicContact CE2-CB 4.23Å; Y68-A71 HydrophobicContact CG-CB 4.19Å; Y68-A71 WeakPolarHBondContact O-CB 3.39Å; Y68-A71 PolarHBondContact O-N 3.33Å; A71-C78 HydrophobicContact CB-CB 4.37Å; A71-F85 HydrophobicContact CB-CD2 4.09Å; A71-F85 HydrophobicContact CB-CE1 4.49Å; A71-F85 HydrophobicContact CB-CE2 3.78Å; A71-F85 HydrophobicContact CB-CZ 4Å; A71-R97 PolarHBondContact O-NE 2.94Å; A71-R97 PolarHBondContact O-NH2 2.86Å
72	C	90.8	Very high	85.9	Confident	18 Å²	18	72 Å²	72	12%	0.122	39%	0.39	C	S	.	.	S	Bend	trans	-111.4	139.3	172.8	-47.7	0	0	0	0	111.6	G70 G76 C78 C87	G70-C72 PolarHBondContact O-N 3.15Å; C72-G76 WeakPolarHBondContact CB-O 3.31Å; C72-C78 VanDerWaalsContact SG-CA 3.54Å; C72-C87 WeakPolarHBondContact CA-SG 3.4Å; C72-C87 HydrophobicContact CB-CB 3.85Å; C72-C87 WeakPolarHBondContact CB-SG 3.4Å; C72-C87 VanDerWaalsContact SG-CA 3.56Å; C72-C87 WeakPolarHBondContact SG-CB 3.37Å; C72-C87 CovalentContact SG-SG 2.03Å; C72-C87 PolarHBondContact SG-SG 3.08Å
73	Y	85.8	Confident	85.7	Confident	115 Å²	115	73 Å²	73	45%	0.451	40%	0.397	S	S	.	.	S	Bend	trans	-80.2	171.8	169.9	-64.7	-75.6	0	0	0	111.6	N75 G76 R97 E99	Y73-N75 PolarHBondContact O-N 3.32Å; Y73-G76 PolarHBondContact O-N 2.86Å; Y73-R97 WeakPolarHBondContact CB-O 3.43Å; Y73-R97 HydrophobicContact CD2-CB 3.88Å; Y73-R97 WeakPolarHBondContact CD2-O 3.45Å; Y73-R97 HydrophobicContact CE2-CB 4.16Å; Y73-R97 PolarHBondContact N-O 2.96Å; Y73-E99 HydrophobicContact CD2-CB 3.79Å; Y73-E99 HydrophobicContact CE2-CB 4.2Å
74	H	82.3	Confident	85.8	Confident	95 Å²	95	73.9 Å²	73.9	44%	0.44	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	32.5	171.8	-56.6	114.7	0	0	0	115.4	G76 P90 F93 C98	H74-G76 VanDerWaalsContact C-N 3.3Å; H74-G76 PolarHBondContact O-N 3.39Å; H74-P90 WeakPolarHBondContact O-CG 3.49Å; H74-F93 HydrophobicContact CB-CD1 3.55Å; H74-F93 HydrophobicContact CB-CD2 4.28Å; H74-F93 HydrophobicContact CB-CE1 3.6Å; H74-F93 HydrophobicContact CB-CE2 4.33Å; H74-F93 HydrophobicContact CB-CG 3.9Å; H74-F93 HydrophobicContact CB-CZ 4Å; H74-F93 AromaticContact CD2-CE1 3.41Å; H74-F93 VanDerWaalsContact CD2-CE1 3.41Å; H74-F93 WeakPolarHBondContact CD2-CE1 3.45Å; H74-F93 AromaticContact CE1-CD1 3.99Å; H74-F93 AromaticContact CE1-CE1 3.84Å; H74-F93 AromaticContact CG-CD1 3.37Å; H74-F93 AromaticContact CG-CE1 3.21Å; H74-F93 AromaticContact CG-CZ 3.98Å; H74-F93 AromaticContact ND1-CD1 3.35Å; H74-F93 VanDerWaalsContact ND1-CD1 3.35Å; H74-F93 WeakPolarHBondContact ND1-CD1 3.06Å; H74-F93 AromaticContact ND1-CE1 3.51Å; H74-F93 AromaticContact NE2-CE1 3.82Å; H74-C98 PolarHBondContact ND1-O 3.02Å
75	N	82.4	Confident	85.9	Confident	160 Å²	160	73 Å²	73	86%	0.856	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	26.4	-179	-132.9	43.5	0	0	0	114.5	Y73	Y73-N75 PolarHBondContact O-N 3.32Å
76	G	85.1	Confident	86.1	Confident	15 Å²	15	70.9 Å²	70.9	16%	0.155	39%	0.387	C	S	.	.			trans	-62.5	148.6	169.9	0	0	0	0	0	113.2	C72 Y73 H74 I88	C72-G76 WeakPolarHBondContact CB-O 3.31Å; Y73-G76 PolarHBondContact O-N 2.86Å; H74-G76 VanDerWaalsContact C-N 3.3Å; H74-G76 PolarHBondContact O-N 3.39Å; G76-I88 WeakPolarHBondContact CA-O 3.47Å
77	T	90.2	Very high	86.4	Confident	89 Å²	89	69.3 Å²	69.3	55%	0.546	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114.1	-178.7	-57.4	0	0	0	0	109.7	I88	T77-I88 PolarHBondContact N-O 3.24Å; T77-I88 PolarHBondContact O-N 2.84Å
78	C	91.8	Very high	86.4	Confident	36 Å²	36	72.6 Å²	72.6	24%	0.243	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	138.9	174.2	-169.2	0	0	0	0	110.9	C67 A71 C72 D86	C67-C78 VanDerWaalsContact CA-SG 3.53Å; C67-C78 HydrophobicContact CB-CB 3.84Å; C67-C78 WeakPolarHBondContact CB-SG 3.49Å; C67-C78 VanDerWaalsContact SG-C 3.52Å; C67-C78 WeakPolarHBondContact SG-CB 3.13Å; C67-C78 CovalentContact SG-SG 2.04Å; C67-C78 PolarHBondContact SG-SG 2.93Å; A71-C78 HydrophobicContact CB-CB 4.37Å; C72-C78 VanDerWaalsContact SG-CA 3.54Å; C78-D86 CarbonylContact C-O 3.48Å
79	V	90.2	Very high	86.2	Confident	43 Å²	43	68.6 Å²	68.6	26%	0.261	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116.4	177.6	179.2	0	0	0	0	109	D86 I88	V79-D86 HydrophobicContact CB-CB 4.44Å; V79-D86 PolarHBondContact N-O 3.45Å; V79-D86 PolarHBondContact O-N 3.24Å; V79-I88 HydrophobicContact CG2-CD1 3.65Å; V79-I88 HydrophobicContact CG2-CG1 3.91Å
80	D	86.3	Confident	86	Confident	54 Å²	54	63.3 Å²	63.3	29%	0.289	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	142.2	178.4	-175.7	43.8	0	0	0	113.6	N63 D65 D66	N63-D80 PolarHBondContact ND2-OD1 2.69Å; N63-D80 VanDerWaalsContact ND2-OD1 3.11Å; N63-D80 PolarHBondContact ND2-OD2 3.45Å; D65-D80 WeakPolarHBondContact CA-OD1 3.49Å; D66-D80 PolarHBondContact N-OD1 2.9Å; D66-D80 VanDerWaalsContact N-OD1 3.11Å
81	R	85.9	Confident	85.6	Confident	107 Å²	107	66 Å²	66	40%	0.404	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	171.9	177.6	-63.6	-70.6	-177.1	-116.1	2.3	109.1	N63 D83 S84 D86	N63-R81 PolarHBondContact ND2-O 2.78Å; R81-D83 PolarHBondContact O-N 3.15Å; R81-S84 CarbonylContact C-O 3.57Å; R81-S84 WeakPolarHBondContact CA-O 3.04Å; R81-S84 VanDerWaalsContact CB-O 3.3Å; R81-S84 WeakPolarHBondContact CB-O 3.35Å; R81-S84 WeakPolarHBondContact CB-OG 3.34Å; R81-S84 PolarHBondContact N-O 3.3Å; R81-S84 VanDerWaalsContact N-O 3.08Å; R81-S84 VanDerWaalsContact O-O 3.13Å; R81-D86 IonicContact CZ-OD2 3.27Å; R81-D86 VanDerWaalsContact NE-CG 3.33Å; R81-D86 IonicContact NE-OD1 2.63Å; R81-D86 IonicContact NE-OD2 2.65Å; R81-D86 PolarHBondContact NE-OD2 3.35Å; R81-D86 IonicContact NH2-OD2 2.74Å; R81-D86 PolarHBondContact NH2-OD2 3.39Å
82	V	82.1	Confident	84.3	Confident	61 Å²	61	66.5 Å²	66.5	37%	0.37	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	114	176.8	180	0	0	0	0	109	N31 T55 N63 S84	N31-V82 HydrophobicContact CB-CG2 4.17Å; T55-V82 HydrophobicContact CG2-CG1 3.69Å; T55-V82 HydrophobicContact CG2-CG2 4.46Å; N63-V82 WeakPolarHBondContact OD1-CA 3.08Å; N63-V82 WeakPolarHBondContact OD1-CG2 3.37Å; V82-S84 PolarHBondContact O-N 2.89Å; V82-S84 PolarHBondContact O-OG 2.98Å
83	D	82.5	Confident	83.3	Confident	104 Å²	104	67.4 Å²	67.4	56%	0.556	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	30.8	177.7	-149.4	48	0	0	0	112.3	A53 G54 D66 R81	A53-D83 HydrophobicContact CB-CB 4.42Å; A53-D83 VanDerWaalsContact CB-CG 3.47Å; A53-D83 WeakPolarHBondContact CB-OD1 2.95Å; A53-D83 WeakPolarHBondContact CB-OD2 3.46Å; G54-D83 PolarHBondContact N-OD1 3.46Å; G54-D83 VanDerWaalsContact N-OD1 3.16Å; D66-D83 VanDerWaalsContact OD2-C 3.32Å; D66-D83 VanDerWaalsContact OD2-CA 3.23Å; D66-D83 WeakPolarHBondContact OD2-CA 3.4Å; D66-D83 PolarHBondContact OD2-N 3.19Å; R81-D83 PolarHBondContact O-N 3.15Å
84	S	86.3	Confident	82.7	Confident	57 Å²	57	62.7 Å²	62.7	40%	0.399	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	172.4	-169.4	47.3	0	0	0	0	112.7	D66 R81 V82	D66-S84 WeakPolarHBondContact CB-O 3.4Å; D66-S84 PolarHBondContact OD2-N 3.28Å; R81-S84 CarbonylContact C-O 3.57Å; R81-S84 WeakPolarHBondContact CA-O 3.04Å; R81-S84 VanDerWaalsContact CB-O 3.3Å; R81-S84 WeakPolarHBondContact CB-O 3.35Å; R81-S84 WeakPolarHBondContact CB-OG 3.34Å; R81-S84 PolarHBondContact N-O 3.3Å; R81-S84 VanDerWaalsContact N-O 3.08Å; R81-S84 VanDerWaalsContact O-O 3.13Å; V82-S84 PolarHBondContact O-N 2.89Å; V82-S84 PolarHBondContact O-OG 2.98Å
85	F	89.5	Confident	82.3	Confident	51 Å²	51	60.1 Å²	60.1	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.7	168.9	64.4	-89.6	0	0	0	111.1	Y68 A71 R97	Y68-F85 HydrophobicContact CE1-CD1 4.43Å; Y68-F85 AromaticContact CE1-CE1 3.72Å; Y68-F85 HydrophobicContact CE1-CE1 3.72Å; Y68-F85 HydrophobicContact CE1-CZ 4.13Å; A71-F85 HydrophobicContact CB-CD2 4.09Å; A71-F85 HydrophobicContact CB-CE1 4.49Å; A71-F85 HydrophobicContact CB-CE2 3.78Å; A71-F85 HydrophobicContact CB-CZ 4Å; F85-R97 HydrophobicContact CE2-CG 4.27Å; F85-R97 HydrophobicContact CZ-CG 4.44Å
86	D	89.9	Confident	82.3	Confident	75 Å²	75	60.9 Å²	60.9	40%	0.401	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	144.8	170.4	-73.2	-4.1	0	0	0	110.1	C78 V79 R81	C78-D86 CarbonylContact C-O 3.48Å; V79-D86 HydrophobicContact CB-CB 4.44Å; V79-D86 PolarHBondContact N-O 3.45Å; V79-D86 PolarHBondContact O-N 3.24Å; R81-D86 IonicContact CZ-OD2 3.27Å; R81-D86 VanDerWaalsContact NE-CG 3.33Å; R81-D86 IonicContact NE-OD1 2.63Å; R81-D86 IonicContact NE-OD2 2.65Å; R81-D86 PolarHBondContact NE-OD2 3.35Å; R81-D86 IonicContact NH2-OD2 2.74Å; R81-D86 PolarHBondContact NH2-OD2 3.39Å
87	C	91	Very high	82.4	Confident	20 Å²	20	63.7 Å²	63.7	14%	0.135	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	117.8	169.5	-72.2	0	0	0	0	112.1	C72 C89 E96	C72-C87 WeakPolarHBondContact CA-SG 3.4Å; C72-C87 HydrophobicContact CB-CB 3.85Å; C72-C87 WeakPolarHBondContact CB-SG 3.4Å; C72-C87 VanDerWaalsContact SG-CA 3.56Å; C72-C87 WeakPolarHBondContact SG-CB 3.37Å; C72-C87 CovalentContact SG-SG 2.03Å; C72-C87 PolarHBondContact SG-SG 3.08Å; C87-C89 PolarHBondContact O-N 2.82Å; C87-E96 WeakPolarHBondContact CB-O 3.46Å
88	I	88.6	Confident	82.2	Confident	107 Å²	107	59.4 Å²	59.4	55%	0.549	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	104.4	166.8	-58.8	177.7	0	0	0	108.1	G76 T77 V79	G76-I88 WeakPolarHBondContact CA-O 3.47Å; T77-I88 PolarHBondContact N-O 3.24Å; T77-I88 PolarHBondContact O-N 2.84Å; V79-I88 HydrophobicContact CG2-CD1 3.65Å; V79-I88 HydrophobicContact CG2-CG1 3.91Å
89	C	83.2	Confident	81.6	Confident	36 Å²	36	61.9 Å²	61.9	24%	0.243	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-74.9	144.1	180	-53.9	0	0	0	0	112.5	C87 F93 C98	C87-C89 PolarHBondContact O-N 2.82Å; C89-F93 HydrophobicContact CB-CB 4.31Å; C89-C98 WeakPolarHBondContact CA-SG 3.47Å; C89-C98 HydrophobicContact CB-CB 3.78Å; C89-C98 WeakPolarHBondContact CB-SG 3.37Å; C89-C98 WeakPolarHBondContact SG-CA 3.28Å; C89-C98 WeakPolarHBondContact SG-CB 3.26Å; C89-C98 CovalentContact SG-SG 2.04Å; C89-C98 PolarHBondContact SG-SG 2.82Å
90	P	76.7	Confident	80.7	Confident	38 Å²	38	63.4 Å²	63.4	25%	0.247	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-65.5	161.5	166.1	28.5	-31.1	0	0	0	110.2	H74 F93	H74-P90 WeakPolarHBondContact O-CG 3.49Å; P90-F93 HydrophobicContact CG-CB 4.44Å; P90-F93 HydrophobicContact CG-CD2 3.85Å; P90-F93 HydrophobicContact CG-CG 4.42Å; P90-F93 PolarHBondContact O-N 3.39Å
91	P	71.4	Confident	79.7	Confident	104 Å²	104	65.9 Å²	65.9	68%	0.675	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	147.7	173.2	-25.8	34.6	0	0	0	111.7	F93 N123	P91-F93 WeakPolarHBondContact O-CD2 3.44Å; P91-F93 PolarHBondContact O-N 2.86Å; P91-N123 PolarHBondContact O-ND2 2.98Å; P91-N123 PolarHBondContact O-OD1 3.43Å
92	G	59.3	Low	78.6	Confident	11 Å²	11	63.6 Å²	63.6	11%	0.113	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-0.7	-178.2	0	0	0	0	0	115.8	T102 N123	G92-T102 PolarHBondContact O-N 3.06Å; G92-N123 WeakPolarHBondContact CA-OD1 3.13Å
93	F	69.2	Low	77.8	Confident	38 Å²	38	64.9 Å²	64.9	17%	0.167	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	155.4	174.6	-63	-90.3	0	0	0	111.8	H74 C89 P90 P91 C98 V100 Q101 N123	H74-F93 HydrophobicContact CB-CD1 3.55Å; H74-F93 HydrophobicContact CB-CD2 4.28Å; H74-F93 HydrophobicContact CB-CE1 3.6Å; H74-F93 HydrophobicContact CB-CE2 4.33Å; H74-F93 HydrophobicContact CB-CG 3.9Å; H74-F93 HydrophobicContact CB-CZ 4Å; H74-F93 AromaticContact CD2-CE1 3.41Å; H74-F93 VanDerWaalsContact CD2-CE1 3.41Å; H74-F93 WeakPolarHBondContact CD2-CE1 3.45Å; H74-F93 AromaticContact CE1-CD1 3.99Å; H74-F93 AromaticContact CE1-CE1 3.84Å; H74-F93 AromaticContact CG-CD1 3.37Å; H74-F93 AromaticContact CG-CE1 3.21Å; H74-F93 AromaticContact CG-CZ 3.98Å; H74-F93 AromaticContact ND1-CD1 3.35Å; H74-F93 VanDerWaalsContact ND1-CD1 3.35Å; H74-F93 WeakPolarHBondContact ND1-CD1 3.06Å; H74-F93 AromaticContact ND1-CE1 3.51Å; H74-F93 AromaticContact NE2-CE1 3.82Å; C89-F93 HydrophobicContact CB-CB 4.31Å; P90-F93 HydrophobicContact CG-CB 4.44Å; P90-F93 HydrophobicContact CG-CD2 3.85Å; P90-F93 HydrophobicContact CG-CG 4.42Å; P90-F93 PolarHBondContact O-N 3.39Å; P91-F93 WeakPolarHBondContact O-CD2 3.44Å; P91-F93 PolarHBondContact O-N 2.86Å; F93-C98 HydrophobicContact CB-CB 4.41Å; F93-V100 CarbonylContact C-O 3.43Å; F93-V100 VanDerWaalsContact CA-O 3.3Å; F93-V100 WeakPolarHBondContact CA-O 3.04Å; F93-Q101 HydrophobicContact CD1-CG 3.94Å; F93-Q101 HydrophobicContact CE1-CG 3.53Å; F93-Q101 HydrophobicContact CZ-CG 4.29Å; F93-N123 WeakPolarHBondContact CE2-OD1 3.3Å
94	G	72.2	Confident	77.2	Confident	16 Å²	16	61.8 Å²	61.8	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	-170.8	-178.2	0	0	0	0	0	112.2	C98 E99 V100	G94-C98 CarbonylContact O-C 3.46Å; G94-C98 WeakPolarHBondContact O-CA 3.44Å; G94-E99 PolarHBondContact O-N 2.94Å; G94-V100 PolarHBondContact N-O 2.9Å; G94-V100 WeakPolarHBondContact O-CA 3.28Å; G94-V100 WeakPolarHBondContact O-CB 3.36Å; G94-V100 PolarHBondContact O-N 3.33Å
95	G	75.7	Confident	76.8	Confident	41 Å²	41	60.2 Å²	60.2	42%	0.423	33%	0.332	S	S	.	.	S	Bend	trans	85.9	165.3	-164.6	0	0	0	0	0	111.9	R97 C98 E99	G95-R97 PolarHBondContact O-N 2.77Å; G95-C98 PolarHBondContact O-N 3.07Å; G95-E99 WeakPolarHBondContact CA-OE1 3.46Å
96	E	81.8	Confident	76.1	Confident	176 Å²	176	62.3 Å²	62.3	82%	0.822	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-26	-169.1	-65.5	-174.4	153.9	0	0	113	C87 E99	C87-E96 WeakPolarHBondContact CB-O 3.46Å; E96-E99 PolarHBondContact N-OE1 3.01Å
97	R	87.3	Confident	75.2	Confident	73 Å²	73	63 Å²	63	28%	0.275	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	18.7	177.7	-60.3	177.6	60.5	-175	-2.3	111.9	Y68 G70 A71 Y73 F85 G95 E99	Y68-R97 PolarHBondContact OH-NH2 3.26Å; G70-R97 PolarHBondContact O-NH2 2.79Å; A71-R97 PolarHBondContact O-NE 2.94Å; A71-R97 PolarHBondContact O-NH2 2.86Å; Y73-R97 WeakPolarHBondContact CB-O 3.43Å; Y73-R97 HydrophobicContact CD2-CB 3.88Å; Y73-R97 WeakPolarHBondContact CD2-O 3.45Å; Y73-R97 HydrophobicContact CE2-CB 4.16Å; Y73-R97 PolarHBondContact N-O 2.96Å; F85-R97 HydrophobicContact CE2-CG 4.27Å; F85-R97 HydrophobicContact CZ-CG 4.44Å; G95-R97 PolarHBondContact O-N 2.77Å; R97-E99 VanDerWaalsContact C-N 3.27Å; R97-E99 WeakPolarHBondContact CA-OE2 3.49Å; R97-E99 WeakPolarHBondContact CB-OE2 3.36Å; R97-E99 PolarHBondContact N-OE2 3.19Å; R97-E99 PolarHBondContact O-N 2.83Å
98	C	86.6	Confident	74.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	39%	0.388	C	S	.	.	S	Bend	trans	64.5	24.9	-176.9	-44.4	0	0	0	0	114.8	H74 C89 F93 G94 G95	H74-C98 PolarHBondContact ND1-O 3.02Å; C89-C98 WeakPolarHBondContact CA-SG 3.47Å; C89-C98 HydrophobicContact CB-CB 3.78Å; C89-C98 WeakPolarHBondContact CB-SG 3.37Å; C89-C98 WeakPolarHBondContact SG-CA 3.28Å; C89-C98 WeakPolarHBondContact SG-CB 3.26Å; C89-C98 CovalentContact SG-SG 2.04Å; C89-C98 PolarHBondContact SG-SG 2.82Å; F93-C98 HydrophobicContact CB-CB 4.41Å; G94-C98 CarbonylContact O-C 3.46Å; G94-C98 WeakPolarHBondContact O-CA 3.44Å; G95-C98 PolarHBondContact O-N 3.07Å
99	E	78.9	Confident	74	Confident	88 Å²	88	62 Å²	62	41%	0.411	36%	0.364	S	S	.	.			trans	-73.3	-21.2	-178.9	67.7	-72.7	169.3	0	0	114.6	Y73 G94 G95 E96 R97	Y73-E99 HydrophobicContact CD2-CB 3.79Å; Y73-E99 HydrophobicContact CE2-CB 4.2Å; G94-E99 PolarHBondContact O-N 2.94Å; G95-E99 WeakPolarHBondContact CA-OE1 3.46Å; E96-E99 PolarHBondContact N-OE1 3.01Å; R97-E99 VanDerWaalsContact C-N 3.27Å; R97-E99 WeakPolarHBondContact CA-OE2 3.49Å; R97-E99 WeakPolarHBondContact CB-OE2 3.36Å; R97-E99 PolarHBondContact N-OE2 3.19Å; R97-E99 PolarHBondContact O-N 2.83Å
100	V	70.6	Confident	74.2	Confident	75 Å²	75	61.5 Å²	61.5	46%	0.455	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.8	-177.6	-172.3	0	0	0	0	110.1	F93 G94	F93-V100 CarbonylContact C-O 3.43Å; F93-V100 VanDerWaalsContact CA-O 3.3Å; F93-V100 WeakPolarHBondContact CA-O 3.04Å; G94-V100 PolarHBondContact N-O 2.9Å; G94-V100 WeakPolarHBondContact O-CA 3.28Å; G94-V100 WeakPolarHBondContact O-CB 3.36Å; G94-V100 PolarHBondContact O-N 3.33Å
101	Q	65.5	Low	74.6	Confident	105 Å²	105	61 Å²	61	49%	0.491	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	123.2	161.2	-79.4	-169.7	-55.1	0	0	109.6	F93 N103 D122	F93-Q101 HydrophobicContact CD1-CG 3.94Å; F93-Q101 HydrophobicContact CE1-CG 3.53Å; F93-Q101 HydrophobicContact CZ-CG 4.29Å; Q101-N103 PolarHBondContact O-N 3.4Å; Q101-D122 PolarHBondContact NE2-OD1 2.8Å
102	T	63.1	Low	75.1	Confident	59 Å²	59	61.7 Å²	61.7	36%	0.362	37%	0.366	S	S	.	.			trans	-70.9	114.7	177.3	-61.7	0	0	0	0	109.1	G92 E104 Q120	G92-T102 PolarHBondContact O-N 3.06Å; T102-E104 PolarHBondContact O-N 2.61Å; T102-Q120 PolarHBondContact O-NE2 2.85Å
103	N	64.1	Low	76	Confident	88 Å²	88	67.3 Å²	67.3	47%	0.471	39%	0.389	S	S	.	.			trans	-77.2	118.6	172.7	-172	-17.4	0	0	0	109.1	Q101 C105 P106 Q120	Q101-N103 PolarHBondContact O-N 3.4Å; N103-C105 WeakPolarHBondContact OD1-CB 3.43Å; N103-C105 PolarHBondContact OD1-N 2.98Å; N103-C105 VanDerWaalsContact OD1-N 3.13Å; N103-P106 HydrophobicContact CB-CG 4.35Å; N103-P106 VanDerWaalsContact CG-CD 3.49Å; N103-P106 WeakPolarHBondContact O-CD 3.49Å; N103-P106 WeakPolarHBondContact OD1-CD 3.26Å; N103-Q120 PolarHBondContact OD1-OE1 2.04Å
104	E	69.9	Low	76.5	Confident	40 Å²	40	65.5 Å²	65.5	19%	0.187	38%	0.381	C	S	.	.	S	Bend	trans	-84.3	-21.9	178.9	-73	94	-174.5	0	0	113.2	T102 P106 S107 Q120 N124	T102-E104 PolarHBondContact O-N 2.61Å; E104-P106 VanDerWaalsContact C-CD 3.49Å; E104-S107 WeakPolarHBondContact O-CB 3.33Å; E104-S107 PolarHBondContact O-N 2.89Å; E104-S107 PolarHBondContact O-OG 3.48Å; E104-Q120 PolarHBondContact OE2-NE2 3.43Å; E104-N124 PolarHBondContact OE2-N 3.21Å; E104-N124 VanDerWaalsContact OE2-N 3.09Å
105	C	78.5	Confident	77.2	Confident	24 Å²	24	65.8 Å²	65.8	16%	0.162	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-56.7	-36.5	-180	-73.3	0	0	0	0	115.3	N103 S107 S108 P109 C118	N103-C105 WeakPolarHBondContact OD1-CB 3.43Å; N103-C105 PolarHBondContact OD1-N 2.98Å; N103-C105 VanDerWaalsContact OD1-N 3.13Å; C105-S107 PolarHBondContact O-N 3.28Å; C105-S107 VanDerWaalsContact O-N 3.12Å; C105-S108 PolarHBondContact O-N 3.26Å; C105-P109 WeakPolarHBondContact O-CD 3.44Å; C105-C118 VanDerWaalsContact CA-SG 3.54Å; C105-C118 HydrophobicContact CB-CB 3.83Å; C105-C118 WeakPolarHBondContact CB-SG 3.49Å; C105-C118 VanDerWaalsContact SG-C 3.56Å; C105-C118 WeakPolarHBondContact SG-CB 3.43Å; C105-C118 CovalentContact SG-SG 2.04Å; C105-C118 PolarHBondContact SG-SG 3.3Å
106	P	75.6	Confident	77.5	Confident	95 Å²	95	68.3 Å²	68.3	62%	0.617	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-55.4	-22.7	172.4	-29.5	35	0	0	0	115.3	N103 E104 S108	N103-P106 HydrophobicContact CB-CG 4.35Å; N103-P106 VanDerWaalsContact CG-CD 3.49Å; N103-P106 WeakPolarHBondContact O-CD 3.49Å; N103-P106 WeakPolarHBondContact OD1-CD 3.26Å; E104-P106 VanDerWaalsContact C-CD 3.49Å; P106-S108 PolarHBondContact O-N 3.36Å; P106-S108 VanDerWaalsContact O-N 3.13Å
107	S	70.9	Confident	77.7	Confident	89 Å²	89	66 Å²	66	62%	0.622	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-71.6	0.9	174.8	71.5	0	0	0	0	114	E104 C105	E104-S107 WeakPolarHBondContact O-CB 3.33Å; E104-S107 PolarHBondContact O-N 2.89Å; E104-S107 PolarHBondContact O-OG 3.48Å; C105-S107 PolarHBondContact O-N 3.28Å; C105-S107 VanDerWaalsContact O-N 3.12Å
108	S	72.4	Confident	77.6	Confident	98 Å²	98	64.4 Å²	64.4	69%	0.685	37%	0.373	S	S	*	.			trans	49.4	54.5	-172.1	-61.5	0	0	0	0	113.1	C105 P106 C110	C105-S108 PolarHBondContact O-N 3.26Å; P106-S108 PolarHBondContact O-N 3.36Å; P106-S108 VanDerWaalsContact O-N 3.13Å; S108-C110 VanDerWaalsContact C-N 3.27Å; S108-C110 PolarHBondContact O-N 3.36Å
109	P	81.4	Confident	77.3	Confident	9 Å²	9	67.5 Å²	67.5	6%	0.058	39%	0.389	C	S	.	.			trans	-75.8	-16.3	-174.1	33.6	-36.7	0	0	0	113.3	C105 F125 R137	C105-P109 WeakPolarHBondContact O-CD 3.44Å; P109-F125 HydrophobicContact CB-CD1 3.76Å; P109-F125 HydrophobicContact CB-CD2 3.97Å; P109-F125 HydrophobicContact CB-CE1 3.6Å; P109-F125 HydrophobicContact CB-CE2 3.83Å; P109-F125 HydrophobicContact CB-CG 3.95Å; P109-F125 HydrophobicContact CB-CZ 3.64Å; P109-F125 HydrophobicContact CG-CB 4.05Å; P109-F125 HydrophobicContact CG-CD1 3.77Å; P109-F125 HydrophobicContact CG-CD2 3.72Å; P109-F125 HydrophobicContact CG-CE1 4.15Å; P109-F125 HydrophobicContact CG-CE2 4.11Å; P109-F125 HydrophobicContact CG-CG 3.54Å; P109-F125 HydrophobicContact CG-CZ 4.3Å; P109-R137 WeakPolarHBondContact O-CD 3.42Å; P109-R137 VanDerWaalsContact O-CG 3.24Å; P109-R137 WeakPolarHBondContact O-CG 3.4Å; P109-R137 PolarHBondContact O-NH1 3.34Å
110	C	87.4	Confident	77	Confident	24 Å²	24	66.4 Å²	66.4	16%	0.162	38%	0.384	C	S	.	.	S	Bend	trans	-93.5	152.1	179.5	-58.8	0	0	0	0	112.6	S108 S112 T115 C127	S108-C110 VanDerWaalsContact C-N 3.27Å; S108-C110 PolarHBondContact O-N 3.36Å; C110-S112 PolarHBondContact O-N 2.94Å; C110-T115 HydrophobicContact CB-CG2 3.88Å; C110-T115 WeakPolarHBondContact CB-OG1 3.21Å; C110-C127 VanDerWaalsContact CA-SG 3.51Å; C110-C127 HydrophobicContact CB-CB 3.85Å; C110-C127 WeakPolarHBondContact CB-SG 3.46Å; C110-C127 WeakPolarHBondContact SG-CB 3.04Å; C110-C127 CovalentContact SG-SG 2.03Å; C110-C127 PolarHBondContact SG-SG 3.42Å
111	S	85.3	Confident	76.8	Confident	29 Å²	29	67.4 Å²	67.4	20%	0.203	39%	0.385	C	S	.	.			trans	-63.3	125.7	172.9	175.2	0	0	0	0	111.2	E113 G114 T115 R137 C138	S111-E113 VanDerWaalsContact C-N 3.3Å; S111-E113 PolarHBondContact O-N 3.15Å; S111-G114 PolarHBondContact O-N 2.96Å; S111-G114 PolarHBondContact OG-N 2.83Å; S111-T115 WeakPolarHBondContact O-CB 3.45Å; S111-T115 PolarHBondContact O-N 2.67Å; S111-T115 PolarHBondContact O-OG1 2.95Å; S111-R137 WeakPolarHBondContact CA-O 3.42Å; S111-R137 WeakPolarHBondContact CB-O 3.48Å; S111-R137 PolarHBondContact N-O 3.28Å; S111-C138 VanDerWaalsContact CB-O 3.24Å; S111-C138 WeakPolarHBondContact CB-O 3.42Å; S111-C138 PolarHBondContact OG-O 3.03Å
112	S	80.6	Confident	76.7	Confident	118 Å²	118	68.2 Å²	68.2	83%	0.825	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.8	178.9	49.9	0	0	0	0	113.8	C110	C110-S112 PolarHBondContact O-N 2.94Å
113	E	79.5	Confident	76.6	Confident	129 Å²	129	68.9 Å²	68.9	60%	0.603	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-39.3	177.1	-60	-176.2	-179.2	0	0	112	S111 Y133	S111-E113 VanDerWaalsContact C-N 3.3Å; S111-E113 PolarHBondContact O-N 3.15Å; E113-Y133 HydrophobicContact CB-CE1 4.23Å; E113-Y133 WeakPolarHBondContact CB-OH 3.34Å; E113-Y133 PolarHBondContact OE2-OH 2.95Å
114	G	79.1	Confident	76.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3	-167.5	0	0	0	0	0	116	S111 C129 R130 Y133 C138	S111-G114 PolarHBondContact O-N 2.96Å; S111-G114 PolarHBondContact OG-N 2.83Å; G114-C129 CarbonylContact O-C 3.58Å; G114-C129 WeakPolarHBondContact O-CA 3.34Å; G114-R130 WeakPolarHBondContact O-CB 3.39Å; G114-R130 PolarHBondContact O-N 3.09Å; G114-Y133 VanDerWaalsContact CA-CD1 3.5Å; G114-C138 WeakPolarHBondContact CA-O 3.29Å; G114-C138 WeakPolarHBondContact O-CB 3.47Å
115	T	86.1	Confident	77.1	Confident	21 Å²	21	66.6 Å²	66.6	13%	0.129	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.7	-173.1	-48.6	0	0	0	0	111.8	C110 S111 K117 C127	C110-T115 HydrophobicContact CB-CG2 3.88Å; C110-T115 WeakPolarHBondContact CB-OG1 3.21Å; S111-T115 WeakPolarHBondContact O-CB 3.45Å; S111-T115 PolarHBondContact O-N 2.67Å; S111-T115 PolarHBondContact O-OG1 2.95Å; T115-K117 WeakPolarHBondContact CG2-O 3.48Å; T115-C127 HydrophobicContact CG2-CB 3.93Å
116	V	84	Confident	77.2	Confident	94 Å²	94	67.8 Å²	67.8	57%	0.57	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	-44.9	169.5	-176.7	0	0	0	0	110.3	V128 R130	V116-V128 HydrophobicContact CB-CB 4.48Å; V116-V128 HydrophobicContact CB-CG1 4.25Å; V116-V128 PolarHBondContact N-O 3.37Å; V116-R130 HydrophobicContact CG2-CB 3.93Å; V116-R130 HydrophobicContact CG2-CG 4.49Å
117	K	84.8	Confident	77.9	Confident	129 Å²	129	64 Å²	64	56%	0.561	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.9	136.4	-176.9	-173.3	170.9	-177.7	176.1	0	111.3	T115 I119 V128	T115-K117 WeakPolarHBondContact CG2-O 3.48Å; K117-I119 HydrophobicContact CD-CG1 4.43Å; K117-I119 HydrophobicContact CG-CG1 4.29Å; K117-V128 HydrophobicContact CB-CB 4.29Å; K117-V128 HydrophobicContact CB-CG2 4.25Å; K117-V128 PolarHBondContact O-N 2.87Å
118	C	84.6	Confident	78.6	Confident	39 Å²	39	62.6 Å²	62.6	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.7	161.4	-172	0	0	0	0	108.5	C105	C105-C118 VanDerWaalsContact CA-SG 3.54Å; C105-C118 HydrophobicContact CB-CB 3.83Å; C105-C118 WeakPolarHBondContact CB-SG 3.49Å; C105-C118 VanDerWaalsContact SG-C 3.56Å; C105-C118 WeakPolarHBondContact SG-CB 3.43Å; C105-C118 CovalentContact SG-SG 2.04Å; C105-C118 PolarHBondContact SG-SG 3.3Å
119	I	82	Confident	79.1	Confident	64 Å²	64	60.2 Å²	60.2	33%	0.328	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.4	175.5	-62.7	176.8	0	0	0	107.7	K117 F125 S126 V128	K117-I119 HydrophobicContact CD-CG1 4.43Å; K117-I119 HydrophobicContact CG-CG1 4.29Å; I119-F125 CarbonylContact O-C 3.55Å; I119-F125 WeakPolarHBondContact O-CA 3.17Å; I119-S126 PolarHBondContact N-O 2.67Å; I119-S126 PolarHBondContact O-N 3.44Å; I119-V128 HydrophobicContact CD1-CG2 3.47Å; I119-V128 VanDerWaalsContact CD1-CG2 3.47Å; I119-V128 HydrophobicContact CG1-CG2 3.98Å
120	Q	72.3	Confident	79.1	Confident	65 Å²	65	64 Å²	64	30%	0.304	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.1	170.8	-177.3	57.9	28.7	0	0	110.3	T102 N103 E104	T102-Q120 PolarHBondContact O-NE2 2.85Å; N103-Q120 PolarHBondContact OD1-OE1 2.04Å; E104-Q120 PolarHBondContact OE2-NE2 3.43Å
121	M	66.1	Low	78.1	Confident	96 Å²	96	67 Å²	67	47%	0.473	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	175.1	174.2	-50.1	-170	76.3	0	0	109.7	N123 N124	M121-N123 PolarHBondContact O-N 3.03Å; M121-N123 VanDerWaalsContact O-N 3.15Å; M121-N124 CarbonylContact C-O 3.51Å; M121-N124 WeakPolarHBondContact CA-O 3.34Å; M121-N124 HydrophobicContact CB-CB 4.27Å; M121-N124 WeakPolarHBondContact CB-O 3.3Å; M121-N124 PolarHBondContact N-O 3.33Å; M121-N124 PolarHBondContact O-N 3.12Å
122	D	63.5	Low	76.9	Confident	123 Å²	123	66.4 Å²	66.4	66%	0.658	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	115.3	172.9	-56.4	-62.7	0	0	0	109.9	Q101 N124	Q101-D122 PolarHBondContact NE2-OD1 2.8Å; D122-N124 PolarHBondContact O-N 3.2Å
123	N	61.6	Low	76.7	Confident	73 Å²	73	63.3 Å²	63.3	39%	0.39	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	24	-178.5	-54.9	10.9	0	0	0	115	P91 G92 F93 M121	P91-N123 PolarHBondContact O-ND2 2.98Å; P91-N123 PolarHBondContact O-OD1 3.43Å; G92-N123 WeakPolarHBondContact CA-OD1 3.13Å; F93-N123 WeakPolarHBondContact CE2-OD1 3.3Å; M121-N123 PolarHBondContact O-N 3.03Å; M121-N123 VanDerWaalsContact O-N 3.15Å
124	N	64.8	Low	76.3	Confident	57 Å²	57	60 Å²	60	31%	0.305	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	165.6	-170.9	-160	15.3	0	0	0	113.4	E104 M121 D122 Y136	E104-N124 PolarHBondContact OE2-N 3.21Å; E104-N124 VanDerWaalsContact OE2-N 3.09Å; M121-N124 CarbonylContact C-O 3.51Å; M121-N124 WeakPolarHBondContact CA-O 3.34Å; M121-N124 HydrophobicContact CB-CB 4.27Å; M121-N124 WeakPolarHBondContact CB-O 3.3Å; M121-N124 PolarHBondContact N-O 3.33Å; M121-N124 PolarHBondContact O-N 3.12Å; D122-N124 PolarHBondContact O-N 3.2Å; N124-Y136 PolarHBondContact ND2-OH 3.02Å; N124-Y136 PolarHBondContact OD1-OH 3.3Å
125	F	78.4	Confident	76.2	Confident	23 Å²	23	61.4 Å²	61.4	10%	0.101	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	154.8	171.7	66.3	-86.1	0	0	0	111.3	P109 I119 C127 Y136 R137	P109-F125 HydrophobicContact CB-CD1 3.76Å; P109-F125 HydrophobicContact CB-CD2 3.97Å; P109-F125 HydrophobicContact CB-CE1 3.6Å; P109-F125 HydrophobicContact CB-CE2 3.83Å; P109-F125 HydrophobicContact CB-CG 3.95Å; P109-F125 HydrophobicContact CB-CZ 3.64Å; P109-F125 HydrophobicContact CG-CB 4.05Å; P109-F125 HydrophobicContact CG-CD1 3.77Å; P109-F125 HydrophobicContact CG-CD2 3.72Å; P109-F125 HydrophobicContact CG-CE1 4.15Å; P109-F125 HydrophobicContact CG-CE2 4.11Å; P109-F125 HydrophobicContact CG-CG 3.54Å; P109-F125 HydrophobicContact CG-CZ 4.3Å; I119-F125 CarbonylContact O-C 3.55Å; I119-F125 WeakPolarHBondContact O-CA 3.17Å; F125-C127 VanDerWaalsContact CD2-SG 3.56Å; F125-C127 VanDerWaalsContact CE2-SG 3.58Å; F125-Y136 AromaticContact CE1-CE1 3.98Å; F125-Y136 HydrophobicContact CE1-CE1 3.98Å; F125-Y136 AromaticContact CE2-CD1 3.99Å; F125-Y136 HydrophobicContact CE2-CD1 3.99Å; F125-Y136 AromaticContact CE2-CE1 3.7Å; F125-Y136 HydrophobicContact CE2-CE1 3.7Å; F125-Y136 AromaticContact CZ-CD1 3.8Å; F125-Y136 HydrophobicContact CZ-CD1 3.8Å; F125-Y136 AromaticContact CZ-CE1 3.36Å; F125-Y136 HydrophobicContact CZ-CE1 3.36Å; F125-Y136 PolarHBondContact O-OH 3.17Å; F125-R137 HydrophobicContact CE2-CG 4.33Å; F125-R137 HydrophobicContact CZ-CG 4.38Å
126	S	81.9	Confident	76	Confident	49 Å²	49	66.9 Å²	66.9	34%	0.343	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	125.4	168.2	-175.6	0	0	0	0	110.5	I119	I119-S126 PolarHBondContact N-O 2.67Å; I119-S126 PolarHBondContact O-N 3.44Å
127	C	88.5	Confident	76.1	Confident	14 Å²	14	68.3 Å²	68.3	10%	0.095	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.2	178.3	-50	0	0	0	0	109.8	C110 T115 F125 C129 Y136 C138	C110-C127 VanDerWaalsContact CA-SG 3.51Å; C110-C127 HydrophobicContact CB-CB 3.85Å; C110-C127 WeakPolarHBondContact CB-SG 3.46Å; C110-C127 WeakPolarHBondContact SG-CB 3.04Å; C110-C127 CovalentContact SG-SG 2.03Å; C110-C127 PolarHBondContact SG-SG 3.42Å; T115-C127 HydrophobicContact CG2-CB 3.93Å; F125-C127 VanDerWaalsContact CD2-SG 3.56Å; F125-C127 VanDerWaalsContact CE2-SG 3.58Å; C127-C129 PolarHBondContact O-N 3.27Å; C127-Y136 PolarHBondContact SG-O 2.9Å; C127-C138 HydrophobicContact CB-CB 4.49Å; C127-C138 WeakPolarHBondContact CB-SG 3.45Å; C127-C138 PolarHBondContact O-SG 3.15Å; C127-C138 VanDerWaalsContact O-SG 3.38Å
128	V	86.1	Confident	76.2	Confident	61 Å²	61	62.2 Å²	62.2	37%	0.37	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	107.7	171.8	-179.5	0	0	0	0	108.3	V116 K117 I119	V116-V128 HydrophobicContact CB-CB 4.48Å; V116-V128 HydrophobicContact CB-CG1 4.25Å; V116-V128 PolarHBondContact N-O 3.37Å; K117-V128 HydrophobicContact CB-CB 4.29Å; K117-V128 HydrophobicContact CB-CG2 4.25Å; K117-V128 PolarHBondContact O-N 2.87Å; I119-V128 HydrophobicContact CD1-CG2 3.47Å; I119-V128 VanDerWaalsContact CD1-CG2 3.47Å; I119-V128 HydrophobicContact CG1-CG2 3.98Å
129	C	83	Confident	76.2	Confident	48 Å²	48	64.8 Å²	64.8	32%	0.324	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.3	-173.7	-54	0	0	0	0	113.4	G114 C127 C138	G114-C129 CarbonylContact O-C 3.58Å; G114-C129 WeakPolarHBondContact O-CA 3.34Å; C127-C129 PolarHBondContact O-N 3.27Å; C129-C138 WeakPolarHBondContact CA-SG 3.23Å; C129-C138 HydrophobicContact CB-CB 3.74Å; C129-C138 WeakPolarHBondContact CB-SG 3.37Å; C129-C138 PolarHBondContact N-SG 3.19Å; C129-C138 VanDerWaalsContact N-SG 3.38Å; C129-C138 VanDerWaalsContact SG-CA 3.52Å; C129-C138 WeakPolarHBondContact SG-CB 3.07Å; C129-C138 CovalentContact SG-SG 2.04Å; C129-C138 PolarHBondContact SG-SG 3.08Å
130	R	80.5	Confident	75.9	Confident	87 Å²	87	65.2 Å²	65.2	33%	0.328	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-63.9	144.8	170.5	-174.3	-178.2	-72	-139.9	-0.6	109.2	G114 V116 G132 Y133 G788	G114-R130 WeakPolarHBondContact O-CB 3.39Å; G114-R130 PolarHBondContact O-N 3.09Å; V116-R130 HydrophobicContact CG2-CB 3.93Å; V116-R130 HydrophobicContact CG2-CG 4.49Å; R130-G132 PolarHBondContact O-N 3.08Å; R130-G132 VanDerWaalsContact O-N 3.11Å; R130-Y133 HydrophobicContact CB-CD2 4.47Å; R130-Y133 PolarHBondContact O-N 3.12Å; R130-G788 PolarHBondContact NH1-O 3.39Å
131	A	66.9	Low	75.5	Confident	87 Å²	87	67.9 Å²	67.9	72%	0.719	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	121	172.7	0	0	0	0	0	109.9
132	G	60.2	Low	75.2	Confident	17 Å²	17	66.5 Å²	66.5	18%	0.175	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	122.3	-40.4	-167	0	0	0	0	0	112.7	R130 L142 R161	R130-G132 PolarHBondContact O-N 3.08Å; R130-G132 VanDerWaalsContact O-N 3.11Å; G132-L142 WeakPolarHBondContact O-CB 3.23Å; G132-L142 PolarHBondContact O-N 2.83Å; G132-R161 VanDerWaalsContact CA-NH2 3.28Å; G132-R161 PolarHBondContact O-NH2 3.33Å
133	Y	76.2	Confident	75.1	Confident	54 Å²	54	64.4 Å²	64.4	21%	0.212	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	163.4	-167.5	-65.5	-103.3	0	0	0	113.8	E113 G114 R130 C138 V140 L141	E113-Y133 HydrophobicContact CB-CE1 4.23Å; E113-Y133 WeakPolarHBondContact CB-OH 3.34Å; E113-Y133 PolarHBondContact OE2-OH 2.95Å; G114-Y133 VanDerWaalsContact CA-CD1 3.5Å; R130-Y133 HydrophobicContact CB-CD2 4.47Å; R130-Y133 PolarHBondContact O-N 3.12Å; Y133-C138 VanDerWaalsContact CD1-O 3.28Å; Y133-C138 WeakPolarHBondContact CD1-O 3.46Å; Y133-V140 CarbonylContact C-O 3.45Å; Y133-V140 WeakPolarHBondContact CA-O 3.45Å; Y133-L141 HydrophobicContact CD1-CD1 4.27Å; Y133-L141 HydrophobicContact CD2-CD1 4.3Å; Y133-L141 HydrophobicContact CE1-CD1 4.02Å; Y133-L141 HydrophobicContact CE2-CD1 4.03Å; Y133-L141 HydrophobicContact CG-CD1 4.42Å
134	T	72.5	Confident	75.2	Confident	58 Å²	58	62.3 Å²	62.3	36%	0.356	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	-174.3	176.4	-167.4	0	0	0	0	109.7	C138 D139 V140 L142	T134-C138 CarbonylContact O-C 3.44Å; T134-C138 VanDerWaalsContact O-CA 3.24Å; T134-C138 WeakPolarHBondContact O-CA 3.17Å; T134-D139 PolarHBondContact O-N 2.98Å; T134-V140 HydrophobicContact CG2-CB 3.85Å; T134-V140 HydrophobicContact CG2-CG1 3.86Å; T134-V140 PolarHBondContact N-O 2.79Å; T134-V140 WeakPolarHBondContact O-CB 3.35Å; T134-V140 PolarHBondContact O-N 2.72Å; T134-L142 HydrophobicContact CG2-CB 4.11Å; T134-L142 HydrophobicContact CG2-CD1 3.76Å
135	G	75.9	Confident	75.5	Confident	30 Å²	30	61.2 Å²	61.2	31%	0.309	34%	0.335	S	S	.	.	S	Bend	trans	89.7	162	-174.5	0	0	0	0	0	112.3	R137 C138	G135-R137 PolarHBondContact O-N 3.16Å; G135-C138 PolarHBondContact O-N 2.72Å
136	Y	82.3	Confident	75.1	Confident	136 Å²	136	64.6 Å²	64.6	53%	0.533	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.1	-172.1	-168.7	-108.2	0	0	0	113.4	N124 F125 C127	N124-Y136 PolarHBondContact ND2-OH 3.02Å; N124-Y136 PolarHBondContact OD1-OH 3.3Å; F125-Y136 AromaticContact CE1-CE1 3.98Å; F125-Y136 HydrophobicContact CE1-CE1 3.98Å; F125-Y136 AromaticContact CE2-CD1 3.99Å; F125-Y136 HydrophobicContact CE2-CD1 3.99Å; F125-Y136 AromaticContact CE2-CE1 3.7Å; F125-Y136 HydrophobicContact CE2-CE1 3.7Å; F125-Y136 AromaticContact CZ-CD1 3.8Å; F125-Y136 HydrophobicContact CZ-CD1 3.8Å; F125-Y136 AromaticContact CZ-CE1 3.36Å; F125-Y136 HydrophobicContact CZ-CE1 3.36Å; F125-Y136 PolarHBondContact O-OH 3.17Å; C127-Y136 PolarHBondContact SG-O 2.9Å
137	R	85.9	Confident	74.5	Confident	125 Å²	125	70.1 Å²	70.1	47%	0.472	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	11.1	176.9	-58.6	179.1	170.1	-137	-3	112.1	P109 S111 F125 G135 D139	P109-R137 WeakPolarHBondContact O-CD 3.42Å; P109-R137 VanDerWaalsContact O-CG 3.24Å; P109-R137 WeakPolarHBondContact O-CG 3.4Å; P109-R137 PolarHBondContact O-NH1 3.34Å; S111-R137 WeakPolarHBondContact CA-O 3.42Å; S111-R137 WeakPolarHBondContact CB-O 3.48Å; S111-R137 PolarHBondContact N-O 3.28Å; F125-R137 HydrophobicContact CE2-CG 4.33Å; F125-R137 HydrophobicContact CZ-CG 4.38Å; G135-R137 PolarHBondContact O-N 3.16Å; R137-D139 HydrophobicContact CB-CB 4.16Å; R137-D139 PolarHBondContact N-OD1 3.4Å; R137-D139 PolarHBondContact O-N 3.37Å
138	C	87.1	Confident	73.9	Confident	0 Å²	0	78 Å²	78	0%	0	42%	0.415	C	S	.	.	S	Bend	trans	53.6	33.7	-168.9	-50.6	0	0	0	0	113.2	S111 G114 C127 C129 Y133 T134 G135	S111-C138 VanDerWaalsContact CB-O 3.24Å; S111-C138 WeakPolarHBondContact CB-O 3.42Å; S111-C138 PolarHBondContact OG-O 3.03Å; G114-C138 WeakPolarHBondContact CA-O 3.29Å; G114-C138 WeakPolarHBondContact O-CB 3.47Å; C127-C138 HydrophobicContact CB-CB 4.49Å; C127-C138 WeakPolarHBondContact CB-SG 3.45Å; C127-C138 PolarHBondContact O-SG 3.15Å; C127-C138 VanDerWaalsContact O-SG 3.38Å; C129-C138 WeakPolarHBondContact CA-SG 3.23Å; C129-C138 HydrophobicContact CB-CB 3.74Å; C129-C138 WeakPolarHBondContact CB-SG 3.37Å; C129-C138 PolarHBondContact N-SG 3.19Å; C129-C138 VanDerWaalsContact N-SG 3.38Å; C129-C138 VanDerWaalsContact SG-CA 3.52Å; C129-C138 WeakPolarHBondContact SG-CB 3.07Å; C129-C138 CovalentContact SG-SG 2.04Å; C129-C138 PolarHBondContact SG-SG 3.08Å; Y133-C138 VanDerWaalsContact CD1-O 3.28Å; Y133-C138 WeakPolarHBondContact CD1-O 3.46Å; T134-C138 CarbonylContact O-C 3.44Å; T134-C138 VanDerWaalsContact O-CA 3.24Å; T134-C138 WeakPolarHBondContact O-CA 3.17Å; G135-C138 PolarHBondContact O-N 2.72Å
139	D	84.2	Confident	73.6	Confident	94 Å²	94	76.4 Å²	76.4	50%	0.503	41%	0.406	S	S	.	.			trans	-93.8	-11.8	-174.8	52.3	-33.1	0	0	0	113.3	T134 R137	T134-D139 PolarHBondContact O-N 2.98Å; R137-D139 HydrophobicContact CB-CB 4.16Å; R137-D139 PolarHBondContact N-OD1 3.4Å; R137-D139 PolarHBondContact O-N 3.37Å
140	V	75.5	Confident	73.7	Confident	73 Å²	73	75.3 Å²	75.3	44%	0.442	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.1	179.7	-177.9	0	0	0	0	109.7	Y133 T134 L142	Y133-V140 CarbonylContact C-O 3.45Å; Y133-V140 WeakPolarHBondContact CA-O 3.45Å; T134-V140 HydrophobicContact CG2-CB 3.85Å; T134-V140 HydrophobicContact CG2-CG1 3.86Å; T134-V140 PolarHBondContact N-O 2.79Å; T134-V140 WeakPolarHBondContact O-CB 3.35Å; T134-V140 PolarHBondContact O-N 2.72Å; V140-L142 PolarHBondContact O-N 3.3Å
141	L	64.6	Low	73.9	Confident	120 Å²	120	73.6 Å²	73.6	63%	0.628	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	123.4	169.5	-165.9	73.3	0	0	0	109.3	Y133 D143	Y133-L141 HydrophobicContact CD1-CD1 4.27Å; Y133-L141 HydrophobicContact CD2-CD1 4.3Å; Y133-L141 HydrophobicContact CE1-CD1 4.02Å; Y133-L141 HydrophobicContact CE2-CD1 4.03Å; Y133-L141 HydrophobicContact CG-CD1 4.42Å; L141-D143 PolarHBondContact O-N 3.16Å; L141-D143 VanDerWaalsContact O-N 3.15Å
142	L	60.3	Low	74.8	Confident	67 Å²	67	72.6 Å²	72.6	35%	0.351	38%	0.382	S	S	.	.			trans	-81.8	93.6	-177.9	-173.4	84.7	0	0	0	110.3	G132 T134 V140 F144	G132-L142 WeakPolarHBondContact O-CB 3.23Å; G132-L142 PolarHBondContact O-N 2.83Å; T134-L142 HydrophobicContact CG2-CB 4.11Å; T134-L142 HydrophobicContact CG2-CD1 3.76Å; V140-L142 PolarHBondContact O-N 3.3Å; L142-F144 PolarHBondContact O-N 2.69Å
143	D	61.2	Low	75.9	Confident	79 Å²	79	77.7 Å²	77.7	42%	0.422	41%	0.406	S	S	.	.			trans	-68.1	97.1	165.8	177.9	19.6	0	0	0	110.6	L141 C145 S146	L141-D143 PolarHBondContact O-N 3.16Å; L141-D143 VanDerWaalsContact O-N 3.15Å; D143-C145 PolarHBondContact O-N 3.13Å; D143-C145 WeakPolarHBondContact OD1-CA 3.41Å; D143-C145 WeakPolarHBondContact OD1-CB 3.37Å; D143-C145 PolarHBondContact OD1-N 3.32Å; D143-S146 PolarHBondContact O-N 2.93Å; D143-S146 PolarHBondContact OD1-N 2.9Å; D143-S146 WeakPolarHBondContact OD2-CB 3.4Å; D143-S146 PolarHBondContact OD2-N 3.1Å; D143-S146 VanDerWaalsContact OD2-N 3.08Å; D143-S146 PolarHBondContact OD2-OG 2.9Å
144	F	62.8	Low	76.2	Confident	30 Å²	30	75.7 Å²	75.7	13%	0.132	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-54	-34.1	172.8	176.8	-105.1	0	0	0	112.4	L142 P149 C156 R161 F173	L142-F144 PolarHBondContact O-N 2.69Å; F144-P149 HydrophobicContact CD1-CG 3.86Å; F144-P149 HydrophobicContact CD2-CG 4.33Å; F144-P149 HydrophobicContact CE1-CB 4.46Å; F144-P149 HydrophobicContact CE1-CG 3.55Å; F144-P149 HydrophobicContact CE2-CB 4.3Å; F144-P149 HydrophobicContact CE2-CG 4.07Å; F144-P149 HydrophobicContact CG-CG 4.23Å; F144-P149 HydrophobicContact CZ-CB 4.1Å; F144-P149 HydrophobicContact CZ-CG 3.67Å; F144-P149 WeakPolarHBondContact O-CD 3.2Å; F144-P149 WeakPolarHBondContact O-CG 3.35Å; F144-C156 WeakPolarHBondContact CD1-SG 3.1Å; F144-R161 HydrophobicContact CB-CG 4.22Å; F144-R161 HydrophobicContact CD2-CB 4.13Å; F144-R161 VanDerWaalsContact CE1-C 3.42Å; F144-R161 HydrophobicContact CE2-CB 4.42Å; F144-R161 HydrophobicContact CG-CB 4.18Å; F144-R161 HydrophobicContact CG-CG 4.39Å; F144-R161 WeakPolarHBondContact CZ-O 3.44Å; F144-F173 HydrophobicContact CE2-CE1 4.13Å; F144-F173 HydrophobicContact CZ-CE1 4.18Å
145	C	71.3	Confident	76.8	Confident	33 Å²	33	77.1 Å²	77.1	22%	0.223	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-85.3	-20.7	-173.4	-63	0	0	0	0	114.7	D143 Q147 K148 C156 G158	D143-C145 PolarHBondContact O-N 3.13Å; D143-C145 WeakPolarHBondContact OD1-CA 3.41Å; D143-C145 WeakPolarHBondContact OD1-CB 3.37Å; D143-C145 PolarHBondContact OD1-N 3.32Å; C145-Q147 PolarHBondContact O-N 2.85Å; C145-Q147 VanDerWaalsContact O-N 3.12Å; C145-K148 PolarHBondContact O-N 3.48Å; C145-C156 WeakPolarHBondContact CA-SG 3.46Å; C145-C156 HydrophobicContact CB-CB 3.87Å; C145-C156 WeakPolarHBondContact CB-SG 3.45Å; C145-C156 WeakPolarHBondContact SG-CB 3.5Å; C145-C156 CovalentContact SG-SG 2.04Å; C145-C156 PolarHBondContact SG-SG 2.86Å; C145-G158 WeakPolarHBondContact SG-CA 3.35Å; C145-G158 PolarHBondContact SG-N 2.92Å
146	S	70	Confident	77.1	Confident	95 Å²	95	77.5 Å²	77.5	66%	0.664	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-55.4	-27.7	172.6	-87.8	0	0	0	0	113.4	D143	D143-S146 PolarHBondContact O-N 2.93Å; D143-S146 PolarHBondContact OD1-N 2.9Å; D143-S146 WeakPolarHBondContact OD2-CB 3.4Å; D143-S146 PolarHBondContact OD2-N 3.1Å; D143-S146 VanDerWaalsContact OD2-N 3.08Å; D143-S146 PolarHBondContact OD2-OG 2.9Å
147	Q	69.7	Low	76.6	Confident	164 Å²	164	72 Å²	72	77%	0.766	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-85.6	-3.3	177.6	-59.5	-166.1	13.2	0	0	114.2	C145	C145-Q147 PolarHBondContact O-N 2.85Å; C145-Q147 VanDerWaalsContact O-N 3.12Å
148	K	76.9	Confident	75.2	Confident	181 Å²	181	67.3 Å²	67.3	79%	0.787	38%	0.379	S	S	*	.			trans	48.5	56.7	-171.4	-58	-176.6	-178.8	-177.8	0	113	C145 C150	C145-K148 PolarHBondContact O-N 3.48Å; K148-C150 PolarHBondContact O-N 2.92Å
149	P	78.9	Confident	73.5	Confident	26 Å²	26	72.6 Å²	72.6	17%	0.169	40%	0.402	C	S	.	.			trans	-68.5	-19.5	-172.1	30.6	-37.8	0	0	0	113.5	F144 F173	F144-P149 HydrophobicContact CD1-CG 3.86Å; F144-P149 HydrophobicContact CD2-CG 4.33Å; F144-P149 HydrophobicContact CE1-CB 4.46Å; F144-P149 HydrophobicContact CE1-CG 3.55Å; F144-P149 HydrophobicContact CE2-CB 4.3Å; F144-P149 HydrophobicContact CE2-CG 4.07Å; F144-P149 HydrophobicContact CG-CG 4.23Å; F144-P149 HydrophobicContact CZ-CB 4.1Å; F144-P149 HydrophobicContact CZ-CG 3.67Å; F144-P149 WeakPolarHBondContact O-CD 3.2Å; F144-P149 WeakPolarHBondContact O-CG 3.35Å; P149-F173 HydrophobicContact CB-CD1 3.79Å; P149-F173 HydrophobicContact CB-CE1 3.94Å; P149-F173 WeakPolarHBondContact O-CB 3.25Å; P149-F173 WeakPolarHBondContact O-CD1 3.18Å
150	C	84.7	Confident	72	Confident	25 Å²	25	72 Å²	72	17%	0.169	40%	0.398	C	S	.	.			trans	-84.9	116.8	-174.4	-48.1	0	0	0	0	112.6	K148 G154 C156 C163	K148-C150 PolarHBondContact O-N 2.92Å; C150-G154 WeakPolarHBondContact CB-O 3.44Å; C150-C156 WeakPolarHBondContact SG-CA 3.22Å; C150-C156 WeakPolarHBondContact SG-CB 3.16Å; C150-C163 WeakPolarHBondContact CA-SG 3.07Å; C150-C163 HydrophobicContact CB-CB 3.71Å; C150-C163 WeakPolarHBondContact CB-SG 3.09Å; C150-C163 VanDerWaalsContact SG-CA 3.55Å; C150-C163 WeakPolarHBondContact SG-CB 3.26Å; C150-C163 CovalentContact SG-SG 2.03Å; C150-C163 PolarHBondContact SG-SG 2.85Å
151	S	85.3	Confident	71.5	Confident	52 Å²	52	72.8 Å²	72.8	36%	0.364	39%	0.393	S	S	.	.			trans	-77.2	171.4	170.4	-62.3	0	0	0	0	111.8	N153 G154 F173	S151-N153 VanDerWaalsContact C-N 3.27Å; S151-N153 PolarHBondContact O-N 3.1Å; S151-N153 VanDerWaalsContact O-N 3.11Å; S151-G154 PolarHBondContact O-N 3.36Å; S151-F173 VanDerWaalsContact CB-O 3.3Å; S151-F173 WeakPolarHBondContact CB-O 3.19Å; S151-F173 PolarHBondContact N-O 3.28Å
152	N	85.7	Confident	71.8	Confident	66 Å²	66	69.8 Å²	69.8	35%	0.353	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	43.1	169.4	-58.1	-49	0	0	0	114.5	G154 Y169 C174	N152-G154 PolarHBondContact O-N 3.3Å; N152-Y169 HydrophobicContact CB-CD1 3.58Å; N152-Y169 HydrophobicContact CB-CD2 3.79Å; N152-Y169 HydrophobicContact CB-CE1 3.66Å; N152-Y169 HydrophobicContact CB-CE2 3.87Å; N152-Y169 HydrophobicContact CB-CG 3.64Å; N152-Y169 VanDerWaalsContact ND2-CD1 3.33Å; N152-Y169 WeakPolarHBondContact ND2-CD1 3.14Å; N152-Y169 WeakPolarHBondContact ND2-CE1 3.42Å; N152-C174 PolarHBondContact ND2-O 2.96Å
153	N	83.8	Confident	72.7	Confident	124 Å²	124	67 Å²	67	66%	0.663	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	22.7	-178	-61.2	-12.5	0	0	0	115.5	S151 Q166	S151-N153 VanDerWaalsContact C-N 3.27Å; S151-N153 PolarHBondContact O-N 3.1Å; S151-N153 VanDerWaalsContact O-N 3.11Å; N153-Q166 VanDerWaalsContact CB-CD 3.46Å; N153-Q166 HydrophobicContact CB-CG 4.22Å; N153-Q166 WeakPolarHBondContact O-CG 3.37Å; N153-Q166 PolarHBondContact O-NE2 3.42Å
154	G	82.5	Confident	73.7	Confident	12 Å²	12	67.6 Å²	67.6	12%	0.124	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-62.3	137.5	173.4	0	0	0	0	0	112.6	C150 S151 N152 C156 I164	C150-G154 WeakPolarHBondContact CB-O 3.44Å; S151-G154 PolarHBondContact O-N 3.36Å; N152-G154 PolarHBondContact O-N 3.3Å; G154-C156 PolarHBondContact O-N 2.84Å; G154-I164 CarbonylContact C-O 3.55Å; G154-I164 WeakPolarHBondContact CA-O 3.03Å
155	T	84.7	Confident	74.6	Confident	88 Å²	88	68.1 Å²	68.1	54%	0.54	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.2	178.6	-60	0	0	0	0	110	I164	T155-I164 PolarHBondContact N-O 3.45Å; T155-I164 PolarHBondContact O-N 3.27Å
156	C	80.8	Confident	75	Confident	37 Å²	37	71.1 Å²	71.1	25%	0.25	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.5	179.2	-170.9	0	0	0	0	112.1	F144 C145 C150 G154	F144-C156 WeakPolarHBondContact CD1-SG 3.1Å; C145-C156 WeakPolarHBondContact CA-SG 3.46Å; C145-C156 HydrophobicContact CB-CB 3.87Å; C145-C156 WeakPolarHBondContact CB-SG 3.45Å; C145-C156 WeakPolarHBondContact SG-CB 3.5Å; C145-C156 CovalentContact SG-SG 2.04Å; C145-C156 PolarHBondContact SG-SG 2.86Å; C150-C156 WeakPolarHBondContact SG-CA 3.22Å; C150-C156 WeakPolarHBondContact SG-CB 3.16Å; G154-C156 PolarHBondContact O-N 2.84Å
157	V	72.2	Confident	75.2	Confident	20 Å²	20	74.7 Å²	74.7	12%	0.121	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	92.1	178.5	-174.7	0	0	0	0	109.9	F159 L160 R161 V162 I164	V157-F159 VanDerWaalsContact C-N 3.3Å; V157-F159 HydrophobicContact CG1-CD1 3.82Å; V157-F159 HydrophobicContact CG1-CE1 3.31Å; V157-F159 HydrophobicContact CG1-CE2 4.26Å; V157-F159 HydrophobicContact CG1-CG 4.46Å; V157-F159 HydrophobicContact CG1-CZ 3.54Å; V157-F159 PolarHBondContact O-N 2.83Å; V157-L160 HydrophobicContact CB-CB 4.33Å; V157-L160 HydrophobicContact CG1-CB 3.98Å; V157-L160 HydrophobicContact CG1-CD1 3.99Å; V157-L160 HydrophobicContact CG1-CG 3.87Å; V157-L160 PolarHBondContact O-N 2.84Å; V157-R161 PolarHBondContact O-N 3.17Å; V157-R161 VanDerWaalsContact O-N 3.07Å; V157-V162 HydrophobicContact CB-CG1 4.31Å; V157-V162 PolarHBondContact N-O 3.34Å; V157-I164 HydrophobicContact CG2-CD1 3.57Å; V157-I164 HydrophobicContact CG2-CG1 3.84Å
158	G	56.2	Low	75.3	Confident	28 Å²	28	67.5 Å²	67.5	29%	0.289	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-35.5	-166.7	0	0	0	0	0	115	C145 R161	C145-G158 WeakPolarHBondContact SG-CA 3.35Å; C145-G158 PolarHBondContact SG-N 2.92Å; G158-R161 PolarHBondContact O-N 3.1Å
159	F	52.1	Low	75.6	Confident	111 Å²	111	62.7 Å²	62.7	49%	0.487	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-18	179.9	73	-94.5	0	0	0	113.9	V157 R753	V157-F159 VanDerWaalsContact C-N 3.3Å; V157-F159 HydrophobicContact CG1-CD1 3.82Å; V157-F159 HydrophobicContact CG1-CE1 3.31Å; V157-F159 HydrophobicContact CG1-CE2 4.26Å; V157-F159 HydrophobicContact CG1-CG 4.46Å; V157-F159 HydrophobicContact CG1-CZ 3.54Å; V157-F159 PolarHBondContact O-N 2.83Å; F159-R753 HydrophobicContact CE1-CB 4.33Å; F159-R753 HydrophobicContact CE2-CB 3.84Å; F159-R753 HydrophobicContact CE2-CG 3.62Å; F159-R753 HydrophobicContact CZ-CB 3.46Å; F159-R753 VanDerWaalsContact CZ-CB 3.46Å; F159-R753 HydrophobicContact CZ-CG 3.55Å
160	L	52.4	Low	75.5	Confident	80 Å²	80	65.1 Å²	65.1	42%	0.419	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-13.2	171.5	-70.4	-175.2	0	0	0	112.8	V157 V162	V157-L160 HydrophobicContact CB-CB 4.33Å; V157-L160 HydrophobicContact CG1-CB 3.98Å; V157-L160 HydrophobicContact CG1-CD1 3.99Å; V157-L160 HydrophobicContact CG1-CG 3.87Å; V157-L160 PolarHBondContact O-N 2.84Å; L160-V162 HydrophobicContact CB-CB 4.22Å; L160-V162 HydrophobicContact CB-CG1 3.64Å; L160-V162 HydrophobicContact CD1-CG1 3.93Å; L160-V162 HydrophobicContact CG-CG1 4.45Å; L160-V162 PolarHBondContact O-N 2.81Å
161	R	66.3	Low	74.9	Confident	90 Å²	90	65.1 Å²	65.1	34%	0.34	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	38.7	-168.7	-60	178	163.5	-166.6	-6.3	112.7	G132 F144 V157 G158	G132-R161 VanDerWaalsContact CA-NH2 3.28Å; G132-R161 PolarHBondContact O-NH2 3.33Å; F144-R161 HydrophobicContact CB-CG 4.22Å; F144-R161 HydrophobicContact CD2-CB 4.13Å; F144-R161 VanDerWaalsContact CE1-C 3.42Å; F144-R161 HydrophobicContact CE2-CB 4.42Å; F144-R161 HydrophobicContact CG-CB 4.18Å; F144-R161 HydrophobicContact CG-CG 4.39Å; F144-R161 WeakPolarHBondContact CZ-O 3.44Å; V157-R161 PolarHBondContact O-N 3.17Å; V157-R161 VanDerWaalsContact O-N 3.07Å; G158-R161 PolarHBondContact O-N 3.1Å
162	V	68.9	Low	74.4	Confident	57 Å²	57	68.8 Å²	68.8	35%	0.345	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.9	-177.2	82.5	0	0	0	0	111.6	V157 L160	V157-V162 HydrophobicContact CB-CG1 4.31Å; V157-V162 PolarHBondContact N-O 3.34Å; L160-V162 HydrophobicContact CB-CB 4.22Å; L160-V162 HydrophobicContact CB-CG1 3.64Å; L160-V162 HydrophobicContact CD1-CG1 3.93Å; L160-V162 HydrophobicContact CG-CG1 4.45Å; L160-V162 PolarHBondContact O-N 2.81Å
163	C	80.5	Confident	74.3	Confident	9 Å²	9	69.1 Å²	69.1	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.1	169.4	-65	0	0	0	0	110.5	C150 C165 E172 C174	C150-C163 WeakPolarHBondContact CA-SG 3.07Å; C150-C163 HydrophobicContact CB-CB 3.71Å; C150-C163 WeakPolarHBondContact CB-SG 3.09Å; C150-C163 VanDerWaalsContact SG-CA 3.55Å; C150-C163 WeakPolarHBondContact SG-CB 3.26Å; C150-C163 CovalentContact SG-SG 2.03Å; C150-C163 PolarHBondContact SG-SG 2.85Å; C163-C165 PolarHBondContact O-N 3.28Å; C163-E172 WeakPolarHBondContact CB-O 3.08Å; C163-C174 WeakPolarHBondContact CB-SG 3.02Å
164	I	81	Confident	74.5	Confident	92 Å²	92	63.2 Å²	63.2	47%	0.472	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	107.6	169.3	-62	177.1	0	0	0	107.8	G154 T155 V157	G154-I164 CarbonylContact C-O 3.55Å; G154-I164 WeakPolarHBondContact CA-O 3.03Å; T155-I164 PolarHBondContact N-O 3.45Å; T155-I164 PolarHBondContact O-N 3.27Å; V157-I164 HydrophobicContact CG2-CD1 3.57Å; V157-I164 HydrophobicContact CG2-CG1 3.84Å
165	C	83.1	Confident	74.6	Confident	40 Å²	40	67 Å²	67	27%	0.27	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-77.3	143.2	-174.5	-51.2	0	0	0	0	113	C163 Y169 C174	C163-C165 PolarHBondContact O-N 3.28Å; C165-Y169 WeakPolarHBondContact CB-O 3.04Å; C165-C174 WeakPolarHBondContact CA-SG 3.3Å; C165-C174 HydrophobicContact CB-CB 3.74Å; C165-C174 WeakPolarHBondContact CB-SG 3.34Å; C165-C174 PolarHBondContact N-SG 3.08Å; C165-C174 VanDerWaalsContact N-SG 3.41Å; C165-C174 WeakPolarHBondContact SG-CA 3.15Å; C165-C174 WeakPolarHBondContact SG-CB 3.24Å; C165-C174 CovalentContact SG-SG 2.04Å; C165-C174 PolarHBondContact SG-SG 3.42Å
166	Q	79	Confident	74.4	Confident	96 Å²	96	67 Å²	67	45%	0.449	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-68.2	156.4	169.4	-64	-162	-12.1	0	0	111.1	N153 G168 Y169	N153-Q166 VanDerWaalsContact CB-CD 3.46Å; N153-Q166 HydrophobicContact CB-CG 4.22Å; N153-Q166 WeakPolarHBondContact O-CG 3.37Å; N153-Q166 PolarHBondContact O-NE2 3.42Å; Q166-G168 PolarHBondContact O-N 3.07Å; Q166-G168 VanDerWaalsContact O-N 3.12Å; Q166-Y169 PolarHBondContact O-N 2.84Å
167	Q	73.4	Confident	74.1	Confident	171 Å²	171	71.3 Å²	71.3	80%	0.799	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	118.2	-176	-169.7	172	15.5	0	0	110.9	V183	Q167-V183 HydrophobicContact CG-CG1 4.13Å
168	G	73.3	Confident	74	Confident	12 Å²	12	72.1 Å²	72.1	12%	0.124	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.7	-1.2	-173.3	0	0	0	0	0	115.3	Q166 I178	Q166-G168 PolarHBondContact O-N 3.07Å; Q166-G168 VanDerWaalsContact O-N 3.12Å; G168-I178 PolarHBondContact O-N 3.14Å
169	Y	83.1	Confident	74.7	Confident	80 Å²	80	72.6 Å²	72.6	31%	0.314	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.7	177.6	-60	-80.6	0	0	0	113.5	N152 C165 Q166 E176 K177 I178	N152-Y169 HydrophobicContact CB-CD1 3.58Å; N152-Y169 HydrophobicContact CB-CD2 3.79Å; N152-Y169 HydrophobicContact CB-CE1 3.66Å; N152-Y169 HydrophobicContact CB-CE2 3.87Å; N152-Y169 HydrophobicContact CB-CG 3.64Å; N152-Y169 VanDerWaalsContact ND2-CD1 3.33Å; N152-Y169 WeakPolarHBondContact ND2-CD1 3.14Å; N152-Y169 WeakPolarHBondContact ND2-CE1 3.42Å; C165-Y169 WeakPolarHBondContact CB-O 3.04Å; Q166-Y169 PolarHBondContact O-N 2.84Å; Y169-E176 CarbonylContact C-O 3.17Å; Y169-E176 VanDerWaalsContact CA-O 3.25Å; Y169-E176 WeakPolarHBondContact CA-O 3.43Å; Y169-K177 HydrophobicContact CD1-CB 4.49Å; Y169-K177 HydrophobicContact CE1-CB 4.41Å; Y169-K177 HydrophobicContact CE1-CG 4.45Å; Y169-I178 WeakPolarHBondContact O-CD1 3.44Å
170	K	77.1	Confident	75.7	Confident	77 Å²	77	74.4 Å²	74.4	34%	0.335	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	-175.1	176.7	75.3	179.4	-174	81.2	0	111.2	C174 D175 E176 I178	K170-C174 CarbonylContact O-C 3.59Å; K170-C174 VanDerWaalsContact O-C 3.3Å; K170-C174 VanDerWaalsContact O-CA 3.25Å; K170-C174 WeakPolarHBondContact O-CA 3.38Å; K170-D175 PolarHBondContact O-N 3.39Å; K170-E176 WeakPolarHBondContact CE-OE2 3.19Å; K170-E176 HydrophobicContact CG-CB 3.78Å; K170-E176 PolarHBondContact N-O 3.43Å; K170-E176 IonicContact NZ-OE1 2.99Å; K170-E176 IonicContact NZ-OE2 3.61Å; K170-E176 PolarHBondContact NZ-OE2 2.94Å; K170-E176 WeakPolarHBondContact O-CB 3.5Å; K170-E176 PolarHBondContact O-N 2.92Å; K170-I178 HydrophobicContact CB-CD1 4.3Å; K170-I178 HydrophobicContact CB-CG1 3.89Å; K170-I178 HydrophobicContact CD-CG1 4.2Å; K170-I178 HydrophobicContact CG-CG1 4.06Å
171	G	71.5	Confident	76.8	Confident	25 Å²	25	71.8 Å²	71.8	26%	0.258	36%	0.357	S	S	.	.	S	Bend	trans	94.4	159.6	-174.6	0	0	0	0	0	111.8	F173 C174	G171-F173 PolarHBondContact O-N 3.19Å; G171-F173 VanDerWaalsContact O-N 3.14Å; G171-C174 PolarHBondContact O-N 3.08Å
172	E	75.2	Confident	77.4	Confident	130 Å²	130	68 Å²	68	61%	0.607	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.5	-179	-173.3	-179.3	167.8	0	0	112.2	C163	C163-E172 WeakPolarHBondContact CB-O 3.08Å
173	F	84.3	Confident	77.8	Confident	73 Å²	73	67.6 Å²	67.6	32%	0.32	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	14	-177.9	-57.7	-59.9	0	0	0	113.3	F144 P149 S151 G171 D175	F144-F173 HydrophobicContact CE2-CE1 4.13Å; F144-F173 HydrophobicContact CZ-CE1 4.18Å; P149-F173 HydrophobicContact CB-CD1 3.79Å; P149-F173 HydrophobicContact CB-CE1 3.94Å; P149-F173 WeakPolarHBondContact O-CB 3.25Å; P149-F173 WeakPolarHBondContact O-CD1 3.18Å; S151-F173 VanDerWaalsContact CB-O 3.3Å; S151-F173 WeakPolarHBondContact CB-O 3.19Å; S151-F173 PolarHBondContact N-O 3.28Å; G171-F173 PolarHBondContact O-N 3.19Å; G171-F173 VanDerWaalsContact O-N 3.14Å; F173-D175 PolarHBondContact O-N 2.78Å; F173-D175 VanDerWaalsContact O-N 3.16Å
174	C	86.2	Confident	77.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.369	C	S	.	.	S	Bend	trans	55	25.6	-175.5	-56.1	0	0	0	0	114.7	N152 C163 C165 K170 G171	N152-C174 PolarHBondContact ND2-O 2.96Å; C163-C174 WeakPolarHBondContact CB-SG 3.02Å; C165-C174 WeakPolarHBondContact CA-SG 3.3Å; C165-C174 HydrophobicContact CB-CB 3.74Å; C165-C174 WeakPolarHBondContact CB-SG 3.34Å; C165-C174 PolarHBondContact N-SG 3.08Å; C165-C174 VanDerWaalsContact N-SG 3.41Å; C165-C174 WeakPolarHBondContact SG-CA 3.15Å; C165-C174 WeakPolarHBondContact SG-CB 3.24Å; C165-C174 CovalentContact SG-SG 2.04Å; C165-C174 PolarHBondContact SG-SG 3.42Å; K170-C174 CarbonylContact O-C 3.59Å; K170-C174 VanDerWaalsContact O-C 3.3Å; K170-C174 VanDerWaalsContact O-CA 3.25Å; K170-C174 WeakPolarHBondContact O-CA 3.38Å; G171-C174 PolarHBondContact O-N 3.08Å
175	D	85.3	Confident	77.7	Confident	92 Å²	92	75.8 Å²	75.8	49%	0.492	38%	0.384	S	S	.	.			trans	-85.4	-22.6	-175.7	58.3	-52.4	0	0	0	113.3	K170 F173	K170-D175 PolarHBondContact O-N 3.39Å; F173-D175 PolarHBondContact O-N 2.78Å; F173-D175 VanDerWaalsContact O-N 3.16Å
176	E	80.4	Confident	77.7	Confident	87 Å²	87	74.5 Å²	74.5	41%	0.407	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132	175.5	-58.2	-179.3	-142.4	0	0	111.9	Y169 K170	Y169-E176 CarbonylContact C-O 3.17Å; Y169-E176 VanDerWaalsContact CA-O 3.25Å; Y169-E176 WeakPolarHBondContact CA-O 3.43Å; K170-E176 WeakPolarHBondContact CE-OE2 3.19Å; K170-E176 HydrophobicContact CG-CB 3.78Å; K170-E176 PolarHBondContact N-O 3.43Å; K170-E176 IonicContact NZ-OE1 2.99Å; K170-E176 IonicContact NZ-OE2 3.61Å; K170-E176 PolarHBondContact NZ-OE2 2.94Å; K170-E176 WeakPolarHBondContact O-CB 3.5Å; K170-E176 PolarHBondContact O-N 2.92Å
177	K	75.7	Confident	78	Confident	128 Å²	128	70.9 Å²	70.9	56%	0.557	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.3	168.1	-170.6	-173.5	170.5	-169	0	110.1	Y169 E180	Y169-K177 HydrophobicContact CD1-CB 4.49Å; Y169-K177 HydrophobicContact CE1-CB 4.41Å; Y169-K177 HydrophobicContact CE1-CG 4.45Å; K177-E180 IonicContact NZ-OE1 3.04Å; K177-E180 PolarHBondContact NZ-OE1 3.41Å
178	I	68.9	Low	78.5	Confident	37 Å²	37	67.3 Å²	67.3	19%	0.19	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-64.7	131.2	170.1	-63.2	175.5	0	0	0	108.8	G168 Y169 K170 E180 C182 V183	G168-I178 PolarHBondContact O-N 3.14Å; Y169-I178 WeakPolarHBondContact O-CD1 3.44Å; K170-I178 HydrophobicContact CB-CD1 4.3Å; K170-I178 HydrophobicContact CB-CG1 3.89Å; K170-I178 HydrophobicContact CD-CG1 4.2Å; K170-I178 HydrophobicContact CG-CG1 4.06Å; I178-E180 PolarHBondContact O-N 3.03Å; I178-C182 HydrophobicContact CG2-CB 3.73Å; I178-V183 HydrophobicContact CB-CG2 4.44Å; I178-V183 HydrophobicContact CG2-CG2 4.02Å
179	P	72	Confident	78.6	Confident	38 Å²	38	69 Å²	69	25%	0.247	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-56.9	137	171.9	-22.5	32.5	0	0	0	110.9	A181 C182 V183 P195	P179-A181 PolarHBondContact O-N 3.35Å; P179-C182 WeakPolarHBondContact O-CA 3.5Å; P179-C182 WeakPolarHBondContact O-CB 3.49Å; P179-C182 PolarHBondContact O-N 2.89Å; P179-V183 PolarHBondContact O-N 3.45Å; P179-P195 HydrophobicContact CB-CB 4.06Å; P179-P195 HydrophobicContact CG-CB 3.71Å; P179-P195 HydrophobicContact CG-CG 4.06Å
180	E	73.2	Confident	78.3	Confident	148 Å²	148	73.2 Å²	73.2	69%	0.692	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-55.6	-33.7	-173.4	-77.1	156.6	-158.1	0	0	113.1	K177 I178 C182 V183	K177-E180 IonicContact NZ-OE1 3.04Å; K177-E180 PolarHBondContact NZ-OE1 3.41Å; I178-E180 PolarHBondContact O-N 3.03Å; E180-C182 PolarHBondContact O-N 3.16Å; E180-V183 PolarHBondContact O-N 3.39Å
181	A	75.5	Confident	78.4	Confident	26 Å²	26	70.1 Å²	70.1	22%	0.215	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-62.9	-19.5	173.8	0	0	0	0	0	115.5	P179 L202 Y203	P179-A181 PolarHBondContact O-N 3.35Å; A181-L202 HydrophobicContact CB-CB 3.67Å; A181-L202 WeakPolarHBondContact CB-O 3.27Å; A181-Y203 HydrophobicContact CB-CD1 4.36Å; A181-Y203 WeakPolarHBondContact O-CD1 3.46Å
182	C	78.9	Confident	79	Confident	9 Å²	9	73.7 Å²	73.7	6%	0.061	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-102.1	-7.7	179.4	-73.6	0	0	0	0	113.7	I178 P179 E180 S184 K185 C193	I178-C182 HydrophobicContact CG2-CB 3.73Å; P179-C182 WeakPolarHBondContact O-CA 3.5Å; P179-C182 WeakPolarHBondContact O-CB 3.49Å; P179-C182 PolarHBondContact O-N 2.89Å; E180-C182 PolarHBondContact O-N 3.16Å; C182-S184 PolarHBondContact O-N 3.06Å; C182-K185 PolarHBondContact O-N 3.1Å; C182-C193 WeakPolarHBondContact CA-SG 3.46Å; C182-C193 HydrophobicContact CB-CB 3.75Å; C182-C193 WeakPolarHBondContact CB-SG 3.41Å; C182-C193 WeakPolarHBondContact SG-CB 3.46Å; C182-C193 PolarHBondContact SG-O 2.74Å; C182-C193 VanDerWaalsContact SG-O 3.39Å; C182-C193 CovalentContact SG-SG 2.04Å; C182-C193 PolarHBondContact SG-SG 2.04Å
183	V	76.5	Confident	79.5	Confident	49 Å²	49	68.8 Å²	68.8	30%	0.297	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.6	-178	175.5	0	0	0	0	112.2	Q167 I178 P179 E180 K185	Q167-V183 HydrophobicContact CG-CG1 4.13Å; I178-V183 HydrophobicContact CB-CG2 4.44Å; I178-V183 HydrophobicContact CG2-CG2 4.02Å; P179-V183 PolarHBondContact O-N 3.45Å; E180-V183 PolarHBondContact O-N 3.39Å; V183-K185 PolarHBondContact O-N 2.91Å
184	S	78.9	Confident	79.3	Confident	93 Å²	93	67.6 Å²	67.6	65%	0.65	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	2.8	174.8	53.7	0	0	0	0	114.8	C182	C182-S184 PolarHBondContact O-N 3.06Å
185	K	79.5	Confident	78.8	Confident	180 Å²	180	71.1 Å²	71.1	78%	0.783	37%	0.374	S	S	*	.			trans	47.2	55.7	-173.9	-59.1	-179.3	-179.4	178	0	112.8	C182 V183 C187	C182-K185 PolarHBondContact O-N 3.1Å; V183-K185 PolarHBondContact O-N 2.91Å; K185-C187 PolarHBondContact O-N 3.25Å; K185-C187 VanDerWaalsContact O-N 3.09Å
186	P	83.9	Confident	78.1	Confident	14 Å²	14	68.2 Å²	68.2	9%	0.091	37%	0.366	C	S	.	.			trans	-68.7	-11.5	-171	29.8	-36.8	0	0	0	114.5	Y203 N215	P186-Y203 HydrophobicContact CB-CD1 4.18Å; P186-Y203 HydrophobicContact CB-CD2 4.06Å; P186-Y203 HydrophobicContact CB-CE1 3.8Å; P186-Y203 HydrophobicContact CB-CE2 3.7Å; P186-Y203 HydrophobicContact CB-CG 4.31Å; P186-Y203 HydrophobicContact CG-CD1 3.76Å; P186-Y203 HydrophobicContact CG-CD2 3.64Å; P186-Y203 HydrophobicContact CG-CE1 3.93Å; P186-Y203 HydrophobicContact CG-CE2 3.83Å; P186-Y203 HydrophobicContact CG-CG 3.63Å; P186-N215 VanDerWaalsContact O-CB 3.25Å; P186-N215 WeakPolarHBondContact O-CB 3.39Å; P186-N215 VanDerWaalsContact O-CG 3.31Å; P186-N215 PolarHBondContact O-ND2 3.31Å
187	C	86.2	Confident	77.5	Confident	20 Å²	20	72.7 Å²	72.7	14%	0.135	38%	0.379	C	S	.	.			trans	-94.9	118.3	-176.9	-49.6	0	0	0	0	111	K185 G191 C193 C205	K185-C187 PolarHBondContact O-N 3.25Å; K185-C187 VanDerWaalsContact O-N 3.09Å; C187-G191 WeakPolarHBondContact CB-O 3.42Å; C187-C193 VanDerWaalsContact SG-CB 3.54Å; C187-C205 WeakPolarHBondContact CA-SG 3.44Å; C187-C205 HydrophobicContact CB-CB 3.72Å; C187-C205 WeakPolarHBondContact CB-SG 3.47Å; C187-C205 WeakPolarHBondContact SG-CA 3.38Å; C187-C205 WeakPolarHBondContact SG-CB 3.15Å; C187-C205 CovalentContact SG-SG 2.03Å; C187-C205 PolarHBondContact SG-SG 2.87Å
188	L	83.2	Confident	76.7	Confident	96 Å²	96	68.4 Å²	68.4	50%	0.503	37%	0.365	S	S	.	.			trans	-84.3	173	175.9	-53.8	172.4	0	0	0	110.5	E190 G191 N215 C216	L188-E190 VanDerWaalsContact C-N 3.26Å; L188-E190 PolarHBondContact O-N 3.5Å; L188-E190 VanDerWaalsContact O-N 3.15Å; L188-G191 PolarHBondContact O-N 3.44Å; L188-G191 VanDerWaalsContact O-N 3.17Å; L188-N215 VanDerWaalsContact CB-O 3.23Å; L188-N215 WeakPolarHBondContact CB-O 3.39Å; L188-N215 WeakPolarHBondContact CG-O 3.28Å; L188-N215 PolarHBondContact N-O 2.95Å; L188-C216 VanDerWaalsContact O-CB 3.31Å; L188-C216 WeakPolarHBondContact O-CB 3.09Å
189	N	75.7	Confident	76.3	Confident	48 Å²	48	70.2 Å²	70.2	26%	0.257	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	47.1	174.4	-59.1	-49.8	0	0	0	113.9	G191 T211 C216 G217 K219	N189-G191 PolarHBondContact O-N 3.06Å; N189-G191 VanDerWaalsContact O-N 3.16Å; N189-T211 HydrophobicContact CB-CG2 3.68Å; N189-C216 PolarHBondContact ND2-O 3.08Å; N189-G217 PolarHBondContact ND2-O 3.4Å; N189-K219 WeakPolarHBondContact OD1-CE 3.14Å
190	E	75.7	Confident	75.9	Confident	168 Å²	168	73 Å²	73	79%	0.785	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	20	175.4	-63.9	159.3	-129.2	0	0	115.8	L188 L208	L188-E190 VanDerWaalsContact C-N 3.26Å; L188-E190 PolarHBondContact O-N 3.5Å; L188-E190 VanDerWaalsContact O-N 3.15Å; E190-L208 HydrophobicContact CB-CD1 3.53Å; E190-L208 HydrophobicContact CB-CG 4.22Å
191	G	79.4	Confident	75.6	Confident	11 Å²	11	70.2 Å²	70.2	11%	0.113	38%	0.375	C	S	.	.			trans	-67	137.5	173.3	0	0	0	0	0	113.2	C187 L188 N189 D206	C187-G191 WeakPolarHBondContact CB-O 3.42Å; L188-G191 PolarHBondContact O-N 3.44Å; L188-G191 VanDerWaalsContact O-N 3.17Å; N189-G191 PolarHBondContact O-N 3.06Å; N189-G191 VanDerWaalsContact O-N 3.16Å; G191-D206 CarbonylContact C-O 3.24Å; G191-D206 WeakPolarHBondContact CA-O 3.4Å
192	E	84.6	Confident	75.4	Confident	100 Å²	100	74.7 Å²	74.7	47%	0.467	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.3	178	179.5	-179.3	-171.6	0	0	110.6	L194 D206	E192-L194 HydrophobicContact CG-CD2 3.99Å; E192-L194 HydrophobicContact CG-CG 4.4Å; E192-L194 PolarHBondContact O-N 2.71Å; E192-D206 HydrophobicContact CB-CB 4.16Å; E192-D206 PolarHBondContact N-O 3.07Å; E192-D206 WeakPolarHBondContact O-CB 3.49Å; E192-D206 PolarHBondContact O-N 2.89Å
193	C	84.9	Confident	75.4	Confident	27 Å²	27	76.2 Å²	76.2	18%	0.182	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	108.6	176.5	-166.9	0	0	0	0	111	C182 C187	C182-C193 WeakPolarHBondContact CA-SG 3.46Å; C182-C193 HydrophobicContact CB-CB 3.75Å; C182-C193 WeakPolarHBondContact CB-SG 3.41Å; C182-C193 WeakPolarHBondContact SG-CB 3.46Å; C182-C193 PolarHBondContact SG-O 2.74Å; C182-C193 VanDerWaalsContact SG-O 3.39Å; C182-C193 CovalentContact SG-SG 2.04Å; C182-C193 PolarHBondContact SG-SG 2.04Å; C187-C193 VanDerWaalsContact SG-CB 3.54Å
194	L	81.9	Confident	75.8	Confident	49 Å²	49	77.3 Å²	77.3	26%	0.257	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145	177.8	-62.4	178.4	0	0	0	111	E192 Y203 F204 D206	E192-L194 HydrophobicContact CG-CD2 3.99Å; E192-L194 HydrophobicContact CG-CG 4.4Å; E192-L194 PolarHBondContact O-N 2.71Å; L194-Y203 WeakPolarHBondContact O-CA 3.34Å; L194-F204 PolarHBondContact N-O 3.03Å; L194-F204 PolarHBondContact O-N 3.05Å; L194-D206 HydrophobicContact CD1-CB 4.04Å; L194-D206 HydrophobicContact CG-CB 4.41Å
195	P	74.8	Confident	76.1	Confident	74 Å²	74	73 Å²	73	48%	0.481	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	143.9	173	24.4	-31.5	0	0	0	111.6	P179 R197	P179-P195 HydrophobicContact CB-CB 4.06Å; P179-P195 HydrophobicContact CG-CB 3.71Å; P179-P195 HydrophobicContact CG-CG 4.06Å; P195-R197 PolarHBondContact O-N 3.26Å
196	G	70	Confident	76.2	Confident	31 Å²	31	65.9 Å²	65.9	32%	0.32	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-55.1	131.4	-178	0	0	0	0	0	115.4	S198 E201 L202	G196-S198 PolarHBondContact O-N 3.47Å; G196-E201 WeakPolarHBondContact CA-O 3.39Å; G196-L202 PolarHBondContact N-O 3.46Å
197	R	67.3	Low	76	Confident	181 Å²	181	67 Å²	67	68%	0.683	35%	0.348	S	S	*	.	S	Bend	trans	-75.6	-14.3	169.7	-68.1	-177	176.5	-119.3	-10.1	113	P195 I298	P195-R197 PolarHBondContact O-N 3.26Å; R197-I298 VanDerWaalsContact CZ-CG2 3.49Å
198	S	59	Low	75.2	Confident	38 Å²	38	70.2 Å²	70.2	27%	0.266	36%	0.363	S	S	.	.	S	Bend	trans	-132.6	156.8	171.9	78	0	0	0	0	110	G196 F200 E201	G196-S198 PolarHBondContact O-N 3.47Å; S198-F200 PolarHBondContact O-N 3.13Å; S198-F200 PolarHBondContact OG-N 3.32Å; S198-E201 PolarHBondContact O-N 2.77Å; S198-E201 PolarHBondContact OG-N 3.21Å
199	P	60.7	Low	74	Confident	74 Å²	74	68.6 Å²	68.6	48%	0.481	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.1	168.5	-24.7	34.8	0	0	0	113.6	I1225 C1226	P199-I1225 HydrophobicContact CG-CG2 4.35Å; P199-C1226 HydrophobicContact CG-CB 4.42Å
200	F	63.8	Low	72.9	Confident	96 Å²	96	67.2 Å²	67.2	42%	0.421	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-39.8	-178.7	100.5	141.8	0	0	0	115.7	S198 P1227 R1228	S198-F200 PolarHBondContact O-N 3.13Å; S198-F200 PolarHBondContact OG-N 3.32Å; F200-P1227 HydrophobicContact CD1-CB 4.46Å; F200-P1227 HydrophobicContact CD1-CG 3.91Å; F200-P1227 HydrophobicContact CD2-CB 3.58Å; F200-P1227 HydrophobicContact CD2-CG 3.43Å; F200-P1227 VanDerWaalsContact CD2-CG 3.43Å; F200-P1227 HydrophobicContact CE1-CB 4.07Å; F200-P1227 HydrophobicContact CE1-CG 3.94Å; F200-P1227 HydrophobicContact CE2-CB 3.14Å; F200-P1227 HydrophobicContact CE2-CG 3.53Å; F200-P1227 HydrophobicContact CG-CB 4.3Å; F200-P1227 HydrophobicContact CG-CG 3.71Å; F200-P1227 HydrophobicContact CZ-CB 3.43Å; F200-P1227 VanDerWaalsContact CZ-CB 3.43Å; F200-P1227 HydrophobicContact CZ-CG 3.8Å; F200-R1228 HydrophobicContact CD1-CB 4.28Å; F200-R1228 HydrophobicContact CD1-CG 4.39Å; F200-R1228 HydrophobicContact CE1-CB 3.61Å; F200-R1228 HydrophobicContact CE1-CG 3.79Å; F200-R1228 HydrophobicContact CZ-CB 4.24Å
201	E	66.6	Low	72.4	Confident	91 Å²	91	60.3 Å²	60.3	43%	0.425	33%	0.33	S	S	.	.			trans	-114.8	64.8	-163.3	-175.1	172.4	-134.4	0	0	106.5	G196 S198 Y203 F204	G196-E201 WeakPolarHBondContact CA-O 3.39Å; S198-E201 PolarHBondContact O-N 2.77Å; S198-E201 PolarHBondContact OG-N 3.21Å; E201-Y203 CarbonylContact C-O 3.43Å; E201-Y203 WeakPolarHBondContact CG-O 3.49Å; E201-Y203 CarbonylContact O-C 3.57Å; E201-Y203 PolarHBondContact O-N 3.4Å; E201-F204 HydrophobicContact CG-CB 4.45Å
202	L	71.2	Confident	72	Confident	119 Å²	119	64.4 Å²	64.4	62%	0.623	35%	0.345	S	S	*	.	S	Bend	trans	-46.5	-38	-165.9	-65	169.3	0	0	0	113.2	A181 G196	A181-L202 HydrophobicContact CB-CB 3.67Å; A181-L202 WeakPolarHBondContact CB-O 3.27Å; G196-L202 PolarHBondContact N-O 3.46Å
203	Y	80.6	Confident	71.3	Confident	42 Å²	42	61.2 Å²	61.2	17%	0.165	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.8	162.3	62.5	-89.4	0	0	0	109.2	A181 P186 L194 E201 N215	A181-Y203 HydrophobicContact CB-CD1 4.36Å; A181-Y203 WeakPolarHBondContact O-CD1 3.46Å; P186-Y203 HydrophobicContact CB-CD1 4.18Å; P186-Y203 HydrophobicContact CB-CD2 4.06Å; P186-Y203 HydrophobicContact CB-CE1 3.8Å; P186-Y203 HydrophobicContact CB-CE2 3.7Å; P186-Y203 HydrophobicContact CB-CG 4.31Å; P186-Y203 HydrophobicContact CG-CD1 3.76Å; P186-Y203 HydrophobicContact CG-CD2 3.64Å; P186-Y203 HydrophobicContact CG-CE1 3.93Å; P186-Y203 HydrophobicContact CG-CE2 3.83Å; P186-Y203 HydrophobicContact CG-CG 3.63Å; L194-Y203 WeakPolarHBondContact O-CA 3.34Å; E201-Y203 CarbonylContact C-O 3.43Å; E201-Y203 WeakPolarHBondContact CG-O 3.49Å; E201-Y203 CarbonylContact O-C 3.57Å; E201-Y203 PolarHBondContact O-N 3.4Å; Y203-N215 PolarHBondContact OH-ND2 3.33Å; Y203-N215 PolarHBondContact OH-OD1 2.8Å
204	F	84.2	Confident	71.1	Confident	71 Å²	71	67.6 Å²	67.6	31%	0.311	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.9	160.8	172	-90.9	0	0	0	108.7	L194 E201 D206	L194-F204 PolarHBondContact N-O 3.03Å; L194-F204 PolarHBondContact O-N 3.05Å; E201-F204 HydrophobicContact CG-CB 4.45Å; F204-D206 HydrophobicContact CE1-CB 4.37Å
205	C	84.6	Confident	71.2	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	114.8	177.2	-66.5	0	0	0	0	111.2	C187 C207 K214 C216	C187-C205 WeakPolarHBondContact CA-SG 3.44Å; C187-C205 HydrophobicContact CB-CB 3.72Å; C187-C205 WeakPolarHBondContact CB-SG 3.47Å; C187-C205 WeakPolarHBondContact SG-CA 3.38Å; C187-C205 WeakPolarHBondContact SG-CB 3.15Å; C187-C205 CovalentContact SG-SG 2.03Å; C187-C205 PolarHBondContact SG-SG 2.87Å; C205-C207 PolarHBondContact O-N 3.22Å; C205-K214 WeakPolarHBondContact CB-O 3.21Å; C205-K214 PolarHBondContact SG-O 3.05Å; C205-C216 WeakPolarHBondContact CB-SG 3.47Å
206	D	81.7	Confident	71.7	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.16	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	92.8	172.9	-178.9	37.6	0	0	0	110.5	G191 E192 L194 F204 K295	G191-D206 CarbonylContact C-O 3.24Å; G191-D206 WeakPolarHBondContact CA-O 3.4Å; E192-D206 HydrophobicContact CB-CB 4.16Å; E192-D206 PolarHBondContact N-O 3.07Å; E192-D206 WeakPolarHBondContact O-CB 3.49Å; E192-D206 PolarHBondContact O-N 2.89Å; L194-D206 HydrophobicContact CD1-CB 4.04Å; L194-D206 HydrophobicContact CG-CB 4.41Å; F204-D206 HydrophobicContact CE1-CB 4.37Å; D206-K295 WeakPolarHBondContact OD1-CE 3.24Å; D206-K295 IonicContact OD1-NZ 3.89Å; D206-K295 PolarHBondContact OD1-NZ 2.92Å; D206-K295 IonicContact OD2-NZ 2.65Å; D206-K295 PolarHBondContact OD2-NZ 2.96Å
207	C	80.5	Confident	72	Confident	36 Å²	36	64.6 Å²	64.6	24%	0.243	35%	0.345	C	S	.	.			trans	-71.3	138.9	-173	-53.6	0	0	0	0	113.1	C205 T211 C216	C205-C207 PolarHBondContact O-N 3.22Å; C207-T211 VanDerWaalsContact CB-O 3.24Å; C207-T211 WeakPolarHBondContact CB-O 3.45Å; C207-C216 WeakPolarHBondContact CA-SG 3.23Å; C207-C216 HydrophobicContact CB-CB 3.78Å; C207-C216 WeakPolarHBondContact CB-SG 3.43Å; C207-C216 WeakPolarHBondContact SG-CA 3.18Å; C207-C216 WeakPolarHBondContact SG-CB 3.38Å; C207-C216 CovalentContact SG-SG 2.04Å; C207-C216 PolarHBondContact SG-SG 3.14Å
208	L	69.5	Low	72	Confident	88 Å²	88	62 Å²	62	46%	0.461	34%	0.339	S	S	.	.			trans	-58.4	155.4	171.1	-75.9	-171.9	0	0	0	112	E190 G210 T211	E190-L208 HydrophobicContact CB-CD1 3.53Å; E190-L208 HydrophobicContact CB-CG 4.22Å; L208-G210 PolarHBondContact O-N 3.01Å; L208-T211 PolarHBondContact N-OG1 3.03Å; L208-T211 PolarHBondContact O-N 3.49Å; L208-T211 PolarHBondContact O-OG1 3.14Å
209	A	57.9	Low	71.9	Confident	63 Å²	63	67.4 Å²	67.4	52%	0.521	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	99.1	-179.3	0	0	0	0	0	111.7	K239 G240	A209-K239 WeakPolarHBondContact CB-O 3.32Å; A209-K239 CarbonylContact O-C 3.13Å; A209-K239 WeakPolarHBondContact O-CB 3.11Å; A209-G240 VanDerWaalsContact C-N 3.35Å; A209-G240 PolarHBondContact O-N 2.04Å
210	G	53.1	Low	71.6	Confident	18 Å²	18	67.1 Å²	67.1	19%	0.186	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.1	7.8	-175.7	0	0	0	0	0	115.2	L208 H220	L208-G210 PolarHBondContact O-N 3.01Å; G210-H220 WeakPolarHBondContact O-CB 3.34Å; G210-H220 PolarHBondContact O-N 3.41Å
211	T	65	Low	70.9	Confident	24 Å²	24	69.4 Å²	69.4	15%	0.147	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.7	166.3	64.3	0	0	0	0	112	N189 C207 L208 F218 K219	N189-T211 HydrophobicContact CB-CG2 3.68Å; C207-T211 VanDerWaalsContact CB-O 3.24Å; C207-T211 WeakPolarHBondContact CB-O 3.45Å; L208-T211 PolarHBondContact N-OG1 3.03Å; L208-T211 PolarHBondContact O-N 3.49Å; L208-T211 PolarHBondContact O-OG1 3.14Å; T211-F218 CarbonylContact C-O 3.3Å; T211-F218 WeakPolarHBondContact CA-O 3.21Å; T211-F218 WeakPolarHBondContact CB-O 3.43Å; T211-K219 HydrophobicContact CG2-CG 4.12Å
212	F	69.6	Low	70	Confident	96 Å²	96	69.1 Å²	69.1	42%	0.421	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	175.7	-174.8	69.4	-88.1	0	0	0	113.6	C216 G217 F218	F212-C216 CarbonylContact O-C 3.54Å; F212-C216 VanDerWaalsContact O-CA 3.28Å; F212-C216 WeakPolarHBondContact O-CA 3.46Å; F212-G217 PolarHBondContact O-N 3.41Å; F212-F218 HydrophobicContact CD1-CB 3.79Å; F212-F218 HydrophobicContact CD2-CB 3.84Å; F212-F218 AromaticContact CD2-CD2 3.7Å; F212-F218 HydrophobicContact CD2-CD2 3.7Å; F212-F218 HydrophobicContact CD2-CG 4.11Å; F212-F218 HydrophobicContact CE1-CB 3.53Å; F212-F218 HydrophobicContact CE2-CB 3.58Å; F212-F218 AromaticContact CE2-CD2 3.6Å; F212-F218 HydrophobicContact CE2-CD2 3.6Å; F212-F218 HydrophobicContact CE2-CE2 4.48Å; F212-F218 AromaticContact CE2-CG 3.71Å; F212-F218 HydrophobicContact CE2-CG 3.71Å; F212-F218 HydrophobicContact CG-CB 3.94Å; F212-F218 HydrophobicContact CG-CD2 4.47Å; F212-F218 HydrophobicContact CZ-CB 3.42Å; F212-F218 VanDerWaalsContact CZ-CB 3.42Å; F212-F218 HydrophobicContact CZ-CD2 4.3Å; F212-F218 AromaticContact CZ-CG 3.94Å; F212-F218 HydrophobicContact CZ-CG 3.94Å; F212-F218 PolarHBondContact N-O 2.89Å; F212-F218 WeakPolarHBondContact O-CD2 3.49Å; F212-F218 PolarHBondContact O-N 3.11Å
213	G	70.8	Confident	69	Low	33 Å²	33	64.4 Å²	64.4	34%	0.34	35%	0.346	S	S	.	.	S	Bend	trans	95	164	-173.1	0	0	0	0	0	112.3	N215 C216	G213-N215 PolarHBondContact O-N 3Å; G213-N215 VanDerWaalsContact O-N 3.07Å; G213-C216 PolarHBondContact O-N 3.42Å
214	K	79.6	Confident	68.1	Low	162 Å²	162	64.1 Å²	64.1	70%	0.704	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-36.6	-175.3	-175.7	-176.5	176.2	178	0	114	C205	C205-K214 WeakPolarHBondContact CB-O 3.21Å; C205-K214 PolarHBondContact SG-O 3.05Å
215	N	84.6	Confident	66.7	Low	54 Å²	54	66.9 Å²	66.9	29%	0.289	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	19.8	-179.2	-66.2	52.4	0	0	0	111.2	P186 L188 Y203 G213 G217	P186-N215 VanDerWaalsContact O-CB 3.25Å; P186-N215 WeakPolarHBondContact O-CB 3.39Å; P186-N215 VanDerWaalsContact O-CG 3.31Å; P186-N215 PolarHBondContact O-ND2 3.31Å; L188-N215 VanDerWaalsContact CB-O 3.23Å; L188-N215 WeakPolarHBondContact CB-O 3.39Å; L188-N215 WeakPolarHBondContact CG-O 3.28Å; L188-N215 PolarHBondContact N-O 2.95Å; Y203-N215 PolarHBondContact OH-ND2 3.33Å; Y203-N215 PolarHBondContact OH-OD1 2.8Å; G213-N215 PolarHBondContact O-N 3Å; G213-N215 VanDerWaalsContact O-N 3.07Å; N215-G217 PolarHBondContact O-N 3.23Å
216	C	85.1	Confident	65.2	Low	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.393	C	S	.	.	S	Bend	trans	54.7	20.2	-175.3	-50.9	0	0	0	0	115.8	L188 N189 C205 C207 F212 G213 F218	L188-C216 VanDerWaalsContact O-CB 3.31Å; L188-C216 WeakPolarHBondContact O-CB 3.09Å; N189-C216 PolarHBondContact ND2-O 3.08Å; C205-C216 WeakPolarHBondContact CB-SG 3.47Å; C207-C216 WeakPolarHBondContact CA-SG 3.23Å; C207-C216 HydrophobicContact CB-CB 3.78Å; C207-C216 WeakPolarHBondContact CB-SG 3.43Å; C207-C216 WeakPolarHBondContact SG-CA 3.18Å; C207-C216 WeakPolarHBondContact SG-CB 3.38Å; C207-C216 CovalentContact SG-SG 2.04Å; C207-C216 PolarHBondContact SG-SG 3.14Å; F212-C216 CarbonylContact O-C 3.54Å; F212-C216 VanDerWaalsContact O-CA 3.28Å; F212-C216 WeakPolarHBondContact O-CA 3.46Å; G213-C216 PolarHBondContact O-N 3.42Å; C216-F218 VanDerWaalsContact C-N 3.31Å; C216-F218 PolarHBondContact O-N 2.99Å
217	G	76.5	Confident	63.9	Low	37 Å²	37	76.4 Å²	76.4	38%	0.381	42%	0.421	S	S	.	.			trans	-66.4	-24.9	-170.9	0	0	0	0	0	115.4	N189 F212 N215	N189-G217 PolarHBondContact ND2-O 3.4Å; F212-G217 PolarHBondContact O-N 3.41Å; N215-G217 PolarHBondContact O-N 3.23Å
218	F	67.4	Low	63.2	Low	127 Å²	127	74.8 Å²	74.8	56%	0.557	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.5	-179	-53.6	-71.2	0	0	0	110.8	T211 F212 C216	T211-F218 CarbonylContact C-O 3.3Å; T211-F218 WeakPolarHBondContact CA-O 3.21Å; T211-F218 WeakPolarHBondContact CB-O 3.43Å; F212-F218 HydrophobicContact CD1-CB 3.79Å; F212-F218 HydrophobicContact CD2-CB 3.84Å; F212-F218 AromaticContact CD2-CD2 3.7Å; F212-F218 HydrophobicContact CD2-CD2 3.7Å; F212-F218 HydrophobicContact CD2-CG 4.11Å; F212-F218 HydrophobicContact CE1-CB 3.53Å; F212-F218 HydrophobicContact CE2-CB 3.58Å; F212-F218 AromaticContact CE2-CD2 3.6Å; F212-F218 HydrophobicContact CE2-CD2 3.6Å; F212-F218 HydrophobicContact CE2-CE2 4.48Å; F212-F218 AromaticContact CE2-CG 3.71Å; F212-F218 HydrophobicContact CE2-CG 3.71Å; F212-F218 HydrophobicContact CG-CB 3.94Å; F212-F218 HydrophobicContact CG-CD2 4.47Å; F212-F218 HydrophobicContact CZ-CB 3.42Å; F212-F218 VanDerWaalsContact CZ-CB 3.42Å; F212-F218 HydrophobicContact CZ-CD2 4.3Å; F212-F218 AromaticContact CZ-CG 3.94Å; F212-F218 HydrophobicContact CZ-CG 3.94Å; F212-F218 PolarHBondContact N-O 2.89Å; F212-F218 WeakPolarHBondContact O-CD2 3.49Å; F212-F218 PolarHBondContact O-N 3.11Å; C216-F218 VanDerWaalsContact C-N 3.31Å; C216-F218 PolarHBondContact O-N 2.99Å
219	K	56.8	Low	63.5	Low	151 Å²	151	71.8 Å²	71.8	66%	0.657	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.3	166.5	-65	-176.9	-178.6	179.4	0	109.4	N189 T211 L221	N189-K219 WeakPolarHBondContact OD1-CE 3.14Å; T211-K219 HydrophobicContact CG2-CG 4.12Å; K219-L221 PolarHBondContact O-N 2.58Å
220	H	55.6	Low	64.4	Low	68 Å²	68	71.2 Å²	71.2	32%	0.315	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-66.9	126.8	-176.7	-123.5	-76.6	0	0	0	113.2	G210 N223 Y289	G210-H220 WeakPolarHBondContact O-CB 3.34Å; G210-H220 PolarHBondContact O-N 3.41Å; H220-N223 PolarHBondContact CE1-OD1 2.99Å; H220-N223 PolarHBondContact ND1-OD1 2.92Å; H220-N223 PolarHBondContact NE2-OD1 2.96Å; H220-Y289 PolarHBondContact NE2-OH 2.94Å
221	L	47.7	Very low	65.4	Low	144 Å²	144	74.2 Å²	74.2	75%	0.754	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-66	128.3	146.5	-97.4	67.5	0	0	0	107.7	K219 N223	K219-L221 PolarHBondContact O-N 2.58Å; L221-N223 PolarHBondContact O-N 2.86Å
222	T	47.3	Very low	65.7	Low	84 Å²	84	76 Å²	76	52%	0.515	42%	0.417	S	S	.	.			trans	-7	111	170.7	17.5	0	0	0	0	116.5	C224 L225	T222-C224 PolarHBondContact O-N 2.67Å; T222-L225 PolarHBondContact O-N 2.98Å; T222-L225 VanDerWaalsContact O-N 3.1Å; T222-L225 WeakPolarHBondContact OG1-CD1 3.33Å
223	N	52.1	Low	66.1	Low	21 Å²	21	72 Å²	72	11%	0.112	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-9.9	-178.4	-76.3	-33.8	0	0	0	116.1	H220 L221 S237 R238 A241 F242	H220-N223 PolarHBondContact CE1-OD1 2.99Å; H220-N223 PolarHBondContact ND1-OD1 2.92Å; H220-N223 PolarHBondContact NE2-OD1 2.96Å; L221-N223 PolarHBondContact O-N 2.86Å; N223-S237 PolarHBondContact N-OG 2.86Å; N223-R238 PolarHBondContact ND2-O 3.26Å; N223-A241 WeakPolarHBondContact CB-O 3.34Å; N223-A241 PolarHBondContact ND2-N 3.39Å; N223-A241 PolarHBondContact ND2-O 2.8Å; N223-F242 HydrophobicContact CB-CB 4.09Å; N223-F242 HydrophobicContact CB-CD1 4.49Å
224	C	60.8	Low	66.4	Low	35 Å²	35	75 Å²	75	24%	0.236	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-10.3	178.7	-68.8	0	0	0	0	115.6	T222 V226 C235 S237	T222-C224 PolarHBondContact O-N 2.67Å; C224-V226 PolarHBondContact O-N 3.32Å; C224-C235 WeakPolarHBondContact CA-SG 3.48Å; C224-C235 HydrophobicContact CB-CB 3.64Å; C224-C235 WeakPolarHBondContact CB-SG 3.35Å; C224-C235 WeakPolarHBondContact SG-CB 3.48Å; C224-C235 PolarHBondContact SG-O 3.36Å; C224-C235 CovalentContact SG-SG 2.03Å; C224-C235 PolarHBondContact SG-SG 3.5Å; C224-S237 PolarHBondContact N-OG 3.07Å; C224-S237 PolarHBondContact SG-N 3.02Å; C224-S237 VanDerWaalsContact SG-N 3.41Å; C224-S237 PolarHBondContact SG-OG 3.02Å
225	L	54.7	Low	66.2	Low	130 Å²	130	69.2 Å²	69.2	68%	0.681	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-1.9	-179.7	-92.4	118	0	0	0	115.1	T222	T222-L225 PolarHBondContact O-N 2.98Å; T222-L225 VanDerWaalsContact O-N 3.1Å; T222-L225 WeakPolarHBondContact OG1-CD1 3.33Å
226	V	53.7	Low	65.4	Low	95 Å²	95	68.6 Å²	68.6	58%	0.576	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	57.4	179.8	-164.2	0	0	0	0	111	C224 G228	C224-V226 PolarHBondContact O-N 3.32Å; V226-G228 VanDerWaalsContact C-N 3.28Å; V226-G228 PolarHBondContact O-N 3.05Å; V226-G228 VanDerWaalsContact O-N 3.08Å
227	N	54.7	Low	64.2	Low	139 Å²	139	70.8 Å²	70.8	74%	0.743	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.4	50.9	174.2	-71	-10.5	0	0	0	113.9	C229	N227-C229 PolarHBondContact O-N 2.86Å; N227-C229 VanDerWaalsContact O-N 3.16Å
228	G	65.7	Low	63.2	Low	2 Å²	2	73 Å²	73	2%	0.021	40%	0.402	C	S	.	.			trans	-62.4	-22.4	-175.3	0	0	0	0	0	114	V226 F242 C244 Q254	V226-G228 VanDerWaalsContact C-N 3.28Å; V226-G228 PolarHBondContact O-N 3.05Å; V226-G228 VanDerWaalsContact O-N 3.08Å; G228-F242 WeakPolarHBondContact O-CE2 3.22Å; G228-C244 VanDerWaalsContact C-SG 3.6Å; G228-C244 PolarHBondContact O-SG 3.49Å; G228-Q254 WeakPolarHBondContact O-CB 3.12Å; G228-Q254 PolarHBondContact O-NE2 3.29Å
229	C	74.3	Confident	62.2	Low	25 Å²	25	73.6 Å²	73.6	17%	0.169	40%	0.404	C	S	.	.			trans	-130	132.4	-174.5	-50.1	0	0	0	0	111.7	N227 G233 C235 C244	N227-C229 PolarHBondContact O-N 2.86Å; N227-C229 VanDerWaalsContact O-N 3.16Å; C229-G233 WeakPolarHBondContact CB-O 3.46Å; C229-C235 WeakPolarHBondContact SG-CA 3.45Å; C229-C235 WeakPolarHBondContact SG-CB 3.4Å; C229-C244 WeakPolarHBondContact CA-SG 3.49Å; C229-C244 HydrophobicContact CB-CB 3.72Å; C229-C244 WeakPolarHBondContact CB-SG 3.15Å; C229-C244 WeakPolarHBondContact SG-CA 3.2Å; C229-C244 WeakPolarHBondContact SG-CB 3.48Å; C229-C244 CovalentContact SG-SG 2.02Å; C229-C244 PolarHBondContact SG-SG 3.08Å
230	F	76.6	Confident	61.7	Low	51 Å²	51	67 Å²	67	22%	0.224	38%	0.379	C	S	.	.	S	Bend	trans	-90.7	172.4	174.2	-58.8	-80.9	0	0	0	110.8	G232 G233 Q254 C255 Q256 L282	F230-G232 PolarHBondContact O-N 2.71Å; F230-G233 PolarHBondContact O-N 3.39Å; F230-Q254 HydrophobicContact CD2-CB 3.68Å; F230-Q254 WeakPolarHBondContact CD2-O 3.33Å; F230-Q254 HydrophobicContact CE2-CB 3.89Å; F230-Q254 PolarHBondContact N-O 3.05Å; F230-C255 WeakPolarHBondContact O-CB 3.47Å; F230-Q256 HydrophobicContact CD2-CB 3.74Å; F230-Q256 HydrophobicContact CE2-CB 4.32Å; F230-Q256 HydrophobicContact CG-CB 4.39Å; F230-L282 HydrophobicContact CE2-CG 4.4Å
231	N	75.5	Confident	61.4	Low	80 Å²	80	66 Å²	66	43%	0.428	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	30.6	165.7	-57.1	-37.4	0	0	0	116	P247 F250 C255	N231-P247 WeakPolarHBondContact O-CG 3.38Å; N231-F250 HydrophobicContact CB-CB 4.47Å; N231-F250 HydrophobicContact CB-CD1 3.39Å; N231-F250 HydrophobicContact CB-CD2 4.03Å; N231-F250 HydrophobicContact CB-CE1 3.46Å; N231-F250 VanDerWaalsContact CB-CE1 3.46Å; N231-F250 HydrophobicContact CB-CE2 4.08Å; N231-F250 HydrophobicContact CB-CG 3.68Å; N231-F250 HydrophobicContact CB-CZ 3.81Å; N231-F250 VanDerWaalsContact ND2-CD1 3.33Å; N231-F250 WeakPolarHBondContact ND2-CD1 3.49Å; N231-F250 WeakPolarHBondContact ND2-CE1 3.25Å; N231-C255 PolarHBondContact ND2-O 3.19Å
232	G	70.5	Confident	62.1	Low	62 Å²	62	61.7 Å²	61.7	64%	0.639	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	10.1	-178.8	0	0	0	0	0	115.2	F230 T234	F230-G232 PolarHBondContact O-N 2.71Å; G232-T234 PolarHBondContact O-N 3.36Å
233	G	77.9	Confident	63.1	Low	12 Å²	12	59.9 Å²	59.9	12%	0.124	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-57.9	129.5	172.8	0	0	0	0	0	112.2	C229 F230 C235 H245	C229-G233 WeakPolarHBondContact CB-O 3.46Å; F230-G233 PolarHBondContact O-N 3.39Å; G233-C235 PolarHBondContact O-N 3.14Å; G233-H245 CarbonylContact C-O 3.6Å; G233-H245 WeakPolarHBondContact CA-O 3.12Å
234	T	77.5	Confident	64.3	Low	97 Å²	97	59.5 Å²	59.5	60%	0.595	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.3	177.1	-55.5	0	0	0	0	109.5	G232 H245	G232-T234 PolarHBondContact O-N 3.36Å; T234-H245 PolarHBondContact N-O 3.18Å; T234-H245 PolarHBondContact O-N 3.01Å
235	C	74.3	Confident	65.4	Low	39 Å²	39	62.1 Å²	62.1	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.8	-177.5	-171.6	0	0	0	0	112.6	C224 C229 G233	C224-C235 WeakPolarHBondContact CA-SG 3.48Å; C224-C235 HydrophobicContact CB-CB 3.64Å; C224-C235 WeakPolarHBondContact CB-SG 3.35Å; C224-C235 WeakPolarHBondContact SG-CB 3.48Å; C224-C235 PolarHBondContact SG-O 3.36Å; C224-C235 CovalentContact SG-SG 2.03Å; C224-C235 PolarHBondContact SG-SG 3.5Å; C229-C235 WeakPolarHBondContact SG-CA 3.45Å; C229-C235 WeakPolarHBondContact SG-CB 3.4Å; G233-C235 PolarHBondContact O-N 3.14Å
236	E	67.8	Low	66.6	Low	42 Å²	42	58 Å²	58	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.8	173	-177.5	-177	-121.3	0	0	109.5	R238 F242 V243 H245	E236-R238 IonicContact OE2-CZ 2.69Å; E236-R238 IonicContact OE2-NE 2.88Å; E236-R238 PolarHBondContact OE2-NE 2.9Å; E236-R238 IonicContact OE2-NH2 3.55Å; E236-R238 PolarHBondContact OE2-NH2 2.94Å; E236-F242 CarbonylContact O-C 3.26Å; E236-F242 VanDerWaalsContact O-CA 3.31Å; E236-F242 WeakPolarHBondContact O-CA 3.41Å; E236-V243 PolarHBondContact N-O 2.74Å; E236-V243 PolarHBondContact O-N 2.83Å; E236-H245 VanDerWaalsContact CD-NE2 3.32Å; E236-H245 IonicContact OE1-NE2 2.67Å; E236-H245 IonicContact OE2-CE1 3.74Å; E236-H245 IonicContact OE2-NE2 2.74Å; E236-H245 PolarHBondContact OE2-NE2 2.04Å
237	S	60.3	Low	67.7	Low	46 Å²	46	55.5 Å²	55.5	32%	0.322	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	128.6	176.8	-71.5	0	0	0	0	110.6	N223 C224	N223-S237 PolarHBondContact N-OG 2.86Å; C224-S237 PolarHBondContact N-OG 3.07Å; C224-S237 PolarHBondContact SG-N 3.02Å; C224-S237 VanDerWaalsContact SG-N 3.41Å; C224-S237 PolarHBondContact SG-OG 3.02Å
238	R	55.4	Low	68.5	Low	84 Å²	84	53.2 Å²	53.2	32%	0.317	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	159.1	172.5	-59.2	-169.9	-179.1	-171.5	-1.6	108.8	N223 E236 G240 A241	N223-R238 PolarHBondContact ND2-O 3.26Å; E236-R238 IonicContact OE2-CZ 2.69Å; E236-R238 IonicContact OE2-NE 2.88Å; E236-R238 PolarHBondContact OE2-NE 2.9Å; E236-R238 IonicContact OE2-NH2 3.55Å; E236-R238 PolarHBondContact OE2-NH2 2.94Å; R238-G240 PolarHBondContact O-N 3.45Å; R238-A241 CarbonylContact C-O 3.51Å; R238-A241 PolarHBondContact N-O 2.95Å; R238-A241 PolarHBondContact O-N 2.97Å; R238-A241 VanDerWaalsContact O-N 3.08Å
239	K	47.1	Very low	68.7	Low	139 Å²	139	56.5 Å²	56.5	60%	0.604	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	115.2	-177.6	-69	-171.6	-172.5	178.9	0	109.4	A209 A241 N963	A209-K239 WeakPolarHBondContact CB-O 3.32Å; A209-K239 CarbonylContact O-C 3.13Å; A209-K239 WeakPolarHBondContact O-CB 3.11Å; K239-A241 VanDerWaalsContact C-N 3.32Å; K239-A241 PolarHBondContact O-N 3.02Å; K239-N963 HydrophobicContact CB-CB 3.8Å; K239-N963 HydrophobicContact CD-CB 3.56Å; K239-N963 HydrophobicContact CG-CB 3.51Å; K239-N963 PolarHBondContact N-OD1 2.7Å
240	G	46.8	Very low	68.8	Low	12 Å²	12	57.8 Å²	57.8	12%	0.124	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	10.4	-175.1	0	0	0	0	0	116.9	A209 R238	A209-G240 VanDerWaalsContact C-N 3.35Å; A209-G240 PolarHBondContact O-N 2.04Å; R238-G240 PolarHBondContact O-N 3.45Å
241	A	49	Very low	68.7	Low	47 Å²	47	57.8 Å²	57.8	39%	0.388	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	175.3	177.1	0	0	0	0	0	112.3	N223 R238 K239	N223-A241 WeakPolarHBondContact CB-O 3.34Å; N223-A241 PolarHBondContact ND2-N 3.39Å; N223-A241 PolarHBondContact ND2-O 2.8Å; R238-A241 CarbonylContact C-O 3.51Å; R238-A241 PolarHBondContact N-O 2.95Å; R238-A241 PolarHBondContact O-N 2.97Å; R238-A241 VanDerWaalsContact O-N 3.08Å; K239-A241 VanDerWaalsContact C-N 3.32Å; K239-A241 PolarHBondContact O-N 3.02Å
242	F	61.4	Low	68.3	Low	53 Å²	53	55.5 Å²	55.5	23%	0.232	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.5	160.9	59.4	-91.1	0	0	0	108.7	N223 G228 E236 Q254	N223-F242 HydrophobicContact CB-CB 4.09Å; N223-F242 HydrophobicContact CB-CD1 4.49Å; G228-F242 WeakPolarHBondContact O-CE2 3.22Å; E236-F242 CarbonylContact O-C 3.26Å; E236-F242 VanDerWaalsContact O-CA 3.31Å; E236-F242 WeakPolarHBondContact O-CA 3.41Å; F242-Q254 HydrophobicContact CE2-CG 3.93Å; F242-Q254 HydrophobicContact CZ-CG 4.13Å
243	V	70	Confident	68.4	Low	47 Å²	47	56.2 Å²	56.2	29%	0.285	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136	173.8	168.1	0	0	0	0	108.3	E236	E236-V243 PolarHBondContact N-O 2.74Å; E236-V243 PolarHBondContact O-N 2.83Å
244	C	76.5	Confident	68.3	Low	13 Å²	13	56 Å²	56	9%	0.088	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.5	179.1	-63.1	0	0	0	0	110.5	G228 C229 C246 C255	G228-C244 VanDerWaalsContact C-SG 3.6Å; G228-C244 PolarHBondContact O-SG 3.49Å; C229-C244 WeakPolarHBondContact CA-SG 3.49Å; C229-C244 HydrophobicContact CB-CB 3.72Å; C229-C244 WeakPolarHBondContact CB-SG 3.15Å; C229-C244 WeakPolarHBondContact SG-CA 3.2Å; C229-C244 WeakPolarHBondContact SG-CB 3.48Å; C229-C244 CovalentContact SG-SG 2.02Å; C229-C244 PolarHBondContact SG-SG 3.08Å; C244-C246 PolarHBondContact O-N 3.15Å; C244-C255 WeakPolarHBondContact CB-SG 3.48Å
245	H	83.2	Confident	68.4	Low	90 Å²	90	51.3 Å²	51.3	42%	0.417	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	99.8	172.7	-62.7	-89.1	0	0	0	107.9	G233 T234 E236	G233-H245 CarbonylContact C-O 3.6Å; G233-H245 WeakPolarHBondContact CA-O 3.12Å; T234-H245 PolarHBondContact N-O 3.18Å; T234-H245 PolarHBondContact O-N 3.01Å; E236-H245 VanDerWaalsContact CD-NE2 3.32Å; E236-H245 IonicContact OE1-NE2 2.67Å; E236-H245 IonicContact OE2-CE1 3.74Å; E236-H245 IonicContact OE2-NE2 2.74Å; E236-H245 PolarHBondContact OE2-NE2 2.04Å
246	C	79.7	Confident	68.4	Low	44 Å²	44	52.6 Å²	52.6	30%	0.297	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-75.3	137.9	-171.6	-52.5	0	0	0	0	112.2	C244 F250 C255	C244-C246 PolarHBondContact O-N 3.15Å; C246-F250 HydrophobicContact CB-CB 4.25Å; C246-F250 WeakPolarHBondContact CB-O 3.38Å; C246-C255 WeakPolarHBondContact CA-SG 3.33Å; C246-C255 HydrophobicContact CB-CB 3.75Å; C246-C255 WeakPolarHBondContact CB-SG 3.26Å; C246-C255 PolarHBondContact N-SG 2.9Å; C246-C255 WeakPolarHBondContact SG-CA 3.36Å; C246-C255 WeakPolarHBondContact SG-CB 3.41Å; C246-C255 CovalentContact SG-SG 2.03Å; C246-C255 PolarHBondContact SG-SG 2.8Å
247	P	77.1	Confident	68.3	Low	42 Å²	42	52 Å²	52	27%	0.273	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-65.6	162.9	167	27.9	-32.3	0	0	0	110.3	N231 F250	N231-P247 WeakPolarHBondContact O-CG 3.38Å; P247-F250 HydrophobicContact CG-CD2 4.04Å; P247-F250 PolarHBondContact O-N 3.4Å
248	P	71.5	Confident	68.1	Low	90 Å²	90	56.3 Å²	56.3	58%	0.584	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	148.3	172.4	-26.7	35.2	0	0	0	111.8	F250	P248-F250 VanDerWaalsContact C-N 3.32Å
249	H	71.1	Confident	68.4	Low	71 Å²	71	53.8 Å²	53.8	33%	0.329	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	12.5	-173.1	-37.9	-68.7	0	0	0	115.7	R258 D259 F262	H249-R258 CarbonylContact O-C 3.31Å; H249-R258 WeakPolarHBondContact O-CA 3.35Å; H249-R258 WeakPolarHBondContact O-CG 3.42Å; H249-D259 VanDerWaalsContact C-N 3.29Å; H249-D259 PolarHBondContact O-N 3.46Å; H249-F262 WeakPolarHBondContact ND1-CB 3.29Å; H249-F262 AromaticContact ND1-CG 3.97Å
250	F	76.6	Confident	68.7	Low	53 Å²	53	49.3 Å²	49.3	23%	0.232	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	143.8	174.8	-63.4	-81.4	0	0	0	114.1	N231 C246 P247 P248 C255 L257 R258	N231-F250 HydrophobicContact CB-CB 4.47Å; N231-F250 HydrophobicContact CB-CD1 3.39Å; N231-F250 HydrophobicContact CB-CD2 4.03Å; N231-F250 HydrophobicContact CB-CE1 3.46Å; N231-F250 VanDerWaalsContact CB-CE1 3.46Å; N231-F250 HydrophobicContact CB-CE2 4.08Å; N231-F250 HydrophobicContact CB-CG 3.68Å; N231-F250 HydrophobicContact CB-CZ 3.81Å; N231-F250 VanDerWaalsContact ND2-CD1 3.33Å; N231-F250 WeakPolarHBondContact ND2-CD1 3.49Å; N231-F250 WeakPolarHBondContact ND2-CE1 3.25Å; C246-F250 HydrophobicContact CB-CB 4.25Å; C246-F250 WeakPolarHBondContact CB-O 3.38Å; P247-F250 HydrophobicContact CG-CD2 4.04Å; P247-F250 PolarHBondContact O-N 3.4Å; P248-F250 VanDerWaalsContact C-N 3.32Å; F250-C255 HydrophobicContact CB-CB 4.32Å; F250-L257 CarbonylContact C-O 3.6Å; F250-L257 VanDerWaalsContact CA-O 3.28Å; F250-L257 WeakPolarHBondContact CA-O 3.47Å; F250-L257 WeakPolarHBondContact CD1-O 3.42Å; F250-R258 HydrophobicContact CD1-CB 4.35Å; F250-R258 HydrophobicContact CD1-CG 4.32Å; F250-R258 HydrophobicContact CE1-CB 4.32Å; F250-R258 HydrophobicContact CE1-CG 4.04Å
251	T	73.8	Confident	68.9	Low	51 Å²	51	51.6 Å²	51.6	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	-177.5	-178.4	77.6	0	0	0	0	112.3	C255 Q256 L257 D259	T251-C255 CarbonylContact O-C 3.6Å; T251-C255 VanDerWaalsContact O-C 3.25Å; T251-C255 WeakPolarHBondContact O-CA 3.31Å; T251-Q256 PolarHBondContact O-N 3.13Å; T251-L257 PolarHBondContact N-O 3.37Å; T251-L257 WeakPolarHBondContact O-CB 3.02Å; T251-L257 PolarHBondContact O-N 2.79Å; T251-L257 WeakPolarHBondContact OG1-CB 3.33Å; T251-D259 HydrophobicContact CG2-CB 3.57Å
252	G	67.8	Low	68.8	Low	31 Å²	31	54.8 Å²	54.8	32%	0.32	30%	0.304	S	S	.	.	S	Bend	trans	86.7	159.5	-176.4	0	0	0	0	0	112.6	Q254 C255	G252-Q254 PolarHBondContact O-N 3.07Å; G252-C255 PolarHBondContact O-N 3.04Å
253	A	71.1	Confident	68	Low	78 Å²	78	56.9 Å²	56.9	65%	0.645	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19	-171.1	0	0	0	0	0	115.2
254	Q	75.7	Confident	66.6	Low	6 Å²	6	63.8 Å²	63.8	3%	0.028	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	14.2	175.6	-52.2	-161	-105	0	0	113	G228 F230 F242 G252 Q256	G228-Q254 WeakPolarHBondContact O-CB 3.12Å; G228-Q254 PolarHBondContact O-NE2 3.29Å; F230-Q254 HydrophobicContact CD2-CB 3.68Å; F230-Q254 WeakPolarHBondContact CD2-O 3.33Å; F230-Q254 HydrophobicContact CE2-CB 3.89Å; F230-Q254 PolarHBondContact N-O 3.05Å; F242-Q254 HydrophobicContact CE2-CG 3.93Å; F242-Q254 HydrophobicContact CZ-CG 4.13Å; G252-Q254 PolarHBondContact O-N 3.07Å; Q254-Q256 PolarHBondContact O-N 3.36Å
255	C	79.9	Confident	64.8	Low	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.37	C	S	.	.	S	Bend	trans	58.3	23.9	-171.5	-47.5	0	0	0	0	114	F230 N231 C244 C246 F250 T251 G252	F230-C255 WeakPolarHBondContact O-CB 3.47Å; N231-C255 PolarHBondContact ND2-O 3.19Å; C244-C255 WeakPolarHBondContact CB-SG 3.48Å; C246-C255 WeakPolarHBondContact CA-SG 3.33Å; C246-C255 HydrophobicContact CB-CB 3.75Å; C246-C255 WeakPolarHBondContact CB-SG 3.26Å; C246-C255 PolarHBondContact N-SG 2.9Å; C246-C255 WeakPolarHBondContact SG-CA 3.36Å; C246-C255 WeakPolarHBondContact SG-CB 3.41Å; C246-C255 CovalentContact SG-SG 2.03Å; C246-C255 PolarHBondContact SG-SG 2.8Å; F250-C255 HydrophobicContact CB-CB 4.32Å; T251-C255 CarbonylContact O-C 3.6Å; T251-C255 VanDerWaalsContact O-C 3.25Å; T251-C255 WeakPolarHBondContact O-CA 3.31Å; G252-C255 PolarHBondContact O-N 3.04Å
256	Q	74.2	Confident	62.9	Low	66 Å²	66	67.6 Å²	67.6	31%	0.308	38%	0.377	S	S	.	.			trans	-79.4	-17.9	-175.9	77.2	-78.1	15.4	0	0	113.6	F230 T251 Q254	F230-Q256 HydrophobicContact CD2-CB 3.74Å; F230-Q256 HydrophobicContact CE2-CB 4.32Å; F230-Q256 HydrophobicContact CG-CB 4.39Å; T251-Q256 PolarHBondContact O-N 3.13Å; Q254-Q256 PolarHBondContact O-N 3.36Å
257	L	67.2	Low	61.4	Low	28 Å²	28	74.2 Å²	74.2	15%	0.147	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	150.6	174.8	-53.1	176.7	0	0	0	108.9	F250 T251 Y336	F250-L257 CarbonylContact C-O 3.6Å; F250-L257 VanDerWaalsContact CA-O 3.28Å; F250-L257 WeakPolarHBondContact CA-O 3.47Å; F250-L257 WeakPolarHBondContact CD1-O 3.42Å; T251-L257 PolarHBondContact N-O 3.37Å; T251-L257 WeakPolarHBondContact O-CB 3.02Å; T251-L257 PolarHBondContact O-N 2.79Å; T251-L257 WeakPolarHBondContact OG1-CB 3.33Å; L257-Y336 HydrophobicContact CD2-CD2 4.23Å; L257-Y336 HydrophobicContact CD2-CE2 4.2Å
258	R	56.1	Low	59.9	Low	138 Å²	138	75.8 Å²	75.8	52%	0.521	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.5	173.4	-164.1	179.6	-177.8	168.3	0.2	108.4	H249 F250 T260	H249-R258 CarbonylContact O-C 3.31Å; H249-R258 WeakPolarHBondContact O-CA 3.35Å; H249-R258 WeakPolarHBondContact O-CG 3.42Å; F250-R258 HydrophobicContact CD1-CB 4.35Å; F250-R258 HydrophobicContact CD1-CG 4.32Å; F250-R258 HydrophobicContact CE1-CB 4.32Å; F250-R258 HydrophobicContact CE1-CG 4.04Å; R258-T260 PolarHBondContact O-N 3.26Å
259	D	60.3	Low	58.4	Low	30 Å²	30	79.4 Å²	79.4	16%	0.16	41%	0.408	C	S	.	.			trans	-71.3	115	176.6	-159.5	-24.4	0	0	0	109.9	H249 T251 S261 F262	H249-D259 VanDerWaalsContact C-N 3.29Å; H249-D259 PolarHBondContact O-N 3.46Å; T251-D259 HydrophobicContact CG2-CB 3.57Å; D259-S261 VanDerWaalsContact CG-OG 3.24Å; D259-S261 VanDerWaalsContact OD1-CB 3.31Å; D259-S261 WeakPolarHBondContact OD1-CB 3.48Å; D259-S261 PolarHBondContact OD1-N 3.24Å; D259-S261 PolarHBondContact OD1-OG 2.75Å; D259-S261 PolarHBondContact OD2-OG 3.34Å; D259-F262 HydrophobicContact CB-CD2 4.48Å
260	T	54.6	Low	56.9	Low	46 Å²	46	79.5 Å²	79.5	28%	0.282	42%	0.417	S	S	.	.			trans	-87	-12.2	179.1	46.8	0	0	0	0	112.9	R258 F262 I263	R258-T260 PolarHBondContact O-N 3.26Å; T260-F262 VanDerWaalsContact C-N 3.27Å; T260-F262 PolarHBondContact O-N 2.94Å; T260-I263 HydrophobicContact CG2-CD1 4.19Å; T260-I263 WeakPolarHBondContact O-CG1 3.27Å; T260-I263 PolarHBondContact O-N 3.38Å
261	S	50.9	Low	55.2	Low	59 Å²	59	82 Å²	82	41%	0.413	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.4	-179.4	65.6	0	0	0	0	113.5	D259 I263	D259-S261 VanDerWaalsContact CG-OG 3.24Å; D259-S261 VanDerWaalsContact OD1-CB 3.31Å; D259-S261 WeakPolarHBondContact OD1-CB 3.48Å; D259-S261 PolarHBondContact OD1-N 3.24Å; D259-S261 PolarHBondContact OD1-OG 2.75Å; D259-S261 PolarHBondContact OD2-OG 3.34Å; S261-I263 VanDerWaalsContact C-N 3.29Å; S261-I263 PolarHBondContact O-N 3.47Å
262	F	46.4	Very low	53.6	Low	115 Å²	115	84.2 Å²	84.2	50%	0.504	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	12.7	-179.2	-79.6	-90.3	0	0	0	114.8	H249 D259 T260 E264	H249-F262 WeakPolarHBondContact ND1-CB 3.29Å; H249-F262 AromaticContact ND1-CG 3.97Å; D259-F262 HydrophobicContact CB-CD2 4.48Å; T260-F262 VanDerWaalsContact C-N 3.27Å; T260-F262 PolarHBondContact O-N 2.94Å; F262-E264 PolarHBondContact O-N 2.63Å
263	I	43.8	Very low	52.2	Low	97 Å²	97	89.1 Å²	89.1	50%	0.497	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	58.8	-174.7	-48.8	173.6	0	0	0	111.8	T260 S261	T260-I263 HydrophobicContact CG2-CD1 4.19Å; T260-I263 WeakPolarHBondContact O-CG1 3.27Å; T260-I263 PolarHBondContact O-N 3.38Å; S261-I263 VanDerWaalsContact C-N 3.29Å; S261-I263 PolarHBondContact O-N 3.47Å
264	E	40.6	Very low	50.7	Low	191 Å²	191	91.1 Å²	91.1	89%	0.893	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-29.3	162.4	-65.5	-146.4	120.8	0	0	112.2	F262 A266	F262-E264 PolarHBondContact O-N 2.63Å; E264-A266 PolarHBondContact O-N 2.93Å
265	D	39.4	Very low	48.6	Very low	114 Å²	114	97.2 Å²	97.2	61%	0.61	50%	0.502	S	S	*	.			trans	-77.1	96.3	-175.7	-130.5	-34.1	0	0	0	111.8	K267 I268	D265-K267 PolarHBondContact O-N 3.17Å; D265-I268 PolarHBondContact O-N 3.02Å
266	A	43.4	Very low	46.2	Very low	69 Å²	69	101 Å²	101	57%	0.57	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-58.5	-13.7	-174.5	0	0	0	0	0	114.6	E264 I268 R269	E264-A266 PolarHBondContact O-N 2.93Å; A266-I268 PolarHBondContact O-N 3.41Å; A266-R269 WeakPolarHBondContact O-CB 3.44Å
267	K	47.4	Very low	44	Very low	184 Å²	184	106 Å²	106	80%	0.8	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-72.7	-22.8	-175.7	-151.5	173.7	-173.6	179.6	0	114.3	D265 R269	D265-K267 PolarHBondContact O-N 3.17Å; K267-R269 PolarHBondContact O-N 2.95Å
268	I	46.9	Very low	42.2	Very low	74 Å²	74	107.6 Å²	107.6	38%	0.379	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-77.9	-8.2	-178.6	-63.4	171.4	0	0	0	112.1	D265 A266 S270 D271	D265-I268 PolarHBondContact O-N 3.02Å; A266-I268 PolarHBondContact O-N 3.41Å; I268-S270 VanDerWaalsContact C-N 3.26Å; I268-S270 PolarHBondContact O-N 2.97Å; I268-S270 VanDerWaalsContact O-N 3.14Å; I268-D271 PolarHBondContact O-N 3.32Å
269	R	39	Very low	40.8	Very low	166 Å²	166	106 Å²	106	63%	0.626	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-71.6	-8.9	-168.4	-155.2	171.3	-69.1	-179.3	-0.1	115.2	A266 K267 I272	A266-R269 WeakPolarHBondContact O-CB 3.44Å; K267-R269 PolarHBondContact O-N 2.95Å; R269-I272 HydrophobicContact CG-CD1 4.16Å
270	S	40	Very low	39.8	Very low	74 Å²	74	111.4 Å²	111.4	52%	0.517	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-77.1	-41.4	172.7	49.1	0	0	0	0	113.2	I268 I272 N273	I268-S270 VanDerWaalsContact C-N 3.26Å; I268-S270 PolarHBondContact O-N 2.97Å; I268-S270 VanDerWaalsContact O-N 3.14Å; S270-I272 PolarHBondContact O-N 3.06Å; S270-N273 PolarHBondContact O-N 3.39Å
271	D	40.6	Very low	38.9	Very low	105 Å²	105	114.8 Å²	114.8	56%	0.561	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-80.2	-4.8	-165.4	-54.8	-9.5	0	0	0	112.2	I268 N273	I268-D271 PolarHBondContact O-N 3.32Å; D271-N273 PolarHBondContact O-N 2.93Å
272	I	41.2	Very low	38.5	Very low	97 Å²	97	113 Å²	113	50%	0.497	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-62.6	-21.6	172.7	-62.9	-179.8	0	0	0	111.9	R269 S270	R269-I272 HydrophobicContact CG-CD1 4.16Å; S270-I272 PolarHBondContact O-N 3.06Å
273	N	37.1	Very low	38.3	Very low	135 Å²	135	112 Å²	112	72%	0.722	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-99.4	-4	-173.7	-66.5	-48.3	0	0	0	115.5	S270 D271	S270-N273 PolarHBondContact O-N 3.39Å; D271-N273 PolarHBondContact O-N 2.93Å
274	T	39.7	Very low	38.5	Very low	120 Å²	120	111.8 Å²	111.8	74%	0.736	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	-10.4	-172.5	24.9	0	0	0	0	115.4
275	V	32.4	Very low	38.7	Very low	133 Å²	133	106.6 Å²	106.6	81%	0.806	61%	0.61	S	S	*	*			trans	-113.5	65	170.8	-168.7	0	0	0	0	110
276	A	28.9	Very low	39.1	Very low	80 Å²	80	103.9 Å²	103.9	66%	0.661	59%	0.593	S	S	*	*			trans	-120.8	64	178.2	0	0	0	0	0	111.3
277	L	28.9	Very low	39.6	Very low	172 Å²	172	102.4 Å²	102.4	90%	0.901	57%	0.574	S	S	*	*			trans	-164.4	145	164.8	-130.4	71.6	0	0	0	109
278	G	28.4	Very low	40.2	Very low	60 Å²	60	100.4 Å²	100.4	62%	0.619	57%	0.565	S	S	*	*			trans	85.4	94	-173.2	0	0	0	0	0	112.3
279	S	27.9	Very low	40.8	Very low	106 Å²	106	101.3 Å²	101.3	74%	0.741	57%	0.565	S	S	*	*			cis	61.4	32.2	21.6	89.5	0	0	0	0	115.5
280	N	37.5	Very low	41.9	Very low	143 Å²	143	96.8 Å²	96.8	77%	0.765	55%	0.552	S	S	*	*			trans	-83.8	108.9	154.4	-83.6	-25.1	0	0	0	108.7	L282	N280-L282 PolarHBondContact O-N 3.42Å
281	L	37.1	Very low	43.6	Very low	117 Å²	117	94.1 Å²	94.1	61%	0.613	53%	0.534	S	S	*	.			trans	-61.2	128.9	172.8	-78.9	66.7	0	0	0	108.2	N283	L281-N283 PolarHBondContact O-N 3.23Å
282	L	41.5	Very low	45.1	Very low	20 Å²	20	94.6 Å²	94.6	11%	0.105	53%	0.531	C	S	.	.			trans	-56.1	97.8	145.8	-152.4	-171.8	0	0	0	105	F230 N280 D284 H286 K287	F230-L282 HydrophobicContact CE2-CG 4.4Å; N280-L282 PolarHBondContact O-N 3.42Å; L282-D284 PolarHBondContact O-N 3.43Å; L282-H286 HydrophobicContact CD2-CB 3.38Å; L282-K287 HydrophobicContact CB-CG 4.34Å; L282-K287 HydrophobicContact CD1-CG 4.32Å; L282-K287 HydrophobicContact CD2-CG 3.99Å; L282-K287 HydrophobicContact CG-CG 4.44Å; L282-K287 WeakPolarHBondContact O-CD 3.29Å; L282-K287 WeakPolarHBondContact O-CE 3.49Å; L282-K287 WeakPolarHBondContact O-CG 3.2Å
283	N	43.3	Very low	46.3	Very low	96 Å²	96	93.2 Å²	93.2	51%	0.513	52%	0.524	S	S	.	.			trans	-50.3	142.3	-165.7	-103.2	-21.4	0	0	0	110.6	L281 S285 H286 K287	L281-N283 PolarHBondContact O-N 3.23Å; N283-S285 CarbonylContact O-C 3.59Å; N283-S285 PolarHBondContact O-N 2.84Å; N283-H286 WeakPolarHBondContact O-CA 3.48Å; N283-H286 PolarHBondContact O-N 2.81Å; N283-K287 PolarHBondContact O-N 3.14Å
284	D	47.2	Very low	48	Very low	91 Å²	91	89.2 Å²	89.2	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-54	-29.4	179.8	-83	-9.9	0	0	0	112	L282 K288	L282-D284 PolarHBondContact O-N 3.43Å; D284-K288 VanDerWaalsContact O-CB 3.29Å; D284-K288 WeakPolarHBondContact O-CB 3.39Å; D284-K288 WeakPolarHBondContact O-CD 3.28Å; D284-K288 WeakPolarHBondContact O-CG 3.43Å; D284-K288 PolarHBondContact O-N 3.08Å
285	S	45.3	Very low	50	Low	83 Å²	83	86.6 Å²	86.6	58%	0.58	48%	0.481	S	S	*	.	H	α-helix	trans	-52.8	-54.9	167.6	-39	0	0	0	0	112.6	N283 K288 Y289	N283-S285 CarbonylContact O-C 3.59Å; N283-S285 PolarHBondContact O-N 2.84Å; S285-K288 PolarHBondContact O-N 2.88Å; S285-Y289 VanDerWaalsContact O-CB 3.25Å; S285-Y289 WeakPolarHBondContact O-CB 3.44Å; S285-Y289 PolarHBondContact O-N 2.89Å
286	H	48.4	Very low	52.4	Low	56 Å²	56	80.4 Å²	80.4	26%	0.259	44%	0.444	S	S	.	.	H	α-helix	trans	-69.2	-38.5	179.6	-74.9	-168.5	0	0	0	112.3	L282 N283 K288 Y289 I290	L282-H286 HydrophobicContact CD2-CB 3.38Å; N283-H286 WeakPolarHBondContact O-CA 3.48Å; N283-H286 PolarHBondContact O-N 2.81Å; H286-K288 PolarHBondContact O-N 2.87Å; H286-Y289 WeakPolarHBondContact O-CB 3.43Å; H286-Y289 PolarHBondContact O-N 3.27Å; H286-I290 PolarHBondContact O-N 2.74Å
287	K	52.1	Low	54.9	Low	38 Å²	38	82 Å²	82	17%	0.165	44%	0.437	C	S	.	.	H	α-helix	trans	-60.3	-45.2	174.8	-67.2	-175.4	171.9	-167	0	111.6	L282 N283 L313 E335	L282-K287 HydrophobicContact CB-CG 4.34Å; L282-K287 HydrophobicContact CD1-CG 4.32Å; L282-K287 HydrophobicContact CD2-CG 3.99Å; L282-K287 HydrophobicContact CG-CG 4.44Å; L282-K287 WeakPolarHBondContact O-CD 3.29Å; L282-K287 WeakPolarHBondContact O-CE 3.49Å; L282-K287 WeakPolarHBondContact O-CG 3.2Å; N283-K287 PolarHBondContact O-N 3.14Å; K287-L313 HydrophobicContact CB-CD1 4.28Å; K287-L313 HydrophobicContact CB-CD2 4.35Å; K287-L313 HydrophobicContact CD-CD1 4.41Å; K287-L313 HydrophobicContact CD-CD2 3.77Å; K287-L313 HydrophobicContact CG-CD1 4.08Å; K287-L313 HydrophobicContact CG-CD2 4.24Å; K287-E335 VanDerWaalsContact CE-OE1 3.24Å; K287-E335 WeakPolarHBondContact CE-OE1 3.32Å; K287-E335 IonicContact NZ-OE1 2.8Å; K287-E335 PolarHBondContact NZ-OE1 3.31Å; K287-E335 IonicContact NZ-OE2 2.67Å; K287-E335 PolarHBondContact NZ-OE2 3.12Å
288	K	60.7	Low	57.3	Low	142 Å²	142	76.5 Å²	76.5	62%	0.617	41%	0.408	S	S	*	.	H	α-helix	trans	-66.2	-37.7	173.9	-71	165.5	-173.7	167.1	0	111.9	D284 S285 H286 I290 C291 F292	D284-K288 VanDerWaalsContact O-CB 3.29Å; D284-K288 WeakPolarHBondContact O-CB 3.39Å; D284-K288 WeakPolarHBondContact O-CD 3.28Å; D284-K288 WeakPolarHBondContact O-CG 3.43Å; D284-K288 PolarHBondContact O-N 3.08Å; S285-K288 PolarHBondContact O-N 2.88Å; H286-K288 PolarHBondContact O-N 2.87Å; K288-I290 PolarHBondContact O-N 2.83Å; K288-C291 PolarHBondContact O-N 2.97Å; K288-F292 VanDerWaalsContact O-CB 3.27Å; K288-F292 WeakPolarHBondContact O-CB 3.49Å; K288-F292 PolarHBondContact O-N 3.21Å
289	Y	59.2	Low	59.9	Low	93 Å²	93	75.6 Å²	75.6	37%	0.365	39%	0.387	S	S	.	.	H	α-helix	trans	-60	-40.6	-178.5	-173.6	-120	0	0	0	113.1	H220 S285 H286 F292 I293	H220-Y289 PolarHBondContact NE2-OH 2.94Å; S285-Y289 VanDerWaalsContact O-CB 3.25Å; S285-Y289 WeakPolarHBondContact O-CB 3.44Å; S285-Y289 PolarHBondContact O-N 2.89Å; H286-Y289 WeakPolarHBondContact O-CB 3.43Å; H286-Y289 PolarHBondContact O-N 3.27Å; Y289-F292 WeakPolarHBondContact O-CB 3.38Å; Y289-F292 PolarHBondContact O-N 3.06Å; Y289-I293 HydrophobicContact CD1-CD1 3.67Å; Y289-I293 HydrophobicContact CD2-CD1 4.24Å; Y289-I293 HydrophobicContact CD2-CG1 4.39Å; Y289-I293 HydrophobicContact CE1-CD1 3.37Å; Y289-I293 HydrophobicContact CE1-CG1 4.41Å; Y289-I293 HydrophobicContact CE2-CD1 3.98Å; Y289-I293 HydrophobicContact CE2-CG1 4.17Å; Y289-I293 HydrophobicContact CG-CD1 4.09Å; Y289-I293 WeakPolarHBondContact O-CG1 3.33Å; Y289-I293 PolarHBondContact O-N 3.28Å
290	I	62.9	Low	62.4	Low	71 Å²	71	72.1 Å²	72.1	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-50.4	175.9	-61.5	174.9	0	0	0	110.9	H286 K288 F292 I293 N294	H286-I290 PolarHBondContact O-N 2.74Å; K288-I290 PolarHBondContact O-N 2.83Å; I290-F292 PolarHBondContact O-N 3.32Å; I290-I293 PolarHBondContact O-N 3.37Å; I290-N294 PolarHBondContact O-N 2.83Å; I290-N294 VanDerWaalsContact O-N 3.11Å
291	C	75.4	Confident	64.4	Low	19 Å²	19	70.5 Å²	70.5	13%	0.128	36%	0.356	C	S	.	.	H	α-helix	trans	-67.1	-21.8	177	-56	0	0	0	0	112.9	K288 C296 C314	K288-C291 PolarHBondContact O-N 2.97Å; C291-C296 HydrophobicContact CB-CB 4.14Å; C291-C296 WeakPolarHBondContact O-CB 3.13Å; C291-C296 PolarHBondContact O-N 2.89Å; C291-C314 VanDerWaalsContact CA-SG 3.56Å; C291-C314 HydrophobicContact CB-CB 3.98Å; C291-C314 WeakPolarHBondContact CB-SG 3.24Å; C291-C314 WeakPolarHBondContact SG-CA 3.18Å; C291-C314 WeakPolarHBondContact SG-CB 3.13Å; C291-C314 PolarHBondContact SG-N 2.77Å; C291-C314 CovalentContact SG-SG 2.05Å; C291-C314 PolarHBondContact SG-SG 3.18Å
292	F	71	Confident	66.3	Low	115 Å²	115	68.2 Å²	68.2	50%	0.504	34%	0.344	S	S	.	.	H	α-helix	trans	-75.8	-51.7	174.3	-177.3	-98.6	0	0	0	111.6	K288 Y289 I290 N294 K295 H297	K288-F292 VanDerWaalsContact O-CB 3.27Å; K288-F292 WeakPolarHBondContact O-CB 3.49Å; K288-F292 PolarHBondContact O-N 3.21Å; Y289-F292 WeakPolarHBondContact O-CB 3.38Å; Y289-F292 PolarHBondContact O-N 3.06Å; I290-F292 PolarHBondContact O-N 3.32Å; F292-N294 PolarHBondContact O-N 3.18Å; F292-K295 WeakPolarHBondContact O-CA 3.43Å; F292-K295 PolarHBondContact O-N 2.64Å; F292-H297 AromaticContact CD2-CE1 3.99Å
293	I	67	Low	67.6	Low	67 Å²	67	68.5 Å²	68.5	34%	0.344	35%	0.353	S	S	.	.	H	α-helix	trans	-58	-46.8	177.2	-67.4	161.1	0	0	0	111.3	Y289 I290 K295	Y289-I293 HydrophobicContact CD1-CD1 3.67Å; Y289-I293 HydrophobicContact CD2-CD1 4.24Å; Y289-I293 HydrophobicContact CD2-CG1 4.39Å; Y289-I293 HydrophobicContact CE1-CD1 3.37Å; Y289-I293 HydrophobicContact CE1-CG1 4.41Å; Y289-I293 HydrophobicContact CE2-CD1 3.98Å; Y289-I293 HydrophobicContact CE2-CG1 4.17Å; Y289-I293 HydrophobicContact CG-CD1 4.09Å; Y289-I293 WeakPolarHBondContact O-CG1 3.33Å; Y289-I293 PolarHBondContact O-N 3.28Å; I290-I293 PolarHBondContact O-N 3.37Å; I293-K295 PolarHBondContact O-N 3.11Å; I293-K295 VanDerWaalsContact O-N 3.08Å
294	N	72.7	Confident	69.2	Low	52 Å²	52	70.4 Å²	70.4	28%	0.278	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-2.6	178.2	-72.9	-4.6	0	0	0	113.2	I290 F292 C296 K299 E308	I290-N294 PolarHBondContact O-N 2.83Å; I290-N294 VanDerWaalsContact O-N 3.11Å; F292-N294 PolarHBondContact O-N 3.18Å; N294-C296 VanDerWaalsContact CB-SG 3.58Å; N294-C296 PolarHBondContact O-N 2.93Å; N294-K299 WeakPolarHBondContact O-CE 3.43Å; N294-K299 PolarHBondContact O-NZ 2.75Å; N294-E308 HydrophobicContact CB-CG 4.12Å; N294-E308 PolarHBondContact ND2-O 2.9Å
295	K	81	Confident	70.7	Confident	64 Å²	64	68.4 Å²	68.4	28%	0.278	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	32.7	-175.2	-47.3	174.1	-170.4	171.6	0	113.1	D206 F292 I293 H297 I298 K299	D206-K295 WeakPolarHBondContact OD1-CE 3.24Å; D206-K295 IonicContact OD1-NZ 3.89Å; D206-K295 PolarHBondContact OD1-NZ 2.92Å; D206-K295 IonicContact OD2-NZ 2.65Å; D206-K295 PolarHBondContact OD2-NZ 2.96Å; F292-K295 WeakPolarHBondContact O-CA 3.43Å; F292-K295 PolarHBondContact O-N 2.64Å; I293-K295 PolarHBondContact O-N 3.11Å; I293-K295 VanDerWaalsContact O-N 3.08Å; K295-H297 PolarHBondContact O-N 3.3Å; K295-H297 VanDerWaalsContact O-N 3.1Å; K295-I298 HydrophobicContact CB-CD1 3.92Å; K295-I298 HydrophobicContact CB-CG1 3.88Å; K295-I298 HydrophobicContact CD-CD1 3.99Å; K295-I298 WeakPolarHBondContact O-CG1 3.48Å; K295-I298 PolarHBondContact O-N 3.42Å; K295-K299 PolarHBondContact O-N 3.17Å
296	C	83.4	Confident	72.3	Confident	4 Å²	4	66.2 Å²	66.2	3%	0.027	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-26.6	-178.7	-57.3	0	0	0	0	112.4	C291 N294 I298 K299 A300 C309 C314	C291-C296 HydrophobicContact CB-CB 4.14Å; C291-C296 WeakPolarHBondContact O-CB 3.13Å; C291-C296 PolarHBondContact O-N 2.89Å; N294-C296 VanDerWaalsContact CB-SG 3.58Å; N294-C296 PolarHBondContact O-N 2.93Å; C296-I298 PolarHBondContact O-N 3.33Å; C296-K299 PolarHBondContact O-N 3.21Å; C296-A300 WeakPolarHBondContact O-CB 3.05Å; C296-A300 PolarHBondContact O-N 2.98Å; C296-C309 WeakPolarHBondContact CA-SG 3.5Å; C296-C309 HydrophobicContact CB-CB 3.7Å; C296-C309 WeakPolarHBondContact CB-SG 3.49Å; C296-C309 WeakPolarHBondContact SG-CA 3.43Å; C296-C309 WeakPolarHBondContact SG-CB 3.34Å; C296-C309 CovalentContact SG-SG 2.04Å; C296-C309 PolarHBondContact SG-SG 3.49Å; C296-C314 HydrophobicContact CB-CB 3.92Å
297	H	81	Confident	73.8	Confident	112 Å²	112	68.5 Å²	68.5	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-11.6	171.8	72.1	-87.8	0	0	0	115.1	F292 K295	F292-H297 AromaticContact CD2-CE1 3.99Å; K295-H297 PolarHBondContact O-N 3.3Å; K295-H297 VanDerWaalsContact O-N 3.1Å
298	I	79.8	Confident	75	Confident	57 Å²	57	70.6 Å²	70.6	29%	0.292	36%	0.361	S	S	.	.	H	α-helix	trans	-109.6	-12.8	171.7	86.7	-179.2	0	0	0	113.4	R197 K295 C296	R197-I298 VanDerWaalsContact CZ-CG2 3.49Å; K295-I298 HydrophobicContact CB-CD1 3.92Å; K295-I298 HydrophobicContact CB-CG1 3.88Å; K295-I298 HydrophobicContact CD-CD1 3.99Å; K295-I298 WeakPolarHBondContact O-CG1 3.48Å; K295-I298 PolarHBondContact O-N 3.42Å; C296-I298 PolarHBondContact O-N 3.33Å
299	K	82.6	Confident	76.1	Confident	41 Å²	41	63.9 Å²	63.9	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-94.6	-41.2	-179.4	-71	170.3	-179.7	169.6	0	111.2	N294 K295 C296 N301 N302 N306 E308 D317	N294-K299 WeakPolarHBondContact O-CE 3.43Å; N294-K299 PolarHBondContact O-NZ 2.75Å; K295-K299 PolarHBondContact O-N 3.17Å; C296-K299 PolarHBondContact O-N 3.21Å; K299-N301 PolarHBondContact O-N 3.26Å; K299-N302 WeakPolarHBondContact O-CB 3.49Å; K299-N302 PolarHBondContact O-N 2.96Å; K299-N302 PolarHBondContact O-ND2 3.36Å; K299-N306 HydrophobicContact CB-CB 4.48Å; K299-N306 HydrophobicContact CD-CB 4.06Å; K299-E308 IonicContact NZ-OE1 2.65Å; K299-E308 PolarHBondContact NZ-OE1 3.27Å; K299-D317 WeakPolarHBondContact CB-OD1 3.41Å
300	A	81.5	Confident	77.1	Confident	33 Å²	33	61.3 Å²	61.3	27%	0.273	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	131.2	174.2	0	0	0	0	0	114.1	C296 D317	C296-A300 WeakPolarHBondContact O-CB 3.05Å; C296-A300 PolarHBondContact O-N 2.98Å; A300-D317 WeakPolarHBondContact CA-O 3.43Å; A300-D317 PolarHBondContact N-OD1 3.28Å
301	N	78.5	Confident	77.8	Confident	110 Å²	110	59.6 Å²	59.6	59%	0.588	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	30	-178.8	-63.5	-112	0	0	0	114.3	K299 G318 D320	K299-N301 PolarHBondContact O-N 3.26Å; N301-G318 PolarHBondContact ND2-O 3.49Å; N301-D320 WeakPolarHBondContact CA-OD2 3.45Å; N301-D320 PolarHBondContact N-OD2 3.23Å
302	N	76.8	Confident	78	Confident	68 Å²	68	61.9 Å²	61.9	36%	0.364	33%	0.325	S	S	.	.	S	Bend	trans	-92.4	-7.6	174	78.5	24.4	0	0	0	114	K299 F304 N306 D320	K299-N302 WeakPolarHBondContact O-CB 3.49Å; K299-N302 PolarHBondContact O-N 2.96Å; K299-N302 PolarHBondContact O-ND2 3.36Å; N302-F304 WeakPolarHBondContact O-CD2 3.18Å; N302-F304 WeakPolarHBondContact OD1-CA 3.19Å; N302-F304 WeakPolarHBondContact OD1-CB 3.44Å; N302-F304 WeakPolarHBondContact OD1-CD2 3.45Å; N302-F304 PolarHBondContact OD1-N 2.95Å; N302-F304 PolarHBondContact OD1-O 3.25Å; N302-F304 VanDerWaalsContact OD1-O 3.13Å; N302-N306 PolarHBondContact ND2-ND2 3.25Å; N302-D320 PolarHBondContact N-OD2 3.14Å
303	G	70.6	Confident	78.3	Confident	27 Å²	27	59.3 Å²	59.3	28%	0.278	32%	0.316	S	S	.	.	S	Bend	trans	86	7	-179.4	0	0	0	0	0	115.3	D320	G303-D320 VanDerWaalsContact CA-OD1 3.27Å; G303-D320 WeakPolarHBondContact CA-OD1 3.39Å; G303-D320 VanDerWaalsContact N-CG 3.34Å; G303-D320 PolarHBondContact N-OD1 3.04Å; G303-D320 PolarHBondContact N-OD2 3.32Å
304	F	75.2	Confident	78.8	Confident	136 Å²	136	56.9 Å²	56.9	60%	0.596	31%	0.305	S	S	*	.	S	Bend	trans	-129.5	116.1	176.3	-57.1	-94.1	0	0	0	109.7	N302 N306	N302-F304 WeakPolarHBondContact O-CD2 3.18Å; N302-F304 WeakPolarHBondContact OD1-CA 3.19Å; N302-F304 WeakPolarHBondContact OD1-CB 3.44Å; N302-F304 WeakPolarHBondContact OD1-CD2 3.45Å; N302-F304 PolarHBondContact OD1-N 2.95Å; N302-F304 PolarHBondContact OD1-O 3.25Å; N302-F304 VanDerWaalsContact OD1-O 3.13Å; F304-N306 PolarHBondContact O-N 3.29Å; F304-N306 VanDerWaalsContact O-N 3.11Å; F304-N306 PolarHBondContact O-ND2 3.28Å
305	C	79.2	Confident	79.2	Confident	49 Å²	49	55.8 Å²	55.8	33%	0.331	31%	0.306	S	S	.	.			trans	-61.8	112.4	175.5	174.4	0	0	0	0	112	C321	C305-C321 WeakPolarHBondContact CA-SG 3.23Å; C305-C321 HydrophobicContact CB-CB 3.86Å; C305-C321 WeakPolarHBondContact CB-SG 3.38Å; C305-C321 VanDerWaalsContact SG-CA 3.51Å; C305-C321 WeakPolarHBondContact SG-CB 3.02Å; C305-C321 CovalentContact SG-SG 2.03Å; C305-C321 PolarHBondContact SG-SG 2.8Å
306	N	80.3	Confident	79.4	Confident	36 Å²	36	53.9 Å²	53.9	19%	0.193	30%	0.298	C	S	.	.			trans	-92.6	113.7	174.3	-59.5	-87.1	0	0	0	109.5	K299 N302 F304 E308 C309 N310 D317	K299-N306 HydrophobicContact CB-CB 4.48Å; K299-N306 HydrophobicContact CD-CB 4.06Å; N302-N306 PolarHBondContact ND2-ND2 3.25Å; F304-N306 PolarHBondContact O-N 3.29Å; F304-N306 VanDerWaalsContact O-N 3.11Å; F304-N306 PolarHBondContact O-ND2 3.28Å; N306-E308 VanDerWaalsContact C-N 3.28Å; N306-E308 PolarHBondContact O-N 3.35Å; N306-E308 VanDerWaalsContact O-N 3.17Å; N306-C309 HydrophobicContact CB-CB 4.47Å; N306-C309 WeakPolarHBondContact O-CA 3.27Å; N306-C309 PolarHBondContact O-N 2.81Å; N306-N310 PolarHBondContact O-N 3.07Å; N306-D317 WeakPolarHBondContact CB-OD2 3.45Å; N306-D317 PolarHBondContact N-OD2 2.93Å; N306-D317 PolarHBondContact ND2-OD2 2.81Å
307	P	79.5	Confident	79.4	Confident	104 Å²	104	53.7 Å²	53.7	68%	0.675	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-57.7	-33.9	-170.6	-28.1	36.3	0	0	0	115.1	C309 N310	P307-C309 PolarHBondContact O-N 3.12Å; P307-N310 WeakPolarHBondContact O-CB 3.44Å; P307-N310 PolarHBondContact O-N 3.16Å; P307-N310 VanDerWaalsContact O-N 3.15Å
308	E	77	Confident	79.3	Confident	83 Å²	83	49.1 Å²	49.1	39%	0.388	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-70.4	-8.6	177.2	72.6	-86.2	-151.7	0	0	114.1	N294 K299 N306	N294-E308 HydrophobicContact CB-CG 4.12Å; N294-E308 PolarHBondContact ND2-O 2.9Å; K299-E308 IonicContact NZ-OE1 2.65Å; K299-E308 PolarHBondContact NZ-OE1 3.27Å; N306-E308 VanDerWaalsContact C-N 3.28Å; N306-E308 PolarHBondContact O-N 3.35Å; N306-E308 VanDerWaalsContact O-N 3.17Å
309	C	83.4	Confident	79.3	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-113.9	-2.9	174.8	-63.3	0	0	0	0	112.4	C296 N306 P307 S311 C314 D317	C296-C309 WeakPolarHBondContact CA-SG 3.5Å; C296-C309 HydrophobicContact CB-CB 3.7Å; C296-C309 WeakPolarHBondContact CB-SG 3.49Å; C296-C309 WeakPolarHBondContact SG-CA 3.43Å; C296-C309 WeakPolarHBondContact SG-CB 3.34Å; C296-C309 CovalentContact SG-SG 2.04Å; C296-C309 PolarHBondContact SG-SG 3.49Å; N306-C309 HydrophobicContact CB-CB 4.47Å; N306-C309 WeakPolarHBondContact O-CA 3.27Å; N306-C309 PolarHBondContact O-N 2.81Å; P307-C309 PolarHBondContact O-N 3.12Å; C309-S311 PolarHBondContact O-N 2.95Å; C309-C314 WeakPolarHBondContact O-CB 3.41Å; C309-D317 HydrophobicContact CB-CB 3.75Å; C309-D317 WeakPolarHBondContact CB-OD1 3.42Å; C309-D317 PolarHBondContact O-N 2.96Å
310	N	81.1	Confident	79.2	Confident	39 Å²	39	47.6 Å²	47.6	21%	0.209	27%	0.274	C	S	.	.			trans	-77.5	66.4	178	-167.8	12.6	0	0	0	112.2	N306 P307 C321 D529	N306-N310 PolarHBondContact O-N 3.07Å; P307-N310 WeakPolarHBondContact O-CB 3.44Å; P307-N310 PolarHBondContact O-N 3.16Å; P307-N310 VanDerWaalsContact O-N 3.15Å; N310-C321 HydrophobicContact CB-CB 4.27Å; N310-C321 VanDerWaalsContact CB-SG 3.53Å; N310-C321 VanDerWaalsContact OD1-CB 3.26Å; N310-C321 WeakPolarHBondContact OD1-CB 3.05Å; N310-D529 VanDerWaalsContact ND2-CB 3.33Å; N310-D529 WeakPolarHBondContact ND2-CB 3.02Å; N310-D529 PolarHBondContact ND2-OD2 2.99Å
311	S	76.9	Confident	79.2	Confident	35 Å²	35	46.2 Å²	46.2	25%	0.245	26%	0.262	C	S	.	.	S	Bend	trans	-138.1	155.7	174.3	70.1	0	0	0	0	110.8	C309 L313 C314 G315 F316	C309-S311 PolarHBondContact O-N 2.95Å; S311-L313 PolarHBondContact O-N 2.84Å; S311-C314 CarbonylContact O-C 3.5Å; S311-C314 PolarHBondContact O-N 3.15Å; S311-C314 VanDerWaalsContact O-N 3.17Å; S311-C314 PolarHBondContact OG-N 2.85Å; S311-G315 PolarHBondContact O-N 3.31Å; S311-G315 VanDerWaalsContact O-N 3.13Å; S311-F316 PolarHBondContact O-N 3.25Å
312	Y	78.8	Confident	79.3	Confident	67 Å²	67	41.2 Å²	41.2	26%	0.263	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.7	175.4	178.9	-92	0	0	0	112.3	G315 F316 R334 E335 A338	Y312-G315 PolarHBondContact O-N 2.81Å; Y312-F316 AromaticContact CD2-CE2 3.88Å; Y312-F316 HydrophobicContact CD2-CE2 3.88Å; Y312-F316 AromaticContact CD2-CZ 3.95Å; Y312-F316 HydrophobicContact CD2-CZ 3.95Å; Y312-F316 HydrophobicContact CG-CZ 4.42Å; Y312-R334 HydrophobicContact CD2-CB 4.29Å; Y312-R334 HydrophobicContact CE1-CB 4.14Å; Y312-R334 HydrophobicContact CE2-CB 3.63Å; Y312-R334 HydrophobicContact CE2-CG 4.44Å; Y312-R334 WeakPolarHBondContact OH-CD 3.32Å; Y312-E335 HydrophobicContact CD1-CB 3.71Å; Y312-E335 HydrophobicContact CD1-CG 4.1Å; Y312-E335 HydrophobicContact CE1-CB 4.08Å; Y312-A338 HydrophobicContact CD2-CB 4.45Å; Y312-A338 HydrophobicContact CG-CB 4.4Å
313	L	77	Confident	78.8	Confident	62 Å²	62	39 Å²	39	33%	0.325	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-37.6	179.5	-69.1	-178.8	0	0	0	113.7	K287 S311 G315 E335	K287-L313 HydrophobicContact CB-CD1 4.28Å; K287-L313 HydrophobicContact CB-CD2 4.35Å; K287-L313 HydrophobicContact CD-CD1 4.41Å; K287-L313 HydrophobicContact CD-CD2 3.77Å; K287-L313 HydrophobicContact CG-CD1 4.08Å; K287-L313 HydrophobicContact CG-CD2 4.24Å; S311-L313 PolarHBondContact O-N 2.84Å; L313-G315 VanDerWaalsContact C-N 3.28Å; L313-E335 HydrophobicContact CD2-CG 4.18Å; L313-E335 HydrophobicContact CG-CG 4.49Å
314	C	78.7	Confident	78.7	Confident	16 Å²	16	39.9 Å²	39.9	11%	0.108	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	16.1	175	-44.9	0	0	0	0	112.3	C291 C296 C309 S311 F316 D317 G318	C291-C314 VanDerWaalsContact CA-SG 3.56Å; C291-C314 HydrophobicContact CB-CB 3.98Å; C291-C314 WeakPolarHBondContact CB-SG 3.24Å; C291-C314 WeakPolarHBondContact SG-CA 3.18Å; C291-C314 WeakPolarHBondContact SG-CB 3.13Å; C291-C314 PolarHBondContact SG-N 2.77Å; C291-C314 CovalentContact SG-SG 2.05Å; C291-C314 PolarHBondContact SG-SG 3.18Å; C296-C314 HydrophobicContact CB-CB 3.92Å; C309-C314 WeakPolarHBondContact O-CB 3.41Å; S311-C314 CarbonylContact O-C 3.5Å; S311-C314 PolarHBondContact O-N 3.15Å; S311-C314 VanDerWaalsContact O-N 3.17Å; S311-C314 PolarHBondContact OG-N 2.85Å; C314-F316 PolarHBondContact O-N 3.06Å; C314-D317 PolarHBondContact O-N 3.45Å; C314-G318 PolarHBondContact O-N 3.48Å; C314-G318 VanDerWaalsContact O-N 3.14Å
315	G	80.5	Confident	78.8	Confident	29 Å²	29	35.2 Å²	35.2	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	69.5	27.1	175.7	0	0	0	0	0	115.1	S311 Y312 L313 G318 I319	S311-G315 PolarHBondContact O-N 3.31Å; S311-G315 VanDerWaalsContact O-N 3.13Å; Y312-G315 PolarHBondContact O-N 2.81Å; L313-G315 VanDerWaalsContact C-N 3.28Å; G315-G318 CarbonylContact O-C 3.45Å; G315-G318 PolarHBondContact O-N 3.37Å; G315-I319 PolarHBondContact O-N 3.01Å
316	F	84.7	Confident	78.8	Confident	23 Å²	23	37.2 Å²	37.2	10%	0.101	21%	0.213	C	C	.	.	H	α-helix	trans	56.1	54.4	-172	-52.5	-74.3	0	0	0	111.8	S311 Y312 C314 I319 D320 C321 A322 P327 F328 A338	S311-F316 PolarHBondContact O-N 3.25Å; Y312-F316 AromaticContact CD2-CE2 3.88Å; Y312-F316 HydrophobicContact CD2-CE2 3.88Å; Y312-F316 AromaticContact CD2-CZ 3.95Å; Y312-F316 HydrophobicContact CD2-CZ 3.95Å; Y312-F316 HydrophobicContact CG-CZ 4.42Å; C314-F316 PolarHBondContact O-N 3.06Å; F316-I319 CarbonylContact O-C 3.54Å; F316-I319 WeakPolarHBondContact O-CA 3.01Å; F316-I319 PolarHBondContact O-N 2.85Å; F316-I319 VanDerWaalsContact O-N 3.17Å; F316-D320 PolarHBondContact O-N 3.1Å; F316-C321 HydrophobicContact CB-CB 4.29Å; F316-C321 WeakPolarHBondContact O-CB 3.46Å; F316-C321 PolarHBondContact O-N 3.46Å; F316-C321 VanDerWaalsContact O-N 3.12Å; F316-A322 HydrophobicContact CB-CB 4.32Å; F316-P327 HydrophobicContact CD2-CG 4.18Å; F316-P327 HydrophobicContact CE2-CG 3.87Å; F316-P327 HydrophobicContact CZ-CG 4.18Å; F316-F328 HydrophobicContact CZ-CD2 4.14Å; F316-F328 HydrophobicContact CZ-CE2 4.47Å; F316-A338 HydrophobicContact CZ-CB 4.14Å
317	D	84.2	Confident	78.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	49.7	54	-167.3	-159	24.4	0	0	0	112.1	K299 A300 N306 C309 C314 I319 D320	K299-D317 WeakPolarHBondContact CB-OD1 3.41Å; A300-D317 WeakPolarHBondContact CA-O 3.43Å; A300-D317 PolarHBondContact N-OD1 3.28Å; N306-D317 WeakPolarHBondContact CB-OD2 3.45Å; N306-D317 PolarHBondContact N-OD2 2.93Å; N306-D317 PolarHBondContact ND2-OD2 2.81Å; C309-D317 HydrophobicContact CB-CB 3.75Å; C309-D317 WeakPolarHBondContact CB-OD1 3.42Å; C309-D317 PolarHBondContact O-N 2.96Å; C314-D317 PolarHBondContact O-N 3.45Å; D317-I319 PolarHBondContact O-N 3.15Å; D317-I319 VanDerWaalsContact O-N 3.11Å; D317-D320 HydrophobicContact CB-CB 4.38Å; D317-D320 WeakPolarHBondContact O-CB 3.04Å; D317-D320 PolarHBondContact O-N 2.67Å
318	G	78.1	Confident	79.4	Confident	16 Å²	16	30.8 Å²	30.8	17%	0.165	17%	0.173	C	C	.	.	H	α-helix	trans	63.8	13.8	-178.3	0	0	0	0	0	116.7	N301 C314 G315	N301-G318 PolarHBondContact ND2-O 3.49Å; C314-G318 PolarHBondContact O-N 3.48Å; C314-G318 VanDerWaalsContact O-N 3.14Å; G315-G318 CarbonylContact O-C 3.45Å; G315-G318 PolarHBondContact O-N 3.37Å
319	I	80.9	Confident	79.9	Confident	33 Å²	33	34.2 Å²	34.2	17%	0.169	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	-2.4	-169.4	87	-153.6	0	0	0	116.5	G315 F316 D317 C321 A322 G323 Q326	G315-I319 PolarHBondContact O-N 3.01Å; F316-I319 CarbonylContact O-C 3.54Å; F316-I319 WeakPolarHBondContact O-CA 3.01Å; F316-I319 PolarHBondContact O-N 2.85Å; F316-I319 VanDerWaalsContact O-N 3.17Å; D317-I319 PolarHBondContact O-N 3.15Å; D317-I319 VanDerWaalsContact O-N 3.11Å; I319-C321 VanDerWaalsContact C-N 3.27Å; I319-C321 PolarHBondContact O-N 3.21Å; I319-A322 PolarHBondContact O-N 3.44Å; I319-A322 VanDerWaalsContact O-N 3.15Å; I319-G323 PolarHBondContact O-N 2.6Å; I319-Q326 HydrophobicContact CG2-CG 4.22Å
320	D	81.2	Confident	80.1	Confident	33 Å²	33	39.1 Å²	39.1	18%	0.176	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-33.1	178.4	-71.4	-43.1	0	0	0	112.7	N301 N302 G303 F316 D317	N301-D320 WeakPolarHBondContact CA-OD2 3.45Å; N301-D320 PolarHBondContact N-OD2 3.23Å; N302-D320 PolarHBondContact N-OD2 3.14Å; G303-D320 VanDerWaalsContact CA-OD1 3.27Å; G303-D320 WeakPolarHBondContact CA-OD1 3.39Å; G303-D320 VanDerWaalsContact N-CG 3.34Å; G303-D320 PolarHBondContact N-OD1 3.04Å; G303-D320 PolarHBondContact N-OD2 3.32Å; F316-D320 PolarHBondContact O-N 3.1Å; D317-D320 HydrophobicContact CB-CB 4.38Å; D317-D320 WeakPolarHBondContact O-CB 3.04Å; D317-D320 PolarHBondContact O-N 2.67Å
321	C	81.3	Confident	80.5	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.034	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-29.5	175.1	-61.2	0	0	0	0	113.3	C305 N310 F316 I319 K532	C305-C321 WeakPolarHBondContact CA-SG 3.23Å; C305-C321 HydrophobicContact CB-CB 3.86Å; C305-C321 WeakPolarHBondContact CB-SG 3.38Å; C305-C321 VanDerWaalsContact SG-CA 3.51Å; C305-C321 WeakPolarHBondContact SG-CB 3.02Å; C305-C321 CovalentContact SG-SG 2.03Å; C305-C321 PolarHBondContact SG-SG 2.8Å; N310-C321 HydrophobicContact CB-CB 4.27Å; N310-C321 VanDerWaalsContact CB-SG 3.53Å; N310-C321 VanDerWaalsContact OD1-CB 3.26Å; N310-C321 WeakPolarHBondContact OD1-CB 3.05Å; F316-C321 HydrophobicContact CB-CB 4.29Å; F316-C321 WeakPolarHBondContact O-CB 3.46Å; F316-C321 PolarHBondContact O-N 3.46Å; F316-C321 VanDerWaalsContact O-N 3.12Å; I319-C321 VanDerWaalsContact C-N 3.27Å; I319-C321 PolarHBondContact O-N 3.21Å; C321-K532 PolarHBondContact O-NZ 3.38Å
322	A	79.8	Confident	81.1	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.033	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-33.7	178	0	0	0	0	0	112.2	F316 I319 L325 P327 S527 K532	F316-A322 HydrophobicContact CB-CB 4.32Å; I319-A322 PolarHBondContact O-N 3.44Å; I319-A322 VanDerWaalsContact O-N 3.15Å; A322-L325 WeakPolarHBondContact CB-O 3.43Å; A322-P327 HydrophobicContact CB-CG 4.46Å; A322-S527 WeakPolarHBondContact O-CB 3.04Å; A322-K532 VanDerWaalsContact C-NZ 3.28Å; A322-K532 PolarHBondContact O-NZ 2.69Å
323	G	65.9	Low	81.3	Confident	21 Å²	21	43.4 Å²	43.4	22%	0.216	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	69.9	-174.2	0	0	0	0	0	111.1	I319 L325	I319-G323 PolarHBondContact O-N 2.6Å; G323-L325 PolarHBondContact O-N 3.2Å
324	D	67.9	Low	81.8	Confident	46 Å²	46	45.6 Å²	45.6	25%	0.246	22%	0.22	C	C	.	.	S	Bend	trans	61.7	-15.8	-175.9	-67.7	-53.8	0	0	0	116.9	S487 I488 K489	D324-S487 WeakPolarHBondContact CB-O 3.46Å; D324-I488 WeakPolarHBondContact OD2-CA 3.3Å; D324-K489 PolarHBondContact OD2-N 2.94Å
325	L	77.4	Confident	81.9	Confident	38 Å²	38	47.5 Å²	47.5	20%	0.199	23%	0.228	C	C	.	.			trans	-82.7	164.6	178.2	-69.5	173.1	0	0	0	113.2	A322 G323 T523 V546	A322-L325 WeakPolarHBondContact CB-O 3.43Å; G323-L325 PolarHBondContact O-N 3.2Å; L325-T523 WeakPolarHBondContact CD1-O 3.14Å; L325-V546 WeakPolarHBondContact CD1-O 3.42Å
326	Q	79.8	Confident	81.9	Confident	91 Å²	91	48.9 Å²	48.9	43%	0.425	22%	0.224	S	C	.	.			trans	-127.3	80.7	176.5	-71.8	-175	-25	0	0	109.9	I319 R329	I319-Q326 HydrophobicContact CG2-CG 4.22Å; Q326-R329 HydrophobicContact CB-CB 4.19Å; Q326-R329 WeakPolarHBondContact O-CB 3.16Å; Q326-R329 PolarHBondContact O-N 3.39Å
327	P	83.6	Confident	82.2	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.019	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	154.1	177.9	23.9	-32.7	0	0	0	111.3	F316 A322 R329 L356 S527 V528	F316-P327 HydrophobicContact CD2-CG 4.18Å; F316-P327 HydrophobicContact CE2-CG 3.87Å; F316-P327 HydrophobicContact CZ-CG 4.18Å; A322-P327 HydrophobicContact CB-CG 4.46Å; P327-R329 PolarHBondContact O-N 2.84Å; P327-L356 HydrophobicContact CB-CD1 4.08Å; P327-S527 WeakPolarHBondContact CG-OG 3.3Å; P327-V528 HydrophobicContact CB-CG2 3.78Å; P327-V528 HydrophobicContact CG-CG2 4.19Å
328	F	89.2	Confident	82.3	Confident	3 Å²	3	48.8 Å²	48.8	1%	0.013	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	6.2	-174.4	-44.9	-84	0	0	0	115.7	F316 Q330 C331 R334 C337 A338 F341 L356 V528	F316-F328 HydrophobicContact CZ-CD2 4.14Å; F316-F328 HydrophobicContact CZ-CE2 4.47Å; F328-Q330 PolarHBondContact O-N 3.11Å; F328-Q330 VanDerWaalsContact O-N 3.07Å; F328-C331 HydrophobicContact CB-CB 4.02Å; F328-C331 WeakPolarHBondContact O-CB 3.43Å; F328-C331 PolarHBondContact O-N 3.17Å; F328-R334 WeakPolarHBondContact O-CG 3.49Å; F328-C337 HydrophobicContact CD1-CB 4.26Å; F328-A338 HydrophobicContact CD2-CB 3.59Å; F328-A338 HydrophobicContact CE2-CB 3.77Å; F328-A338 HydrophobicContact CG-CB 4.06Å; F328-A338 HydrophobicContact CZ-CB 4.37Å; F328-F341 HydrophobicContact CE1-CB 3.96Å; F328-F341 AromaticContact CE1-CD2 3.73Å; F328-F341 HydrophobicContact CE1-CD2 3.73Å; F328-F341 HydrophobicContact CE1-CE2 4.45Å; F328-F341 AromaticContact CE1-CG 4Å; F328-F341 HydrophobicContact CE1-CG 4Å; F328-F341 HydrophobicContact CZ-CB 3.69Å; F328-F341 HydrophobicContact CZ-CD1 4.1Å; F328-F341 AromaticContact CZ-CD2 3.68Å; F328-F341 HydrophobicContact CZ-CD2 3.68Å; F328-F341 HydrophobicContact CZ-CE2 4.29Å; F328-F341 AromaticContact CZ-CG 3.58Å; F328-F341 HydrophobicContact CZ-CG 3.58Å; F328-L356 HydrophobicContact CD1-CD1 4.15Å; F328-L356 HydrophobicContact CD1-CG 4.37Å; F328-L356 HydrophobicContact CE1-CB 4.26Å; F328-L356 HydrophobicContact CE1-CD1 3.94Å; F328-L356 HydrophobicContact CE1-CG 4.29Å; F328-L356 HydrophobicContact CE2-CD1 4.38Å; F328-L356 HydrophobicContact CG-CD1 4.46Å; F328-L356 HydrophobicContact CZ-CD1 4.05Å; F328-V528 HydrophobicContact CE2-CG2 4.16Å; F328-V528 HydrophobicContact CZ-CG2 4.39Å
329	R	87.8	Confident	82.3	Confident	154 Å²	154	51.8 Å²	51.8	58%	0.581	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.9	179.7	176.9	173.6	175.8	164	-8.2	114	Q326 P327 R334	Q326-R329 HydrophobicContact CB-CB 4.19Å; Q326-R329 WeakPolarHBondContact O-CB 3.16Å; Q326-R329 PolarHBondContact O-N 3.39Å; P327-R329 PolarHBondContact O-N 2.84Å; R329-R334 PolarHBondContact O-NE 3.48Å; R329-R334 PolarHBondContact O-NH2 2.86Å
330	Q	86.8	Confident	82.4	Confident	103 Å²	103	50.6 Å²	50.6	48%	0.481	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-15.6	179	-57.6	-172.9	71.7	0	0	112.7	F328 D354 R521	F328-Q330 PolarHBondContact O-N 3.11Å; F328-Q330 VanDerWaalsContact O-N 3.07Å; Q330-D354 HydrophobicContact CB-CB 4.38Å; Q330-D354 VanDerWaalsContact CB-OD1 3.3Å; Q330-D354 WeakPolarHBondContact CB-OD1 3.19Å; Q330-R521 VanDerWaalsContact CD-CZ 3.44Å; Q330-R521 VanDerWaalsContact CD-NH2 3.3Å; Q330-R521 VanDerWaalsContact NE2-CZ 3.33Å; Q330-R521 VanDerWaalsContact NE2-NE 3.2Å
331	C	90.5	Very high	82.7	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.02	23%	0.23	C	C	.	.			trans	-59.2	137.9	174.2	-173.6	0	0	0	0	111.2	F328 K333 R334 D354 C355	F328-C331 HydrophobicContact CB-CB 4.02Å; F328-C331 WeakPolarHBondContact O-CB 3.43Å; F328-C331 PolarHBondContact O-N 3.17Å; C331-K333 PolarHBondContact SG-N 3.25Å; C331-K333 VanDerWaalsContact SG-N 3.45Å; C331-R334 HydrophobicContact CB-CG 4.31Å; C331-R334 WeakPolarHBondContact O-CG 3.37Å; C331-D354 VanDerWaalsContact CA-O 3.3Å; C331-D354 WeakPolarHBondContact CA-O 3.46Å; C331-D354 VanDerWaalsContact CB-O 3.25Å; C331-D354 WeakPolarHBondContact CB-O 3.37Å; C331-D354 PolarHBondContact N-O 2.79Å; C331-C355 VanDerWaalsContact CA-SG 3.5Å; C331-C355 HydrophobicContact CB-CB 3.89Å; C331-C355 WeakPolarHBondContact CB-SG 3.29Å; C331-C355 WeakPolarHBondContact SG-CB 3.24Å; C331-C355 CovalentContact SG-SG 2.04Å; C331-C355 PolarHBondContact SG-SG 2.73Å
332	Y	88.1	Confident	83	Confident	142 Å²	142	53.5 Å²	53.5	56%	0.557	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-28.2	175.4	75.3	-73.9	0	0	0	112.4	Q349	Y332-Q349 VanDerWaalsContact CE1-O 3.26Å; Y332-Q349 WeakPolarHBondContact CE1-O 3.18Å; Y332-Q349 WeakPolarHBondContact OH-CB 3.49Å; Y332-Q349 PolarHBondContact OH-O 3.21Å
333	K	84.1	Confident	83	Confident	86 Å²	86	56.1 Å²	56.1	37%	0.374	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	43	-179.8	-99	-178	-172.6	164.9	0	112.7	C331 E335 Y336 C337	C331-K333 PolarHBondContact SG-N 3.25Å; C331-K333 VanDerWaalsContact SG-N 3.45Å; K333-E335 PolarHBondContact O-N 3.15Å; K333-Y336 WeakPolarHBondContact O-CB 3.2Å; K333-Y336 PolarHBondContact O-N 2.93Å; K333-C337 PolarHBondContact O-N 2.81Å
334	R	87	Confident	83.7	Confident	108 Å²	108	63.2 Å²	63.2	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-38.5	-59.1	-170.8	-51.4	-172.1	176.5	145.7	0.1	115.5	Y312 F328 R329 C331 Y336 A338	Y312-R334 HydrophobicContact CD2-CB 4.29Å; Y312-R334 HydrophobicContact CE1-CB 4.14Å; Y312-R334 HydrophobicContact CE2-CB 3.63Å; Y312-R334 HydrophobicContact CE2-CG 4.44Å; Y312-R334 WeakPolarHBondContact OH-CD 3.32Å; F328-R334 WeakPolarHBondContact O-CG 3.49Å; R329-R334 PolarHBondContact O-NE 3.48Å; R329-R334 PolarHBondContact O-NH2 2.86Å; C331-R334 HydrophobicContact CB-CG 4.31Å; C331-R334 WeakPolarHBondContact O-CG 3.37Å; R334-Y336 VanDerWaalsContact C-N 3.33Å; R334-Y336 PolarHBondContact O-N 3.32Å; R334-A338 WeakPolarHBondContact O-CB 3.43Å; R334-A338 PolarHBondContact O-N 3.27Å
335	E	80.9	Confident	84.3	Confident	57 Å²	57	63.9 Å²	63.9	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-66.7	-32.5	-176.1	-175.4	-178.6	158.5	0	0	112.9	K287 Y312 L313 K333 N339	K287-E335 VanDerWaalsContact CE-OE1 3.24Å; K287-E335 WeakPolarHBondContact CE-OE1 3.32Å; K287-E335 IonicContact NZ-OE1 2.8Å; K287-E335 PolarHBondContact NZ-OE1 3.31Å; K287-E335 IonicContact NZ-OE2 2.67Å; K287-E335 PolarHBondContact NZ-OE2 3.12Å; Y312-E335 HydrophobicContact CD1-CB 3.71Å; Y312-E335 HydrophobicContact CD1-CG 4.1Å; Y312-E335 HydrophobicContact CE1-CB 4.08Å; L313-E335 HydrophobicContact CD2-CG 4.18Å; L313-E335 HydrophobicContact CG-CG 4.49Å; K333-E335 PolarHBondContact O-N 3.15Å; E335-N339 VanDerWaalsContact O-CG 3.23Å; E335-N339 PolarHBondContact O-ND2 2.96Å
336	Y	81.7	Confident	84.9	Confident	57 Å²	57	64.9 Å²	64.9	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-72.8	-56.5	175.6	-179.8	-83.9	0	0	0	110.2	L257 K333 R334 A338 N339 V340 D347 Q349 C350	L257-Y336 HydrophobicContact CD2-CD2 4.23Å; L257-Y336 HydrophobicContact CD2-CE2 4.2Å; K333-Y336 WeakPolarHBondContact O-CB 3.2Å; K333-Y336 PolarHBondContact O-N 2.93Å; R334-Y336 VanDerWaalsContact C-N 3.33Å; R334-Y336 PolarHBondContact O-N 3.32Å; Y336-A338 VanDerWaalsContact C-N 3.3Å; Y336-A338 PolarHBondContact O-N 2.99Å; Y336-N339 WeakPolarHBondContact O-CB 3.02Å; Y336-N339 PolarHBondContact O-N 2.67Å; Y336-V340 HydrophobicContact CD1-CG2 4.07Å; Y336-V340 HydrophobicContact CE1-CG1 4.08Å; Y336-V340 HydrophobicContact CE1-CG2 3.73Å; Y336-V340 PolarHBondContact O-N 2.81Å; Y336-D347 WeakPolarHBondContact CE1-OD1 3.05Å; Y336-D347 WeakPolarHBondContact CE1-OD2 3.41Å; Y336-D347 VanDerWaalsContact OH-CG 3.26Å; Y336-D347 PolarHBondContact OH-OD1 3.36Å; Y336-D347 VanDerWaalsContact OH-OD1 3.11Å; Y336-D347 PolarHBondContact OH-OD2 2.66Å; Y336-Q349 HydrophobicContact CD1-CG 4.45Å; Y336-Q349 HydrophobicContact CE1-CG 4.01Å; Y336-Q349 VanDerWaalsContact CE1-NE2 3.26Å; Y336-Q349 VanDerWaalsContact CZ-NE2 3.25Å; Y336-Q349 PolarHBondContact OH-NE2 3.13Å; Y336-C350 VanDerWaalsContact CD1-SG 3.57Å
337	C	89.1	Confident	85.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-33.1	-175.9	-60.3	0	0	0	0	112.8	F328 K333 N339 V340 F341 C350 C355	F328-C337 HydrophobicContact CD1-CB 4.26Å; K333-C337 PolarHBondContact O-N 2.81Å; C337-N339 PolarHBondContact O-N 2.82Å; C337-V340 PolarHBondContact O-N 3.37Å; C337-F341 WeakPolarHBondContact O-CB 3.27Å; C337-F341 PolarHBondContact O-N 2.72Å; C337-C350 WeakPolarHBondContact CA-SG 3.2Å; C337-C350 HydrophobicContact CB-CB 3.78Å; C337-C350 WeakPolarHBondContact CB-SG 3.41Å; C337-C350 VanDerWaalsContact SG-CA 3.59Å; C337-C350 WeakPolarHBondContact SG-CB 3.02Å; C337-C350 CovalentContact SG-SG 2.04Å; C337-C350 PolarHBondContact SG-SG 3.29Å; C337-C355 HydrophobicContact CB-CB 4.06Å
338	A	86.4	Confident	85.4	Confident	21 Å²	21	65.3 Å²	65.3	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-66.5	-17.1	173.4	0	0	0	0	0	114.4	Y312 F316 F328 R334 Y336	Y312-A338 HydrophobicContact CD2-CB 4.45Å; Y312-A338 HydrophobicContact CG-CB 4.4Å; F316-A338 HydrophobicContact CZ-CB 4.14Å; F328-A338 HydrophobicContact CD2-CB 3.59Å; F328-A338 HydrophobicContact CE2-CB 3.77Å; F328-A338 HydrophobicContact CG-CB 4.06Å; F328-A338 HydrophobicContact CZ-CB 4.37Å; R334-A338 WeakPolarHBondContact O-CB 3.43Å; R334-A338 PolarHBondContact O-N 3.27Å; Y336-A338 VanDerWaalsContact C-N 3.3Å; Y336-A338 PolarHBondContact O-N 2.99Å
339	N	79	Confident	85.4	Confident	80 Å²	80	68.2 Å²	68.2	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-98.6	-17.6	177.7	-69.6	-22.8	0	0	0	113.5	E335 Y336 C337	E335-N339 VanDerWaalsContact O-CG 3.23Å; E335-N339 PolarHBondContact O-ND2 2.96Å; Y336-N339 WeakPolarHBondContact O-CB 3.02Å; Y336-N339 PolarHBondContact O-N 2.67Å; C337-N339 PolarHBondContact O-N 2.82Å
340	V	82.2	Confident	85.5	Confident	8 Å²	8	60.9 Å²	60.9	5%	0.048	29%	0.293	C	S	.	.	H	α-helix	trans	-105.9	-22.5	178	-62.2	0	0	0	0	113.9	Y336 C337 R342 N343 D347	Y336-V340 HydrophobicContact CD1-CG2 4.07Å; Y336-V340 HydrophobicContact CE1-CG1 4.08Å; Y336-V340 HydrophobicContact CE1-CG2 3.73Å; Y336-V340 PolarHBondContact O-N 2.81Å; C337-V340 PolarHBondContact O-N 3.37Å; V340-R342 PolarHBondContact O-N 3.36Å; V340-R342 VanDerWaalsContact O-N 3.16Å; V340-N343 WeakPolarHBondContact O-CB 3.26Å; V340-N343 PolarHBondContact O-N 2.8Å; V340-N343 VanDerWaalsContact O-N 3.12Å; V340-N343 PolarHBondContact O-ND2 3.16Å; V340-N343 PolarHBondContact O-OD1 3.15Å; V340-D347 HydrophobicContact CG2-CB 4.05Å
341	F	88.5	Confident	85.7	Confident	17 Å²	17	58.2 Å²	58.2	8%	0.075	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	118.1	178.3	173.7	-86.5	0	0	0	113.1	F328 C337 L356 G359 F525 V528 V531	F328-F341 HydrophobicContact CE1-CB 3.96Å; F328-F341 AromaticContact CE1-CD2 3.73Å; F328-F341 HydrophobicContact CE1-CD2 3.73Å; F328-F341 HydrophobicContact CE1-CE2 4.45Å; F328-F341 AromaticContact CE1-CG 4Å; F328-F341 HydrophobicContact CE1-CG 4Å; F328-F341 HydrophobicContact CZ-CB 3.69Å; F328-F341 HydrophobicContact CZ-CD1 4.1Å; F328-F341 AromaticContact CZ-CD2 3.68Å; F328-F341 HydrophobicContact CZ-CD2 3.68Å; F328-F341 HydrophobicContact CZ-CE2 4.29Å; F328-F341 AromaticContact CZ-CG 3.58Å; F328-F341 HydrophobicContact CZ-CG 3.58Å; C337-F341 WeakPolarHBondContact O-CB 3.27Å; C337-F341 PolarHBondContact O-N 2.72Å; F341-L356 HydrophobicContact CD2-CB 4.13Å; F341-L356 HydrophobicContact CE2-CB 3.65Å; F341-L356 HydrophobicContact CE2-CD1 4.44Å; F341-G359 VanDerWaalsContact CD2-CA 3.47Å; F341-G359 VanDerWaalsContact CE2-N 3.35Å; F341-F525 AromaticContact CE2-CD2 3.85Å; F341-F525 HydrophobicContact CE2-CD2 3.85Å; F341-F525 AromaticContact CE2-CE2 3.83Å; F341-F525 HydrophobicContact CE2-CE2 3.83Å; F341-F525 AromaticContact CZ-CD2 3.84Å; F341-F525 HydrophobicContact CZ-CD2 3.84Å; F341-F525 AromaticContact CZ-CE2 3.76Å; F341-F525 HydrophobicContact CZ-CE2 3.76Å; F341-F525 HydrophobicContact CZ-CG 4.37Å; F341-F525 HydrophobicContact CZ-CZ 4.21Å; F341-V528 HydrophobicContact CD1-CG1 4.02Å; F341-V528 HydrophobicContact CE1-CB 3.96Å; F341-V528 HydrophobicContact CE1-CG1 3.71Å; F341-V528 HydrophobicContact CE1-CG2 4.1Å; F341-V528 HydrophobicContact CZ-CB 4.43Å; F341-V528 HydrophobicContact CZ-CG2 4.22Å; F341-V531 HydrophobicContact CE1-CG2 3.78Å; F341-V531 HydrophobicContact CZ-CG2 3.92Å
342	R	86.4	Confident	85.8	Confident	81 Å²	81	60.7 Å²	60.7	31%	0.306	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	49.6	-177.2	-57.7	-150.4	69.8	-166.1	-5.9	113.8	V340 G359 D361 I534	V340-R342 PolarHBondContact O-N 3.36Å; V340-R342 VanDerWaalsContact O-N 3.16Å; R342-G359 WeakPolarHBondContact CD-O 3.41Å; R342-G359 VanDerWaalsContact CG-CA 3.45Å; R342-D361 VanDerWaalsContact C-OD2 3.3Å; R342-D361 WeakPolarHBondContact CA-OD2 3.11Å; R342-D361 PolarHBondContact N-OD2 2.75Å; R342-D361 VanDerWaalsContact N-OD2 3.13Å; R342-I534 VanDerWaalsContact NH1-CD1 3.31Å
343	N	80.2	Confident	85.9	Confident	59 Å²	59	55.4 Å²	55.4	32%	0.316	28%	0.277	S	S	.	.	S	Bend	trans	-101	1.5	168.6	70	0.6	0	0	0	113.4	V340 L345 D361	V340-N343 WeakPolarHBondContact O-CB 3.26Å; V340-N343 PolarHBondContact O-N 2.8Å; V340-N343 VanDerWaalsContact O-N 3.12Å; V340-N343 PolarHBondContact O-ND2 3.16Å; V340-N343 PolarHBondContact O-OD1 3.15Å; N343-L345 PolarHBondContact O-N 2.97Å; N343-L345 WeakPolarHBondContact OD1-CA 3.02Å; N343-L345 WeakPolarHBondContact OD1-CB 3.31Å; N343-L345 PolarHBondContact OD1-N 3.33Å; N343-L345 PolarHBondContact OD1-O 2.85Å; N343-D361 PolarHBondContact N-OD2 3.42Å; N343-D361 PolarHBondContact OD1-OD2 3.22Å
344	E	81	Confident	86.3	Confident	171 Å²	171	54.4 Å²	54.4	80%	0.799	28%	0.276	S	S	*	.	S	Bend	trans	69.3	9.9	-176.6	-53.3	179.2	176.3	0	0	114.5	D361	E344-D361 PolarHBondContact N-OD2 2.77Å
345	L	81.8	Confident	86.5	Confident	60 Å²	60	49.3 Å²	49.3	31%	0.314	26%	0.257	S	S	.	.	S	Bend	trans	-120.5	103.6	178.7	-60	174.6	0	0	0	110.3	N343 D347	N343-L345 PolarHBondContact O-N 2.97Å; N343-L345 WeakPolarHBondContact OD1-CA 3.02Å; N343-L345 WeakPolarHBondContact OD1-CB 3.31Å; N343-L345 PolarHBondContact OD1-N 3.33Å; N343-L345 PolarHBondContact OD1-O 2.85Å; L345-D347 PolarHBondContact O-N 3Å
346	C	88.5	Confident	87.1	Confident	59 Å²	59	46.6 Å²	46.6	40%	0.399	24%	0.244	S	C	.	.			trans	-48.3	113.3	176.8	174.6	0	0	0	0	113.1	P348 C362	C346-P348 WeakPolarHBondContact O-CD 3.49Å; C346-C362 WeakPolarHBondContact CA-SG 3.09Å; C346-C362 HydrophobicContact CB-CB 3.88Å; C346-C362 WeakPolarHBondContact CB-SG 3.27Å; C346-C362 WeakPolarHBondContact SG-CA 3.45Å; C346-C362 WeakPolarHBondContact SG-CB 3.45Å; C346-C362 CovalentContact SG-SG 2.04Å; C346-C362 PolarHBondContact SG-SG 2.79Å
347	D	88.2	Confident	87.6	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.027	24%	0.237	C	C	.	.			trans	-106.1	90.9	176.6	-139.1	-51.8	0	0	0	108.1	Y336 V340 L345 Q349 C350 N351 D358	Y336-D347 WeakPolarHBondContact CE1-OD1 3.05Å; Y336-D347 WeakPolarHBondContact CE1-OD2 3.41Å; Y336-D347 VanDerWaalsContact OH-CG 3.26Å; Y336-D347 PolarHBondContact OH-OD1 3.36Å; Y336-D347 VanDerWaalsContact OH-OD1 3.11Å; Y336-D347 PolarHBondContact OH-OD2 2.66Å; V340-D347 HydrophobicContact CG2-CB 4.05Å; L345-D347 PolarHBondContact O-N 3Å; D347-Q349 PolarHBondContact O-N 2.82Å; D347-Q349 WeakPolarHBondContact OD1-CG 3.46Å; D347-Q349 PolarHBondContact OD1-NE2 3.46Å; D347-C350 HydrophobicContact CB-CB 4.47Å; D347-C350 PolarHBondContact O-N 3.3Å; D347-N351 PolarHBondContact O-N 3.2Å; D347-D358 WeakPolarHBondContact CA-OD2 3.45Å; D347-D358 VanDerWaalsContact CB-OD2 3.24Å; D347-D358 WeakPolarHBondContact CB-OD2 3.21Å; D347-D358 PolarHBondContact N-OD2 3.2Å
348	P	86.8	Confident	87.7	Confident	98 Å²	98	44.7 Å²	44.7	64%	0.636	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.6	-163.1	-21.7	34.3	0	0	0	113.6	C346 C350	C346-P348 WeakPolarHBondContact O-CD 3.49Å; P348-C350 VanDerWaalsContact C-N 3.27Å
349	Q	88	Confident	87.9	Confident	63 Å²	63	43.9 Å²	43.9	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.5	175.2	73.3	-170.4	-49.8	0	0	113.4	Y332 Y336 D347	Y332-Q349 VanDerWaalsContact CE1-O 3.26Å; Y332-Q349 WeakPolarHBondContact CE1-O 3.18Å; Y332-Q349 WeakPolarHBondContact OH-CB 3.49Å; Y332-Q349 PolarHBondContact OH-O 3.21Å; Y336-Q349 HydrophobicContact CD1-CG 4.45Å; Y336-Q349 HydrophobicContact CE1-CG 4.01Å; Y336-Q349 VanDerWaalsContact CE1-NE2 3.26Å; Y336-Q349 VanDerWaalsContact CZ-NE2 3.25Å; Y336-Q349 PolarHBondContact OH-NE2 3.13Å; D347-Q349 PolarHBondContact O-N 2.82Å; D347-Q349 WeakPolarHBondContact OD1-CG 3.46Å; D347-Q349 PolarHBondContact OD1-NE2 3.46Å
350	C	90.7	Very high	88.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-11.6	175.9	-64.1	0	0	0	0	112.8	Y336 C337 D347 P348 T352 C355 D358	Y336-C350 VanDerWaalsContact CD1-SG 3.57Å; C337-C350 WeakPolarHBondContact CA-SG 3.2Å; C337-C350 HydrophobicContact CB-CB 3.78Å; C337-C350 WeakPolarHBondContact CB-SG 3.41Å; C337-C350 VanDerWaalsContact SG-CA 3.59Å; C337-C350 WeakPolarHBondContact SG-CB 3.02Å; C337-C350 CovalentContact SG-SG 2.04Å; C337-C350 PolarHBondContact SG-SG 3.29Å; D347-C350 HydrophobicContact CB-CB 4.47Å; D347-C350 PolarHBondContact O-N 3.3Å; P348-C350 VanDerWaalsContact C-N 3.27Å; C350-T352 PolarHBondContact O-N 2.88Å; C350-C355 HydrophobicContact CB-CB 4.29Å; C350-C355 WeakPolarHBondContact O-CB 3.34Å; C350-D358 HydrophobicContact CB-CB 3.97Å; C350-D358 WeakPolarHBondContact CB-OD1 3.17Å; C350-D358 PolarHBondContact O-N 3.17Å; C350-D358 VanDerWaalsContact O-N 3.15Å
351	N	91	Very high	88.7	Confident	47 Å²	47	42 Å²	42	25%	0.251	22%	0.219	S	C	.	.			trans	-72.9	66.6	174	-173.2	12.6	0	0	0	112.5	D347 D358 C362 S514	D347-N351 PolarHBondContact O-N 3.2Å; N351-D358 HydrophobicContact CB-CB 4.36Å; N351-C362 HydrophobicContact CB-CB 4.15Å; N351-C362 WeakPolarHBondContact ND2-CB 3.45Å; N351-S514 PolarHBondContact OD1-OG 2.87Å
352	T	91.5	Very high	88.6	Confident	55 Å²	55	42.3 Å²	42.3	34%	0.337	22%	0.223	S	C	.	.	S	Bend	trans	-143	153.2	175.2	59.6	0	0	0	0	109.1	C350 D354 C355 L356 F357	C350-T352 PolarHBondContact O-N 2.88Å; T352-D354 PolarHBondContact O-N 3.11Å; T352-C355 CarbonylContact O-C 3.47Å; T352-C355 VanDerWaalsContact O-C 3.31Å; T352-C355 PolarHBondContact O-N 3.49Å; T352-C355 PolarHBondContact OG1-N 3.15Å; T352-L356 PolarHBondContact O-N 3.14Å; T352-F357 PolarHBondContact O-N 3.22Å
353	E	91.6	Very high	88.3	Confident	32 Å²	32	40.1 Å²	40.1	15%	0.15	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-58.4	-34.8	-179.8	-173.7	175.1	-151	0	0	112.4	C355 L356 F357 F516 T517 R521	E353-C355 VanDerWaalsContact C-N 3.28Å; E353-C355 PolarHBondContact O-N 2.03Å; E353-L356 PolarHBondContact O-N 3.21Å; E353-L356 VanDerWaalsContact O-N 3.13Å; E353-F357 HydrophobicContact CB-CE1 4.05Å; E353-F357 HydrophobicContact CB-CE2 4.04Å; E353-F357 HydrophobicContact CB-CZ 3.59Å; E353-F357 HydrophobicContact CG-CE2 4.1Å; E353-F357 HydrophobicContact CG-CZ 4.07Å; E353-F516 HydrophobicContact CG-CD1 4.2Å; E353-F516 VanDerWaalsContact OE1-CA 3.3Å; E353-F516 WeakPolarHBondContact OE1-CA 3.4Å; E353-T517 VanDerWaalsContact CD-OG1 3.26Å; E353-T517 PolarHBondContact OE1-N 2.82Å; E353-T517 PolarHBondContact OE1-OG1 3.21Å; E353-T517 WeakPolarHBondContact OE2-CB 3.16Å; E353-T517 WeakPolarHBondContact OE2-CG2 3.27Å; E353-T517 PolarHBondContact OE2-OG1 3.17Å; E353-R521 HydrophobicContact CG-CB 4.06Å; E353-R521 HydrophobicContact CG-CG 3.9Å; E353-R521 PolarHBondContact O-NH1 2.92Å; E353-R521 WeakPolarHBondContact OE1-CB 3.45Å; E353-R521 VanDerWaalsContact OE1-CG 3.28Å; E353-R521 WeakPolarHBondContact OE1-CG 3.42Å
354	D	91.7	Very high	87.6	Confident	65 Å²	65	47.3 Å²	47.3	35%	0.348	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-64	-31.5	176.7	-74.9	-42.5	0	0	0	114	Q330 C331 T352 R521	Q330-D354 HydrophobicContact CB-CB 4.38Å; Q330-D354 VanDerWaalsContact CB-OD1 3.3Å; Q330-D354 WeakPolarHBondContact CB-OD1 3.19Å; C331-D354 VanDerWaalsContact CA-O 3.3Å; C331-D354 WeakPolarHBondContact CA-O 3.46Å; C331-D354 VanDerWaalsContact CB-O 3.25Å; C331-D354 WeakPolarHBondContact CB-O 3.37Å; C331-D354 PolarHBondContact N-O 2.79Å; T352-D354 PolarHBondContact O-N 3.11Å; D354-R521 IonicContact OD1-CZ 3.81Å; D354-R521 IonicContact OD1-NH1 3.32Å; D354-R521 PolarHBondContact OD1-NH1 2.83Å; D354-R521 IonicContact OD1-NH2 2.87Å; D354-R521 PolarHBondContact OD1-NH2 3.44Å
355	C	92.1	Very high	86.5	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-104	22	175.1	-55.9	0	0	0	0	112	C331 C337 C350 T352 E353 F357 D358	C331-C355 VanDerWaalsContact CA-SG 3.5Å; C331-C355 HydrophobicContact CB-CB 3.89Å; C331-C355 WeakPolarHBondContact CB-SG 3.29Å; C331-C355 WeakPolarHBondContact SG-CB 3.24Å; C331-C355 CovalentContact SG-SG 2.04Å; C331-C355 PolarHBondContact SG-SG 2.73Å; C337-C355 HydrophobicContact CB-CB 4.06Å; C350-C355 HydrophobicContact CB-CB 4.29Å; C350-C355 WeakPolarHBondContact O-CB 3.34Å; T352-C355 CarbonylContact O-C 3.47Å; T352-C355 VanDerWaalsContact O-C 3.31Å; T352-C355 PolarHBondContact O-N 3.49Å; T352-C355 PolarHBondContact OG1-N 3.15Å; E353-C355 VanDerWaalsContact C-N 3.28Å; E353-C355 PolarHBondContact O-N 2.03Å; C355-F357 VanDerWaalsContact C-N 3.34Å; C355-F357 PolarHBondContact O-N 2.8Å; C355-D358 PolarHBondContact O-N 2.73Å
356	L	93	Very high	85.1	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	59.8	37.5	173.3	-53.8	176.9	0	0	0	114.3	P327 F328 F341 T352 E353 D358 G359 D524 F525 V528	P327-L356 HydrophobicContact CB-CD1 4.08Å; F328-L356 HydrophobicContact CD1-CD1 4.15Å; F328-L356 HydrophobicContact CD1-CG 4.37Å; F328-L356 HydrophobicContact CE1-CB 4.26Å; F328-L356 HydrophobicContact CE1-CD1 3.94Å; F328-L356 HydrophobicContact CE1-CG 4.29Å; F328-L356 HydrophobicContact CE2-CD1 4.38Å; F328-L356 HydrophobicContact CG-CD1 4.46Å; F328-L356 HydrophobicContact CZ-CD1 4.05Å; F341-L356 HydrophobicContact CD2-CB 4.13Å; F341-L356 HydrophobicContact CE2-CB 3.65Å; F341-L356 HydrophobicContact CE2-CD1 4.44Å; T352-L356 PolarHBondContact O-N 3.14Å; E353-L356 PolarHBondContact O-N 3.21Å; E353-L356 VanDerWaalsContact O-N 3.13Å; L356-D358 PolarHBondContact O-N 2.86Å; L356-D358 VanDerWaalsContact O-N 3.14Å; L356-G359 PolarHBondContact O-N 3.19Å; L356-D524 HydrophobicContact CD1-CB 4.37Å; L356-D524 HydrophobicContact CD2-CB 3.8Å; L356-F525 HydrophobicContact CB-CD2 4.23Å; L356-F525 HydrophobicContact CD2-CB 4.49Å; L356-V528 HydrophobicContact CD1-CG2 4.28Å
357	F	92.7	Very high	83.1	Confident	17 Å²	17	50.6 Å²	50.6	8%	0.075	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	52.7	30.2	179.1	-60.9	-66	0	0	0	114.5	T352 E353 C355 G359 F360 S515 F516	T352-F357 PolarHBondContact O-N 3.22Å; E353-F357 HydrophobicContact CB-CE1 4.05Å; E353-F357 HydrophobicContact CB-CE2 4.04Å; E353-F357 HydrophobicContact CB-CZ 3.59Å; E353-F357 HydrophobicContact CG-CE2 4.1Å; E353-F357 HydrophobicContact CG-CZ 4.07Å; C355-F357 VanDerWaalsContact C-N 3.34Å; C355-F357 PolarHBondContact O-N 2.8Å; F357-G359 PolarHBondContact O-N 3.44Å; F357-G359 VanDerWaalsContact O-N 3.14Å; F357-F360 HydrophobicContact CB-CD1 3.72Å; F357-F360 HydrophobicContact CB-CE1 3.56Å; F357-F360 HydrophobicContact CB-CZ 4.29Å; F357-F360 AromaticContact CD2-CE1 3.64Å; F357-F360 HydrophobicContact CD2-CE1 3.64Å; F357-F360 AromaticContact CD2-CZ 3.9Å; F357-F360 HydrophobicContact CD2-CZ 3.9Å; F357-F360 HydrophobicContact CG-CD1 4.41Å; F357-F360 AromaticContact CG-CE1 3.8Å; F357-F360 HydrophobicContact CG-CE1 3.8Å; F357-F360 HydrophobicContact CG-CZ 4.45Å; F357-F360 WeakPolarHBondContact O-CA 2.99Å; F357-F360 PolarHBondContact O-N 3.13Å; F357-S515 WeakPolarHBondContact CZ-O 3.32Å; F357-F516 HydrophobicContact CD2-CD1 4.15Å; F357-F516 AromaticContact CD2-CE1 3.84Å; F357-F516 HydrophobicContact CD2-CE1 3.84Å; F357-F516 HydrophobicContact CD2-CZ 4.05Å; F357-F516 AromaticContact CE2-CD1 3.67Å; F357-F516 HydrophobicContact CE2-CD1 3.67Å; F357-F516 HydrophobicContact CE2-CD2 4.48Å; F357-F516 AromaticContact CE2-CE1 3.85Å; F357-F516 HydrophobicContact CE2-CE1 3.85Å; F357-F516 HydrophobicContact CE2-CG 4.02Å; F357-F516 HydrophobicContact CE2-CZ 4.34Å
358	D	91.1	Very high	81.2	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	54.6	28.6	-175.7	-156.3	40.8	0	0	0	113.4	D347 C350 N351 C355 L356 F360 D361	D347-D358 WeakPolarHBondContact CA-OD2 3.45Å; D347-D358 VanDerWaalsContact CB-OD2 3.24Å; D347-D358 WeakPolarHBondContact CB-OD2 3.21Å; D347-D358 PolarHBondContact N-OD2 3.2Å; C350-D358 HydrophobicContact CB-CB 3.97Å; C350-D358 WeakPolarHBondContact CB-OD1 3.17Å; C350-D358 PolarHBondContact O-N 3.17Å; C350-D358 VanDerWaalsContact O-N 3.15Å; N351-D358 HydrophobicContact CB-CB 4.36Å; C355-D358 PolarHBondContact O-N 2.73Å; L356-D358 PolarHBondContact O-N 2.86Å; L356-D358 VanDerWaalsContact O-N 3.14Å; D358-F360 PolarHBondContact O-N 2.81Å; D358-D361 PolarHBondContact O-N 2.66Å
359	G	89.4	Confident	79.3	Confident	3 Å²	3	61 Å²	61	3%	0.031	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	73.1	8.3	-177.1	0	0	0	0	0	114.9	F341 R342 L356 F357	F341-G359 VanDerWaalsContact CD2-CA 3.47Å; F341-G359 VanDerWaalsContact CE2-N 3.35Å; R342-G359 WeakPolarHBondContact CD-O 3.41Å; R342-G359 VanDerWaalsContact CG-CA 3.45Å; L356-G359 PolarHBondContact O-N 3.19Å; F357-G359 PolarHBondContact O-N 3.44Å; F357-G359 VanDerWaalsContact O-N 3.14Å
360	F	90.7	Very high	77.5	Confident	17 Å²	17	61.7 Å²	61.7	8%	0.075	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	75.2	13.9	-171.6	-56.8	-64.2	0	0	0	116.6	F357 D358 C362 L363 L443 Q444 S514 F516 F525	F357-F360 HydrophobicContact CB-CD1 3.72Å; F357-F360 HydrophobicContact CB-CE1 3.56Å; F357-F360 HydrophobicContact CB-CZ 4.29Å; F357-F360 AromaticContact CD2-CE1 3.64Å; F357-F360 HydrophobicContact CD2-CE1 3.64Å; F357-F360 AromaticContact CD2-CZ 3.9Å; F357-F360 HydrophobicContact CD2-CZ 3.9Å; F357-F360 HydrophobicContact CG-CD1 4.41Å; F357-F360 AromaticContact CG-CE1 3.8Å; F357-F360 HydrophobicContact CG-CE1 3.8Å; F357-F360 HydrophobicContact CG-CZ 4.45Å; F357-F360 WeakPolarHBondContact O-CA 2.99Å; F357-F360 PolarHBondContact O-N 3.13Å; D358-F360 PolarHBondContact O-N 2.81Å; F360-C362 PolarHBondContact O-N 2.96Å; F360-L363 HydrophobicContact CB-CD1 4.1Å; F360-L363 HydrophobicContact CB-CG 4.44Å; F360-L363 HydrophobicContact CD1-CD1 3.49Å; F360-L363 VanDerWaalsContact CD1-CD1 3.49Å; F360-L363 HydrophobicContact CD1-CG 4.24Å; F360-L363 HydrophobicContact CE1-CD1 4.22Å; F360-L363 HydrophobicContact CG-CD1 4.08Å; F360-L363 PolarHBondContact O-N 2.93Å; F360-L443 WeakPolarHBondContact CZ-O 3.35Å; F360-Q444 HydrophobicContact CD1-CG 4.3Å; F360-Q444 HydrophobicContact CD2-CG 4.24Å; F360-Q444 HydrophobicContact CE1-CB 4.35Å; F360-Q444 HydrophobicContact CE1-CG 4.46Å; F360-Q444 HydrophobicContact CE2-CB 4.47Å; F360-Q444 HydrophobicContact CE2-CG 4.42Å; F360-Q444 HydrophobicContact CG-CG 4.18Å; F360-Q444 HydrophobicContact CZ-CB 4.24Å; F360-S514 WeakPolarHBondContact CE1-O 3.44Å; F360-F516 HydrophobicContact CE2-CE2 4.08Å; F360-F516 HydrophobicContact CE2-CZ 4.27Å; F360-F516 HydrophobicContact CZ-CD2 4.48Å; F360-F516 AromaticContact CZ-CE2 3.63Å; F360-F516 HydrophobicContact CZ-CE2 3.63Å; F360-F516 AromaticContact CZ-CZ 3.91Å; F360-F516 HydrophobicContact CZ-CZ 3.91Å; F360-F525 AromaticContact CD2-CE2 3.69Å; F360-F525 HydrophobicContact CD2-CE2 3.69Å; F360-F525 AromaticContact CD2-CZ 3.69Å; F360-F525 HydrophobicContact CD2-CZ 3.69Å; F360-F525 HydrophobicContact CE2-CD2 4.3Å; F360-F525 AromaticContact CE2-CE2 3.54Å; F360-F525 HydrophobicContact CE2-CE2 3.54Å; F360-F525 AromaticContact CE2-CZ 3.71Å; F360-F525 HydrophobicContact CE2-CZ 3.71Å; F360-F525 HydrophobicContact CZ-CE2 4.46Å
361	D	87.3	Confident	75.7	Confident	31 Å²	31	68.3 Å²	68.3	17%	0.166	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.3	177.7	-63.7	-13.9	0	0	0	113.3	R342 N343 E344 D358	R342-D361 VanDerWaalsContact C-OD2 3.3Å; R342-D361 WeakPolarHBondContact CA-OD2 3.11Å; R342-D361 PolarHBondContact N-OD2 2.75Å; R342-D361 VanDerWaalsContact N-OD2 3.13Å; N343-D361 PolarHBondContact N-OD2 3.42Å; N343-D361 PolarHBondContact OD1-OD2 3.22Å; E344-D361 PolarHBondContact N-OD2 2.77Å; D358-D361 PolarHBondContact O-N 2.66Å
362	C	86.7	Confident	74	Confident	24 Å²	24	73.9 Å²	73.9	16%	0.162	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-0.4	170.8	-68.7	0	0	0	0	115.7	C346 N351 F360	C346-C362 WeakPolarHBondContact CA-SG 3.09Å; C346-C362 HydrophobicContact CB-CB 3.88Å; C346-C362 WeakPolarHBondContact CB-SG 3.27Å; C346-C362 WeakPolarHBondContact SG-CA 3.45Å; C346-C362 WeakPolarHBondContact SG-CB 3.45Å; C346-C362 CovalentContact SG-SG 2.04Å; C346-C362 PolarHBondContact SG-SG 2.79Å; N351-C362 HydrophobicContact CB-CB 4.15Å; N351-C362 WeakPolarHBondContact ND2-CB 3.45Å; F360-C362 PolarHBondContact O-N 2.96Å
363	L	80.9	Confident	72.6	Confident	36 Å²	36	72.2 Å²	72.2	19%	0.188	35%	0.349	C	S	.	.			trans	-99	113.3	175.3	-66.6	-178.6	0	0	0	110.8	F360 I365 Q444 A513	F360-L363 HydrophobicContact CB-CD1 4.1Å; F360-L363 HydrophobicContact CB-CG 4.44Å; F360-L363 HydrophobicContact CD1-CD1 3.49Å; F360-L363 VanDerWaalsContact CD1-CD1 3.49Å; F360-L363 HydrophobicContact CD1-CG 4.24Å; F360-L363 HydrophobicContact CE1-CD1 4.22Å; F360-L363 HydrophobicContact CG-CD1 4.08Å; F360-L363 PolarHBondContact O-N 2.93Å; L363-I365 HydrophobicContact CB-CG1 4.43Å; L363-I365 PolarHBondContact O-N 3.36Å; L363-I365 VanDerWaalsContact O-N 3.16Å; L363-Q444 HydrophobicContact CD1-CB 4.42Å; L363-Q444 HydrophobicContact CD1-CG 3.77Å; L363-A513 HydrophobicContact CD2-CB 3.85Å
364	K	64.6	Low	71.8	Confident	210 Å²	210	74.4 Å²	74.4	91%	0.913	36%	0.359	S	S	*	.			trans	-75.4	101	168.1	-64.6	-165.3	175.2	-162.2	0	109.2
365	I	58.6	Low	71.4	Confident	80 Å²	80	77.2 Å²	77.2	41%	0.41	37%	0.368	S	S	.	.			trans	-92.3	111	175.6	-55.3	172	0	0	0	108.7	L363 N367	L363-I365 HydrophobicContact CB-CG1 4.43Å; L363-I365 PolarHBondContact O-N 3.36Å; L363-I365 VanDerWaalsContact O-N 3.16Å; I365-N367 WeakPolarHBondContact CG2-OD1 2.99Å; I365-N367 PolarHBondContact O-N 2.03Å; I365-N367 VanDerWaalsContact O-N 3.13Å
366	E	51.9	Low	71.1	Confident	178 Å²	178	81.5 Å²	81.5	83%	0.832	39%	0.385	S	S	*	.			trans	-77.7	92.1	171.5	-68.4	176.7	169.5	0	0	109.2	E368	E366-E368 PolarHBondContact O-N 2.76Å
367	N	47.1	Very low	70.9	Confident	100 Å²	100	81.4 Å²	81.4	54%	0.535	39%	0.385	S	S	.	.			trans	-85.2	89.5	177.8	-80.5	-33.1	0	0	0	111.3	I365 Y369	I365-N367 WeakPolarHBondContact CG2-OD1 2.99Å; I365-N367 PolarHBondContact O-N 2.03Å; I365-N367 VanDerWaalsContact O-N 3.13Å; N367-Y369 PolarHBondContact O-N 2.04Å
368	E	48.1	Very low	70.7	Confident	162 Å²	162	82.6 Å²	82.6	76%	0.757	39%	0.39	S	S	*	.			trans	-70	104.8	162.5	-71.7	-163.8	129.3	0	0	110	E366 I370	E366-E368 PolarHBondContact O-N 2.76Å; E368-I370 PolarHBondContact O-N 3.29Å; E368-I370 VanDerWaalsContact O-N 3.1Å
369	Y	47.6	Very low	70.6	Confident	161 Å²	161	87.1 Å²	87.1	63%	0.631	42%	0.418	S	S	*	.			trans	-83.3	88	-171.7	-140.5	-84.6	0	0	0	112.2	N367 H371	N367-Y369 PolarHBondContact O-N 2.04Å; Y369-H371 PolarHBondContact O-N 2.89Å; Y369-H371 VanDerWaalsContact O-N 3.08Å
370	I	48.8	Very low	70.6	Confident	77 Å²	77	91.3 Å²	91.3	40%	0.395	43%	0.433	S	S	.	.			trans	-77.2	95.5	176.9	-56.6	-177.9	0	0	0	109.8	E368 N372 S373 M392 Y395	E368-I370 PolarHBondContact O-N 3.29Å; E368-I370 VanDerWaalsContact O-N 3.1Å; I370-N372 PolarHBondContact O-N 3.08Å; I370-N372 VanDerWaalsContact O-N 3.1Å; I370-S373 WeakPolarHBondContact CG2-OG 3.01Å; I370-M392 HydrophobicContact CD1-CE 3.93Å; I370-M392 HydrophobicContact CD1-SD 4Å; I370-Y395 PolarHBondContact O-OH 2.97Å
371	H	53.7	Low	70.5	Confident	139 Å²	139	90.8 Å²	90.8	64%	0.644	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-5.6	-166.3	-141	-41	0	0	0	115.9	Y369	Y369-H371 PolarHBondContact O-N 2.89Å; Y369-H371 VanDerWaalsContact O-N 3.08Å
372	N	54.4	Low	70.4	Confident	164 Å²	164	89.6 Å²	89.6	88%	0.877	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-16.4	-169.2	-69.9	-13.6	0	0	0	115.1	I370	I370-N372 PolarHBondContact O-N 3.08Å; I370-N372 VanDerWaalsContact O-N 3.1Å
373	S	62.1	Low	70.4	Confident	19 Å²	19	92 Å²	92	13%	0.133	44%	0.439	C	S	.	.	S	Bend	trans	-112.1	-6.7	-166.9	33.7	0	0	0	0	115.1	I370 K375 Y376 C377 Y395	I370-S373 WeakPolarHBondContact CG2-OG 3.01Å; S373-K375 PolarHBondContact O-N 3.27Å; S373-Y376 WeakPolarHBondContact O-CB 3.3Å; S373-Y376 PolarHBondContact O-N 3.11Å; S373-C377 PolarHBondContact O-N 3.12Å; S373-C377 VanDerWaalsContact O-N 3.12Å; S373-Y395 PolarHBondContact OG-OH 3.42Å
374	E	75.2	Confident	70.7	Confident	79 Å²	79	92.9 Å²	92.9	37%	0.369	46%	0.456	S	S	.	.	H	α-helix	trans	-50	-57.5	-172.1	-175.4	178.9	-159.2	0	0	112.9	Y376 C377 E378 Y395	E374-Y376 VanDerWaalsContact C-N 3.25Å; E374-Y376 PolarHBondContact O-N 3.06Å; E374-C377 PolarHBondContact O-N 2.79Å; E374-C377 VanDerWaalsContact O-N 3.17Å; E374-E378 WeakPolarHBondContact O-CG 3.27Å; E374-E378 PolarHBondContact O-N 2.88Å; E374-Y395 HydrophobicContact CB-CE1 4.38Å; E374-Y395 PolarHBondContact N-OH 2.9Å
375	K	83.2	Confident	72	Confident	123 Å²	123	85.8 Å²	85.8	54%	0.535	43%	0.433	S	S	.	.	H	α-helix	trans	-68.7	-19.4	-178	-170.3	164.9	-172.9	170.4	0	114.4	S373 V379 W1072	S373-K375 PolarHBondContact O-N 3.27Å; K375-V379 WeakPolarHBondContact O-CG2 3.13Å; K375-W1072 VanDerWaalsContact NZ-CH2 3.32Å
376	Y	87.1	Confident	73.6	Confident	90 Å²	90	84.7 Å²	84.7	35%	0.353	43%	0.432	S	S	.	.	H	α-helix	trans	-72.2	-50.5	171.3	171.9	-97.5	0	0	0	109.4	S373 E374 E378 V379 Y380 N387 E389	S373-Y376 WeakPolarHBondContact O-CB 3.3Å; S373-Y376 PolarHBondContact O-N 3.11Å; E374-Y376 VanDerWaalsContact C-N 3.25Å; E374-Y376 PolarHBondContact O-N 3.06Å; Y376-E378 PolarHBondContact O-N 3.16Å; Y376-V379 PolarHBondContact O-N 3.28Å; Y376-V379 VanDerWaalsContact O-N 3.15Å; Y376-Y380 AromaticContact CD2-CD2 3.89Å; Y376-Y380 HydrophobicContact CD2-CD2 3.89Å; Y376-Y380 AromaticContact CD2-CE2 3.63Å; Y376-Y380 HydrophobicContact CD2-CE2 3.63Å; Y376-Y380 HydrophobicContact CE1-CD2 4.45Å; Y376-Y380 AromaticContact CE2-CD2 3.68Å; Y376-Y380 HydrophobicContact CE2-CD2 3.68Å; Y376-Y380 AromaticContact CE2-CE2 3.38Å; Y376-Y380 HydrophobicContact CE2-CE2 3.38Å; Y376-Y380 HydrophobicContact CG-CD2 4.36Å; Y376-Y380 AromaticContact CZ-CD2 3.98Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.43Å; Y376-Y380 PolarHBondContact O-N 3.1Å; Y376-N387 HydrophobicContact CE1-CB 4.48Å; Y376-E389 HydrophobicContact CE1-CB 4.35Å
377	C	88.9	Confident	75.4	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-66.7	-34.4	179	-60.3	0	0	0	0	113.2	S373 E374 V379 Y380 A381 C390 Y395 I437	S373-C377 PolarHBondContact O-N 3.12Å; S373-C377 VanDerWaalsContact O-N 3.12Å; E374-C377 PolarHBondContact O-N 2.79Å; E374-C377 VanDerWaalsContact O-N 3.17Å; C377-V379 PolarHBondContact O-N 3.11Å; C377-Y380 PolarHBondContact O-N 2.8Å; C377-A381 WeakPolarHBondContact O-CB 3.25Å; C377-A381 PolarHBondContact O-N 3.49Å; C377-C390 WeakPolarHBondContact CA-SG 3.2Å; C377-C390 HydrophobicContact CB-CB 3.84Å; C377-C390 WeakPolarHBondContact CB-SG 3.2Å; C377-C390 VanDerWaalsContact SG-CA 3.5Å; C377-C390 WeakPolarHBondContact SG-CB 3.37Å; C377-C390 CovalentContact SG-SG 2.04Å; C377-C390 PolarHBondContact SG-SG 2.78Å; C377-Y395 HydrophobicContact CB-CD1 3.97Å; C377-Y395 HydrophobicContact CB-CD2 4.1Å; C377-Y395 HydrophobicContact CB-CE1 4.47Å; C377-Y395 HydrophobicContact CB-CG 3.78Å; C377-Y395 WeakPolarHBondContact SG-CD2 3.36Å; C377-I437 HydrophobicContact CB-CD1 4.43Å
378	E	88.5	Confident	77.4	Confident	41 Å²	41	79.3 Å²	79.3	19%	0.192	40%	0.404	C	S	.	.	H	α-helix	trans	-56.2	-30.3	171.6	-75.8	-173.1	132	0	0	114.2	E374 Y376 G433 R434	E374-E378 WeakPolarHBondContact O-CG 3.27Å; E374-E378 PolarHBondContact O-N 2.88Å; Y376-E378 PolarHBondContact O-N 3.16Å; E378-G433 VanDerWaalsContact O-CA 3.29Å; E378-G433 WeakPolarHBondContact O-CA 3.4Å; E378-R434 HydrophobicContact CG-CB 4.12Å; E378-R434 HydrophobicContact CG-CG 4.41Å; E378-R434 WeakPolarHBondContact OE1-CD 3.18Å; E378-R434 WeakPolarHBondContact OE1-CG 3.35Å; E378-R434 IonicContact OE1-CZ 3.47Å; E378-R434 IonicContact OE1-NE 3.48Å; E378-R434 IonicContact OE1-NH1 3.6Å; E378-R434 PolarHBondContact OE1-NH1 2.9Å
379	V	87.8	Confident	79.1	Confident	95 Å²	95	77.9 Å²	77.9	58%	0.576	40%	0.398	S	S	*	.	H	α-helix	trans	-84.8	-36.5	-175.6	167.4	0	0	0	0	112.3	K375 Y376 C377	K375-V379 WeakPolarHBondContact O-CG2 3.13Å; Y376-V379 PolarHBondContact O-N 3.28Å; Y376-V379 VanDerWaalsContact O-N 3.15Å; C377-V379 PolarHBondContact O-N 3.11Å
380	Y	89.4	Confident	81	Confident	92 Å²	92	70.2 Å²	70.2	36%	0.361	37%	0.368	S	S	.	.	H	α-helix	trans	-101.1	-19.6	-173.8	-65.8	-76	0	0	0	114.6	Y376 C377 G382 D383 N387	Y376-Y380 AromaticContact CD2-CD2 3.89Å; Y376-Y380 HydrophobicContact CD2-CD2 3.89Å; Y376-Y380 AromaticContact CD2-CE2 3.63Å; Y376-Y380 HydrophobicContact CD2-CE2 3.63Å; Y376-Y380 HydrophobicContact CE1-CD2 4.45Å; Y376-Y380 AromaticContact CE2-CD2 3.68Å; Y376-Y380 HydrophobicContact CE2-CD2 3.68Å; Y376-Y380 AromaticContact CE2-CE2 3.38Å; Y376-Y380 HydrophobicContact CE2-CE2 3.38Å; Y376-Y380 HydrophobicContact CG-CD2 4.36Å; Y376-Y380 AromaticContact CZ-CD2 3.98Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.43Å; Y376-Y380 PolarHBondContact O-N 3.1Å; C377-Y380 PolarHBondContact O-N 2.8Å; Y380-G382 PolarHBondContact O-N 2.76Å; Y380-G382 VanDerWaalsContact O-N 3.09Å; Y380-D383 VanDerWaalsContact O-CB 3.32Å; Y380-D383 WeakPolarHBondContact O-CB 3.41Å; Y380-D383 PolarHBondContact O-N 3.28Å; Y380-N387 WeakPolarHBondContact CB-ND2 3.35Å; Y380-N387 VanDerWaalsContact CG-ND2 3.32Å
381	A	89	Confident	82.9	Confident	5 Å²	5	68.9 Å²	68.9	4%	0.041	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	116.7	-175.2	0	0	0	0	0	113	C377 I437	C377-A381 WeakPolarHBondContact O-CB 3.25Å; C377-A381 PolarHBondContact O-N 3.49Å; A381-I437 HydrophobicContact CB-CD1 3.8Å; A381-I437 HydrophobicContact CB-CG1 3.93Å
382	G	85.5	Confident	84.3	Confident	6 Å²	6	64.8 Å²	64.8	6%	0.062	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	17.3	-179.7	0	0	0	0	0	114.3	Y380 D401 K457	Y380-G382 PolarHBondContact O-N 2.76Å; Y380-G382 VanDerWaalsContact O-N 3.09Å; G382-D401 WeakPolarHBondContact CA-OD2 3.19Å; G382-D401 PolarHBondContact N-OD2 2.85Å; G382-D401 VanDerWaalsContact N-OD2 3.08Å; G382-K457 WeakPolarHBondContact O-CE 3.45Å; G382-K457 PolarHBondContact O-NZ 3.42Å
383	D	87.3	Confident	85.4	Confident	76 Å²	76	60.7 Å²	60.7	41%	0.406	32%	0.324	S	S	.	.	S	Bend	trans	-73.3	-25.6	175	96.1	-4.6	0	0	0	113.9	Y380 S385 D401	Y380-D383 VanDerWaalsContact O-CB 3.32Å; Y380-D383 WeakPolarHBondContact O-CB 3.41Å; Y380-D383 PolarHBondContact O-N 3.28Å; D383-S385 WeakPolarHBondContact OD1-CB 3.5Å; D383-S385 PolarHBondContact OD1-N 2.89Å; D383-S385 PolarHBondContact OD1-OG 2.04Å; D383-D401 PolarHBondContact N-OD2 3.42Å
384	G	86.6	Confident	86.2	Confident	54 Å²	54	60.9 Å²	60.9	56%	0.557	32%	0.324	S	S	*	.	S	Bend	trans	117.3	-5	-175.4	0	0	0	0	0	115	D401	G384-D401 WeakPolarHBondContact CA-OD1 3.42Å; G384-D401 VanDerWaalsContact N-CG 3.29Å; G384-D401 PolarHBondContact N-OD1 3.3Å; G384-D401 PolarHBondContact N-OD2 2.88Å
385	S	90.7	Very high	86.7	Confident	61 Å²	61	58 Å²	58	43%	0.427	31%	0.31	S	S	.	.	S	Bend	trans	-111.2	130.6	-176.8	-39.2	0	0	0	0	110	D383 N387 D398 D401	D383-S385 WeakPolarHBondContact OD1-CB 3.5Å; D383-S385 PolarHBondContact OD1-N 2.89Å; D383-S385 PolarHBondContact OD1-OG 2.04Å; S385-N387 PolarHBondContact O-N 3.49Å; S385-D398 VanDerWaalsContact O-OD2 3.13Å; S385-D401 WeakPolarHBondContact O-CB 3.2Å
386	C	92.4	Very high	86.9	Confident	57 Å²	57	52.2 Å²	52.2	39%	0.385	29%	0.285	S	S	.	.			trans	-76.7	114.8	175.9	172	0	0	0	0	111.3	C402	C386-C402 WeakPolarHBondContact CA-SG 3.4Å; C386-C402 HydrophobicContact CB-CB 3.91Å; C386-C402 WeakPolarHBondContact CB-SG 3.47Å; C386-C402 WeakPolarHBondContact SG-CA 3.32Å; C386-C402 WeakPolarHBondContact SG-CB 3.36Å; C386-C402 CovalentContact SG-SG 2.04Å; C386-C402 PolarHBondContact SG-SG 3.44Å
387	N	90.3	Very high	86.9	Confident	28 Å²	28	49.2 Å²	49.2	15%	0.15	27%	0.274	C	S	.	.			trans	-103.8	102.8	171.1	-71.9	-14.9	0	0	0	109.9	Y376 Y380 S385 E389 C390 N391 D398	Y376-N387 HydrophobicContact CE1-CB 4.48Å; Y380-N387 WeakPolarHBondContact CB-ND2 3.35Å; Y380-N387 VanDerWaalsContact CG-ND2 3.32Å; S385-N387 PolarHBondContact O-N 3.49Å; N387-E389 PolarHBondContact O-N 2.92Å; N387-E389 VanDerWaalsContact O-N 3.15Å; N387-C390 HydrophobicContact CB-CB 4.32Å; N387-C390 WeakPolarHBondContact O-CA 3.05Å; N387-C390 PolarHBondContact O-N 2.72Å; N387-N391 PolarHBondContact O-N 3.27Å; N387-D398 PolarHBondContact N-OD2 3.48Å
388	E	88.2	Confident	87	Confident	137 Å²	137	49.2 Å²	49.2	64%	0.64	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-59.9	-28.3	-176.7	-61.3	-72.7	-164.4	0	0	113.3	C390 N391	E388-C390 PolarHBondContact O-N 3.06Å; E388-N391 WeakPolarHBondContact O-CB 3.01Å; E388-N391 PolarHBondContact O-N 3.34Å; E388-N391 PolarHBondContact OE2-ND2 3.27Å
389	E	84.9	Confident	87	Confident	132 Å²	132	47.3 Å²	47.3	62%	0.617	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.4	173.2	-64.2	-175.2	-176.5	0	0	113.3	Y376 N387 M392	Y376-E389 HydrophobicContact CE1-CB 4.35Å; N387-E389 PolarHBondContact O-N 2.92Å; N387-E389 VanDerWaalsContact O-N 3.15Å; E389-M392 WeakPolarHBondContact O-CE 3.49Å
390	C	88	Confident	87.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-106.1	-1.2	176.8	-57.7	0	0	0	0	113	C377 N387 E388 M392 D398	C377-C390 WeakPolarHBondContact CA-SG 3.2Å; C377-C390 HydrophobicContact CB-CB 3.84Å; C377-C390 WeakPolarHBondContact CB-SG 3.2Å; C377-C390 VanDerWaalsContact SG-CA 3.5Å; C377-C390 WeakPolarHBondContact SG-CB 3.37Å; C377-C390 CovalentContact SG-SG 2.04Å; C377-C390 PolarHBondContact SG-SG 2.78Å; N387-C390 HydrophobicContact CB-CB 4.32Å; N387-C390 WeakPolarHBondContact O-CA 3.05Å; N387-C390 PolarHBondContact O-N 2.72Å; E388-C390 PolarHBondContact O-N 3.06Å; C390-M392 PolarHBondContact O-N 2.98Å; C390-D398 HydrophobicContact CB-CB 4.02Å; C390-D398 WeakPolarHBondContact CB-OD1 3.41Å; C390-D398 PolarHBondContact O-N 2.95Å
391	N	87.2	Confident	87.2	Confident	49 Å²	49	38.9 Å²	38.9	26%	0.262	22%	0.223	S	C	.	.			trans	-80.4	47.2	-175.2	-166.3	10.5	0	0	0	112.7	N387 E388 C402	N387-N391 PolarHBondContact O-N 3.27Å; E388-N391 WeakPolarHBondContact O-CB 3.01Å; E388-N391 PolarHBondContact O-N 3.34Å; E388-N391 PolarHBondContact OE2-ND2 3.27Å; N391-C402 HydrophobicContact CB-CB 4.46Å
392	M	83.2	Confident	87.3	Confident	53 Å²	53	39.8 Å²	39.8	26%	0.261	23%	0.229	S	C	.	.	S	Bend	trans	-133.8	164.8	-177	63.2	176.8	72.2	0	0	112.4	I370 E389 C390 T394 Y395 N396 F397	I370-M392 HydrophobicContact CD1-CE 3.93Å; I370-M392 HydrophobicContact CD1-SD 4Å; E389-M392 WeakPolarHBondContact O-CE 3.49Å; C390-M392 PolarHBondContact O-N 2.98Å; M392-T394 WeakPolarHBondContact CG-OG1 3.18Å; M392-T394 PolarHBondContact O-N 2.94Å; M392-T394 PolarHBondContact SD-OG1 2.77Å; M392-T394 VanDerWaalsContact SD-OG1 3.34Å; M392-Y395 HydrophobicContact CG-CD2 3.65Å; M392-Y395 HydrophobicContact CG-CE2 4.29Å; M392-Y395 HydrophobicContact CG-CG 4.41Å; M392-Y395 CarbonylContact O-C 3.55Å; M392-Y395 PolarHBondContact O-N 2.94Å; M392-Y395 HydrophobicContact SD-CD2 3.79Å; M392-Y395 HydrophobicContact SD-CE2 3.79Å; M392-N396 PolarHBondContact O-N 2.88Å; M392-F397 PolarHBondContact O-N 3.03Å
393	T	77.6	Confident	87.4	Confident	78 Å²	78	40.2 Å²	40.2	48%	0.479	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-57.1	-43.1	-175.3	42.6	0	0	0	0	113.6	Y395 N396 F397 N441	T393-Y395 VanDerWaalsContact C-N 3.28Å; T393-Y395 PolarHBondContact O-N 3.02Å; T393-N396 PolarHBondContact O-N 3Å; T393-N396 VanDerWaalsContact O-N 3.15Å; T393-F397 HydrophobicContact CG2-CE1 4.39Å; T393-F397 HydrophobicContact CG2-CE2 3.92Å; T393-F397 HydrophobicContact CG2-CZ 3.51Å; T393-N441 PolarHBondContact O-OD1 2.88Å
394	T	79.9	Confident	87.4	Confident	22 Å²	22	40.3 Å²	40.3	14%	0.135	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-62.6	-31.8	-178.3	49.4	0	0	0	0	113.2	M392 N441	M392-T394 WeakPolarHBondContact CG-OG1 3.18Å; M392-T394 PolarHBondContact O-N 2.94Å; M392-T394 PolarHBondContact SD-OG1 2.77Å; M392-T394 VanDerWaalsContact SD-OG1 3.34Å; T394-N441 PolarHBondContact O-ND2 3.49Å
395	Y	85.5	Confident	87.3	Confident	18 Å²	18	42.4 Å²	42.4	7%	0.071	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-104.7	23	177.1	-52.5	-49.8	0	0	0	112.9	I370 S373 E374 C377 M392 T393 F397 D398	I370-Y395 PolarHBondContact O-OH 2.97Å; S373-Y395 PolarHBondContact OG-OH 3.42Å; E374-Y395 HydrophobicContact CB-CE1 4.38Å; E374-Y395 PolarHBondContact N-OH 2.9Å; C377-Y395 HydrophobicContact CB-CD1 3.97Å; C377-Y395 HydrophobicContact CB-CD2 4.1Å; C377-Y395 HydrophobicContact CB-CE1 4.47Å; C377-Y395 HydrophobicContact CB-CG 3.78Å; C377-Y395 WeakPolarHBondContact SG-CD2 3.36Å; M392-Y395 HydrophobicContact CG-CD2 3.65Å; M392-Y395 HydrophobicContact CG-CE2 4.29Å; M392-Y395 HydrophobicContact CG-CG 4.41Å; M392-Y395 CarbonylContact O-C 3.55Å; M392-Y395 PolarHBondContact O-N 2.94Å; M392-Y395 HydrophobicContact SD-CD2 3.79Å; M392-Y395 HydrophobicContact SD-CE2 3.79Å; T393-Y395 VanDerWaalsContact C-N 3.28Å; T393-Y395 PolarHBondContact O-N 3.02Å; Y395-F397 VanDerWaalsContact C-N 3.31Å; Y395-F397 PolarHBondContact O-N 3.21Å; Y395-D398 PolarHBondContact O-N 3.48Å
396	N	86.8	Confident	87.1	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.011	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	52.1	41	178.6	-165.6	27.6	0	0	0	114.6	M392 T393 D398 S399 L436 G440 N441 A445	M392-N396 PolarHBondContact O-N 2.88Å; T393-N396 PolarHBondContact O-N 3Å; T393-N396 VanDerWaalsContact O-N 3.15Å; N396-D398 VanDerWaalsContact C-N 3.35Å; N396-D398 PolarHBondContact O-N 2.03Å; N396-S399 WeakPolarHBondContact O-CA 3.42Å; N396-S399 PolarHBondContact O-N 2.81Å; N396-L436 PolarHBondContact ND2-O 2.95Å; N396-G440 WeakPolarHBondContact ND2-CA 3.23Å; N396-N441 WeakPolarHBondContact CB-OD1 3.46Å; N396-A445 PolarHBondContact ND2-O 2.88Å; N396-A445 PolarHBondContact OD1-O 2.75Å
397	F	88.1	Confident	86.7	Confident	28 Å²	28	46.6 Å²	46.6	12%	0.123	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	51.2	50.6	-179.7	-57	-86.3	0	0	0	112.8	M392 T393 Y395 S399 G400 I446 I508 Y510	M392-F397 PolarHBondContact O-N 3.03Å; T393-F397 HydrophobicContact CG2-CE1 4.39Å; T393-F397 HydrophobicContact CG2-CE2 3.92Å; T393-F397 HydrophobicContact CG2-CZ 3.51Å; Y395-F397 VanDerWaalsContact C-N 3.31Å; Y395-F397 PolarHBondContact O-N 3.21Å; F397-S399 PolarHBondContact O-N 3.19Å; F397-G400 PolarHBondContact O-N 3.48Å; F397-I446 HydrophobicContact CB-CD1 4.17Å; F397-I508 HydrophobicContact CD2-CG1 4.32Å; F397-I508 HydrophobicContact CD2-CG2 4.09Å; F397-I508 HydrophobicContact CE2-CB 4.5Å; F397-I508 HydrophobicContact CE2-CD1 4.13Å; F397-I508 HydrophobicContact CE2-CG1 4.2Å; F397-I508 HydrophobicContact CE2-CG2 3.49Å; F397-I508 VanDerWaalsContact CE2-CG2 3.49Å; F397-I508 HydrophobicContact CZ-CG2 3.92Å; F397-Y510 HydrophobicContact CE1-CD2 4.18Å
398	D	89.4	Confident	86.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	54.9	33.9	-178.2	-161.3	32.3	0	0	0	113.2	S385 N387 C390 Y395 N396 G400 D401	S385-D398 VanDerWaalsContact O-OD2 3.13Å; N387-D398 PolarHBondContact N-OD2 3.48Å; C390-D398 HydrophobicContact CB-CB 4.02Å; C390-D398 WeakPolarHBondContact CB-OD1 3.41Å; C390-D398 PolarHBondContact O-N 2.95Å; Y395-D398 PolarHBondContact O-N 3.48Å; N396-D398 VanDerWaalsContact C-N 3.35Å; N396-D398 PolarHBondContact O-N 2.03Å; D398-G400 PolarHBondContact O-N 3.32Å; D398-D401 PolarHBondContact O-N 2.98Å
399	S	90.1	Very high	86.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	46.9	28.3	-169.1	-63.1	0	0	0	0	114.5	N396 F397 L436 I446 R448	N396-S399 WeakPolarHBondContact O-CA 3.42Å; N396-S399 PolarHBondContact O-N 2.81Å; F397-S399 PolarHBondContact O-N 3.19Å; S399-L436 WeakPolarHBondContact OG-CB 3Å; S399-I446 WeakPolarHBondContact O-CG2 3.35Å; S399-R448 VanDerWaalsContact O-CG 3.31Å; S399-R448 WeakPolarHBondContact O-CG 3.42Å; S399-R448 PolarHBondContact O-NH1 2.88Å
400	G	89.4	Confident	86.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	82.5	19.2	175.1	0	0	0	0	0	116.5	F397 D398 L403 R408 R448	F397-G400 PolarHBondContact O-N 3.48Å; D398-G400 PolarHBondContact O-N 3.32Å; G400-L403 WeakPolarHBondContact O-CB 3.2Å; G400-L403 PolarHBondContact O-N 2.04Å; G400-R408 PolarHBondContact O-NH2 2.62Å; G400-R448 VanDerWaalsContact C-NH1 3.28Å; G400-R448 PolarHBondContact O-NH1 2.92Å
401	D	91.4	Very high	85.9	Confident	11 Å²	11	47.7 Å²	47.7	6%	0.059	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-36.8	170.1	-74.4	-30.9	0	0	0	111.7	G382 D383 G384 S385 D398 L403 R408 R448	G382-D401 WeakPolarHBondContact CA-OD2 3.19Å; G382-D401 PolarHBondContact N-OD2 2.85Å; G382-D401 VanDerWaalsContact N-OD2 3.08Å; D383-D401 PolarHBondContact N-OD2 3.42Å; G384-D401 WeakPolarHBondContact CA-OD1 3.42Å; G384-D401 VanDerWaalsContact N-CG 3.29Å; G384-D401 PolarHBondContact N-OD1 3.3Å; G384-D401 PolarHBondContact N-OD2 2.88Å; S385-D401 WeakPolarHBondContact O-CB 3.2Å; D398-D401 PolarHBondContact O-N 2.98Å; D401-L403 PolarHBondContact O-N 2.85Å; D401-L403 VanDerWaalsContact O-N 3.14Å; D401-R408 PolarHBondContact O-NH2 2.05Å; D401-R408 VanDerWaalsContact O-NH2 3.1Å; D401-R448 IonicContact OD1-CZ 3.15Å; D401-R448 IonicContact OD1-NH1 2.72Å; D401-R448 PolarHBondContact OD1-NH1 3.43Å; D401-R448 IonicContact OD1-NH2 2.67Å; D401-R448 PolarHBondContact OD1-NH2 2.89Å
402	C	90.3	Very high	86	Confident	24 Å²	24	49.3 Å²	49.3	16%	0.162	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	2	169.3	-61.4	0	0	0	0	115.7	C386 N391	C386-C402 WeakPolarHBondContact CA-SG 3.4Å; C386-C402 HydrophobicContact CB-CB 3.91Å; C386-C402 WeakPolarHBondContact CB-SG 3.47Å; C386-C402 WeakPolarHBondContact SG-CA 3.32Å; C386-C402 WeakPolarHBondContact SG-CB 3.36Å; C386-C402 CovalentContact SG-SG 2.04Å; C386-C402 PolarHBondContact SG-SG 3.44Å; N391-C402 HydrophobicContact CB-CB 4.46Å
403	L	88	Confident	86.4	Confident	14 Å²	14	47.2 Å²	47.2	7%	0.073	25%	0.248	C	C	.	.			trans	-73.4	133.7	171.5	-65.9	176.5	0	0	0	111.1	G400 D401 Q407 R408 I446 P509	G400-L403 WeakPolarHBondContact O-CB 3.2Å; G400-L403 PolarHBondContact O-N 2.04Å; D401-L403 PolarHBondContact O-N 2.85Å; D401-L403 VanDerWaalsContact O-N 3.14Å; L403-Q407 HydrophobicContact CB-CB 4.43Å; L403-Q407 HydrophobicContact CD2-CB 4.13Å; L403-R408 HydrophobicContact CB-CB 4.38Å; L403-R408 VanDerWaalsContact O-CZ 3.25Å; L403-R408 PolarHBondContact O-NH1 2.88Å; L403-R408 PolarHBondContact O-NH2 3.22Å; L403-I446 HydrophobicContact CD1-CD1 3.95Å; L403-I446 HydrophobicContact CD1-CG2 4.19Å; L403-I446 HydrophobicContact CD2-CD1 4.04Å; L403-I446 HydrophobicContact CG-CD1 4.23Å; L403-P509 HydrophobicContact CD2-CG 3.72Å
404	T	88.2	Confident	87	Confident	78 Å²	78	48.2 Å²	48.2	48%	0.479	25%	0.254	S	S	.	.			trans	-62.6	154.4	163.3	61.5	0	0	0	0	110.5	E406 Q407 R408	T404-E406 PolarHBondContact O-N 2.87Å; T404-Q407 PolarHBondContact O-N 3.34Å; T404-Q407 VanDerWaalsContact OG1-CD 3.26Å; T404-Q407 VanDerWaalsContact OG1-CG 3.27Å; T404-Q407 WeakPolarHBondContact OG1-CG 3.46Å; T404-Q407 PolarHBondContact OG1-N 2.65Å; T404-Q407 PolarHBondContact OG1-OE1 3.41Å; T404-R408 WeakPolarHBondContact O-CB 3.37Å; T404-R408 PolarHBondContact O-N 3.2Å
405	D	84.9	Confident	87.3	Confident	98 Å²	98	48.1 Å²	48.1	52%	0.524	26%	0.258	S	S	.	.	H	α-helix	trans	-60.6	-33.4	178.5	-74.3	-35.3	0	0	0	112.6	R408 F409	D405-R408 PolarHBondContact O-N 2.8Å; D405-R408 IonicContact OD1-CZ 3.92Å; D405-R408 IonicContact OD1-NH1 2.8Å; D405-R408 PolarHBondContact OD1-NH1 2.9Å; D405-F409 HydrophobicContact CB-CD2 4.27Å; D405-F409 HydrophobicContact CB-CE2 4.23Å; D405-F409 WeakPolarHBondContact O-CB 3.46Å; D405-F409 WeakPolarHBondContact O-CD2 3.01Å; D405-F409 PolarHBondContact O-N 2.89Å
406	E	85.2	Confident	87.5	Confident	165 Å²	165	51.6 Å²	51.6	77%	0.771	27%	0.271	S	S	*	.	H	α-helix	trans	-62	-50.1	174.1	-64.4	-169.2	163.9	0	0	111.5	T404 R408 F409 S410	T404-E406 PolarHBondContact O-N 2.87Å; E406-R408 VanDerWaalsContact C-N 3.31Å; E406-R408 PolarHBondContact O-N 3.1Å; E406-F409 PolarHBondContact O-N 3.2Å; E406-S410 VanDerWaalsContact O-CB 3.31Å; E406-S410 WeakPolarHBondContact O-CB 3.03Å; E406-S410 PolarHBondContact O-N 3.27Å; E406-S410 PolarHBondContact O-OG 3.48Å
407	Q	85.3	Confident	87.7	Confident	41 Å²	41	51.6 Å²	51.6	19%	0.192	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-39.9	174.8	-70	163.6	-47.4	0	0	112	L403 T404 G411 P509 Y510	L403-Q407 HydrophobicContact CB-CB 4.43Å; L403-Q407 HydrophobicContact CD2-CB 4.13Å; T404-Q407 PolarHBondContact O-N 3.34Å; T404-Q407 VanDerWaalsContact OG1-CD 3.26Å; T404-Q407 VanDerWaalsContact OG1-CG 3.27Å; T404-Q407 WeakPolarHBondContact OG1-CG 3.46Å; T404-Q407 PolarHBondContact OG1-N 2.65Å; T404-Q407 PolarHBondContact OG1-OE1 3.41Å; Q407-G411 WeakPolarHBondContact O-CA 3.43Å; Q407-G411 PolarHBondContact O-N 2.65Å; Q407-P509 HydrophobicContact CG-CB 4.2Å; Q407-Y510 PolarHBondContact NE2-OH 3.22Å
408	R	84.2	Confident	87.8	Confident	51 Å²	51	51.4 Å²	51.4	19%	0.192	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-48.1	180	-175.3	175.7	-72.8	127.4	2.2	111.5	G400 D401 L403 T404 D405 E406 Q412 H506	G400-R408 PolarHBondContact O-NH2 2.62Å; D401-R408 PolarHBondContact O-NH2 2.05Å; D401-R408 VanDerWaalsContact O-NH2 3.1Å; L403-R408 HydrophobicContact CB-CB 4.38Å; L403-R408 VanDerWaalsContact O-CZ 3.25Å; L403-R408 PolarHBondContact O-NH1 2.88Å; L403-R408 PolarHBondContact O-NH2 3.22Å; T404-R408 WeakPolarHBondContact O-CB 3.37Å; T404-R408 PolarHBondContact O-N 3.2Å; D405-R408 PolarHBondContact O-N 2.8Å; D405-R408 IonicContact OD1-CZ 3.92Å; D405-R408 IonicContact OD1-NH1 2.8Å; D405-R408 PolarHBondContact OD1-NH1 2.9Å; E406-R408 VanDerWaalsContact C-N 3.31Å; E406-R408 PolarHBondContact O-N 3.1Å; R408-Q412 PolarHBondContact O-N 3.28Å; R408-H506 PolarHBondContact O-CE1 3.27Å; R408-H506 PolarHBondContact O-ND1 2.96Å
409	F	82.6	Confident	87.8	Confident	156 Å²	156	51.6 Å²	51.6	68%	0.684	27%	0.273	S	S	*	.	H	α-helix	trans	-73.6	-40.8	178	-74.8	-61.2	0	0	0	113.1	D405 E406	D405-F409 HydrophobicContact CB-CD2 4.27Å; D405-F409 HydrophobicContact CB-CE2 4.23Å; D405-F409 WeakPolarHBondContact O-CB 3.46Å; D405-F409 WeakPolarHBondContact O-CD2 3.01Å; D405-F409 PolarHBondContact O-N 2.89Å; E406-F409 PolarHBondContact O-N 3.2Å
410	S	82.9	Confident	87.7	Confident	104 Å²	104	51.7 Å²	51.7	73%	0.727	27%	0.274	S	S	*	.	H	α-helix	trans	-76.2	-29	-178.9	70.2	0	0	0	0	113.3	E406	E406-S410 VanDerWaalsContact O-CB 3.31Å; E406-S410 WeakPolarHBondContact O-CB 3.03Å; E406-S410 PolarHBondContact O-N 3.27Å; E406-S410 PolarHBondContact O-OG 3.48Å
411	G	84.3	Confident	87.7	Confident	9 Å²	9	51.7 Å²	51.7	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-84.3	-12.8	-179.1	0	0	0	0	0	114.7	Q407 L413 H506 K507	Q407-G411 WeakPolarHBondContact O-CA 3.43Å; Q407-G411 PolarHBondContact O-N 2.65Å; G411-L413 PolarHBondContact O-N 2.99Å; G411-H506 CarbonylContact O-C 3.56Å; G411-H506 WeakPolarHBondContact O-CA 3.42Å; G411-K507 PolarHBondContact O-N 2.9Å
412	Q	89.7	Confident	87.5	Confident	83 Å²	83	52.6 Å²	52.6	39%	0.388	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-69	129.3	-175	-168.6	170.8	-15.2	0	0	112.3	R408	R408-Q412 PolarHBondContact O-N 3.28Å
413	L	90.3	Very high	87.4	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.052	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-74.1	151	175.3	-57.8	-165.7	0	0	0	111.7	G411 V505 K507 F516 V522	G411-L413 PolarHBondContact O-N 2.99Å; L413-V505 HydrophobicContact CB-CB 4.29Å; L413-V505 HydrophobicContact CD1-CB 3.87Å; L413-V505 HydrophobicContact CD1-CG1 3.58Å; L413-V505 HydrophobicContact CG-CB 4.02Å; L413-V505 HydrophobicContact CG-CG1 4Å; L413-V505 PolarHBondContact N-O 2.8Å; L413-K507 HydrophobicContact CD2-CD 4.34Å; L413-K507 HydrophobicContact CD2-CG 3.84Å; L413-F516 HydrophobicContact CD1-CB 3.83Å; L413-F516 WeakPolarHBondContact CD2-O 3.28Å; L413-V522 HydrophobicContact CD1-CG2 4.01Å
414	T	89.8	Confident	87.3	Confident	98 Å²	98	52.3 Å²	52.3	60%	0.601	28%	0.282	S	S	*	.	B	Isolated β-bridge	trans	-75.3	134.3	178.6	54.4	0	0	0	0	111.9	N518 S519	T414-N518 WeakPolarHBondContact OG1-CB 3.47Å; T414-S519 WeakPolarHBondContact O-CB 3.5Å; T414-S519 PolarHBondContact O-N 3.2Å; T414-S519 PolarHBondContact O-OG 2.8Å
415	G	87.1	Confident	87.3	Confident	21 Å²	21	49.5 Å²	49.5	22%	0.216	27%	0.266	C	S	.	.	S	Bend	trans	85.2	158.1	-174.6	0	0	0	0	0	113.7	S519	G415-S519 WeakPolarHBondContact O-CB 3.49Å; G415-S519 PolarHBondContact O-OG 2.85Å
416	R	89.8	Confident	87.3	Confident	90 Å²	90	48.1 Å²	48.1	34%	0.34	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147.5	178.1	-56.7	158.5	-163.5	-115.1	-5.9	109.4	D450 V502 T548 D549	R416-D450 WeakPolarHBondContact CD-OD2 3.05Å; R416-D450 IonicContact CZ-OD2 2.77Å; R416-D450 IonicContact NE-OD2 3.51Å; R416-D450 IonicContact NH1-OD1 3.38Å; R416-D450 PolarHBondContact NH1-OD1 3.16Å; R416-D450 IonicContact NH1-OD2 2.79Å; R416-D450 PolarHBondContact NH1-OD2 3.11Å; R416-V502 HydrophobicContact CB-CG1 3.88Å; R416-V502 HydrophobicContact CG-CG1 4.43Å; R416-T548 CarbonylContact O-C 3.5Å; R416-T548 VanDerWaalsContact O-CA 3.28Å; R416-T548 WeakPolarHBondContact O-CA 3.46Å; R416-D549 HydrophobicContact CB-CB 4.36Å; R416-D549 PolarHBondContact N-O 3.21Å; R416-D549 PolarHBondContact O-N 3.47Å
417	I	91	Very high	87.4	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133.9	170.5	-59.8	178.1	0	0	0	108.3	V502 L503 V505 V522 T523 V546	I417-V502 CarbonylContact O-C 3.57Å; I417-V502 WeakPolarHBondContact O-CA 3.1Å; I417-L503 HydrophobicContact CB-CB 4.28Å; I417-L503 PolarHBondContact N-O 3.24Å; I417-L503 PolarHBondContact O-N 3.32Å; I417-V505 HydrophobicContact CD1-CG2 3.55Å; I417-V505 HydrophobicContact CG1-CG2 4.34Å; I417-V522 HydrophobicContact CD1-CB 3.75Å; I417-V522 HydrophobicContact CD1-CG1 3.42Å; I417-V522 VanDerWaalsContact CD1-CG1 3.42Å; I417-T523 HydrophobicContact CB-CG2 4.38Å; I417-T523 HydrophobicContact CD1-CG2 4.35Å; I417-T523 HydrophobicContact CG1-CG2 3.92Å; I417-T523 HydrophobicContact CG2-CG2 3.92Å; I417-V546 HydrophobicContact CG2-CG1 3.55Å
418	V	90.3	Very high	87.7	Confident	25 Å²	25	44 Å²	44	15%	0.152	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.2	171.3	-174.2	0	0	0	0	107.5	L500 V502 V546 G547 D549	V418-L500 HydrophobicContact CG1-CD1 4.12Å; V418-L500 HydrophobicContact CG1-CD2 4Å; V418-L500 HydrophobicContact CG1-CG 3.99Å; V418-V502 HydrophobicContact CG2-CG1 4.49Å; V418-V502 HydrophobicContact CG2-CG2 4.28Å; V418-V546 CarbonylContact O-C 3.54Å; V418-V546 WeakPolarHBondContact O-CA 3.34Å; V418-G547 PolarHBondContact N-O 3.15Å; V418-G547 PolarHBondContact O-N 3.15Å; V418-D549 HydrophobicContact CG2-CB 4.12Å
419	A	90	Very high	88	Confident	3 Å²	3	46.5 Å²	46.5	3%	0.025	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	144.3	-179.4	0	0	0	0	0	111.2	L500 V501 I543 S545 V546	A419-L500 WeakPolarHBondContact O-CA 3.11Å; A419-V501 HydrophobicContact CB-CG1 4.07Å; A419-V501 PolarHBondContact N-O 3.23Å; A419-V501 PolarHBondContact O-N 2.88Å; A419-I543 HydrophobicContact CB-CG2 4.25Å; A419-S545 WeakPolarHBondContact CA-O 3.2Å; A419-V546 HydrophobicContact CB-CG2 4.43Å
420	I	87.8	Confident	88.3	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.8	171	-53.7	-179	0	0	0	108.3	W462 F490 T499 I543 Q544 S545	I420-W462 HydrophobicContact CD1-CD2 4.02Å; I420-W462 HydrophobicContact CD1-CE3 4.48Å; I420-W462 HydrophobicContact CD1-CG 4.49Å; I420-W462 HydrophobicContact CD1-CH2 4.18Å; I420-W462 HydrophobicContact CD1-CZ2 3.7Å; I420-W462 HydrophobicContact CG2-CB 4.46Å; I420-W462 HydrophobicContact CG2-CG 4.05Å; I420-F490 HydrophobicContact CD1-CD1 3.77Å; I420-F490 HydrophobicContact CD1-CD2 4.35Å; I420-F490 HydrophobicContact CD1-CE1 3.68Å; I420-F490 HydrophobicContact CD1-CE2 4.27Å; I420-F490 HydrophobicContact CD1-CG 4.1Å; I420-F490 HydrophobicContact CD1-CZ 3.94Å; I420-T499 CarbonylContact C-O 3.42Å; I420-T499 WeakPolarHBondContact CA-O 3.03Å; I420-I543 CarbonylContact O-C 3.56Å; I420-Q544 PolarHBondContact O-N 2.93Å; I420-S545 WeakPolarHBondContact CD1-OG 3.21Å; I420-S545 PolarHBondContact N-O 3.29Å
421	V	89.1	Confident	88.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.3	-171.8	-161	0	0	0	0	109.9	V423 F428 S498 T499 V501 Y541 E542 I543	V421-V423 HydrophobicContact CB-CG1 4.05Å; V421-V423 HydrophobicContact CG1-CG1 3.73Å; V421-V423 PolarHBondContact O-N 3.17Å; V421-F428 HydrophobicContact CG1-CE2 4.44Å; V421-F428 HydrophobicContact CG2-CE2 4.16Å; V421-S498 CarbonylContact O-C 3.44Å; V421-S498 WeakPolarHBondContact O-CA 2.97Å; V421-S498 WeakPolarHBondContact O-CB 3.4Å; V421-T499 PolarHBondContact N-O 3.49Å; V421-T499 PolarHBondContact O-N 3.4Å; V421-V501 HydrophobicContact CG2-CG1 4.16Å; V421-Y541 HydrophobicContact CG1-CD2 3.3Å; V421-Y541 HydrophobicContact CG1-CE2 3.57Å; V421-Y541 HydrophobicContact CG1-CG 4.39Å; V421-E542 WeakPolarHBondContact CA-O 3.4Å; V421-I543 HydrophobicContact CG1-CG1 4.42Å; V421-I543 HydrophobicContact CG2-CG1 4.49Å
422	A	87.1	Confident	89	Confident	30 Å²	30	43 Å²	43	25%	0.248	24%	0.243	C	C	.	.	S	Bend	trans	-77.3	46.1	-171.9	0	0	0	0	0	114.3	E542 Q544	A422-E542 HydrophobicContact CB-CB 4.34Å; A422-E542 WeakPolarHBondContact CB-O 3.28Å; A422-E542 PolarHBondContact N-O 2.69Å; A422-Q544 HydrophobicContact CB-CG 4.01Å
423	V	87.9	Confident	89.1	Confident	5 Å²	5	39.3 Å²	39.3	3%	0.03	23%	0.228	C	C	.	.	S	Bend	trans	-145	153.5	-173.2	59.3	0	0	0	0	110.6	V421 E427 F428 S498 T499 Y541	V421-V423 HydrophobicContact CB-CG1 4.05Å; V421-V423 HydrophobicContact CG1-CG1 3.73Å; V421-V423 PolarHBondContact O-N 3.17Å; V423-E427 HydrophobicContact CG2-CB 3.82Å; V423-E427 HydrophobicContact CG2-CG 3.58Å; V423-E427 WeakPolarHBondContact CG2-OE2 3.45Å; V423-F428 HydrophobicContact CG1-CB 3.97Å; V423-F428 HydrophobicContact CG1-CD2 3.78Å; V423-F428 HydrophobicContact CG1-CG 4.29Å; V423-S498 CarbonylContact O-C 3.59Å; V423-S498 WeakPolarHBondContact O-CA 3.16Å; V423-T499 PolarHBondContact O-N 2.81Å; V423-T499 PolarHBondContact O-OG1 3.28Å; V423-Y541 HydrophobicContact CB-CD1 4.03Å; V423-Y541 HydrophobicContact CB-CD2 4.32Å; V423-Y541 HydrophobicContact CB-CG 3.84Å; V423-Y541 HydrophobicContact CG1-CD1 4.24Å; V423-Y541 HydrophobicContact CG1-CD2 3.91Å; V423-Y541 HydrophobicContact CG1-CE2 4.17Å; V423-Y541 HydrophobicContact CG1-CG 3.94Å; V423-Y541 HydrophobicContact CG2-CD1 3.98Å; V423-Y541 HydrophobicContact CG2-CE1 4.42Å; V423-Y541 HydrophobicContact CG2-CG 4.32Å
424	S	85.9	Confident	89.1	Confident	27 Å²	27	42.6 Å²	42.6	19%	0.189	24%	0.239	C	C	.	.			trans	-70.4	148.5	-178.9	74.5	0	0	0	0	112.4	A426 E427 F428 T499	S424-A426 PolarHBondContact O-N 3.1Å; S424-A426 VanDerWaalsContact O-N 3.08Å; S424-E427 PolarHBondContact O-N 3.22Å; S424-E427 WeakPolarHBondContact OG-CB 3.4Å; S424-E427 PolarHBondContact OG-N 3.09Å; S424-E427 PolarHBondContact OG-OE2 2.97Å; S424-E427 VanDerWaalsContact OG-OE2 3.06Å; S424-F428 WeakPolarHBondContact O-CB 3.25Å; S424-F428 PolarHBondContact O-N 2.72Å; S424-T499 VanDerWaalsContact C-OG1 3.24Å
425	S	87.1	Confident	89.3	Confident	19 Å²	19	37.9 Å²	37.9	13%	0.133	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	5.7	-175.8	68.2	0	0	0	0	114.9	K429 Q461 T499	S425-K429 WeakPolarHBondContact O-CD 3.37Å; S425-K429 WeakPolarHBondContact O-CE 3.38Å; S425-K429 WeakPolarHBondContact O-CG 3.5Å; S425-K429 PolarHBondContact O-NZ 2.87Å; S425-Q461 VanDerWaalsContact CB-OE1 3.27Å; S425-Q461 WeakPolarHBondContact OG-CB 3.43Å; S425-Q461 PolarHBondContact OG-OE1 2.9Å; S425-T499 WeakPolarHBondContact CA-OG1 3.11Å; S425-T499 WeakPolarHBondContact CB-OG1 3.42Å; S425-T499 PolarHBondContact N-OG1 2.83Å; S425-T499 VanDerWaalsContact N-OG1 3.08Å
426	A	86.5	Confident	89.6	Confident	69 Å²	69	37 Å²	37	57%	0.57	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-50.6	165.2	0	0	0	0	0	110.1	S424 F428 K429 V430	S424-A426 PolarHBondContact O-N 3.1Å; S424-A426 VanDerWaalsContact O-N 3.08Å; A426-F428 PolarHBondContact O-N 3.07Å; A426-K429 WeakPolarHBondContact O-CA 3.45Å; A426-K429 WeakPolarHBondContact O-CB 3.4Å; A426-K429 PolarHBondContact O-N 2.92Å; A426-V430 PolarHBondContact O-N 2.78Å
427	E	87.8	Confident	89.6	Confident	118 Å²	118	33.4 Å²	33.4	55%	0.551	19%	0.188	S	C	*	.	H	α-helix	trans	-64.3	-36.6	177.6	-173.1	176	-160.3	0	0	112.8	V423 S424 K429 V430 D431	V423-E427 HydrophobicContact CG2-CB 3.82Å; V423-E427 HydrophobicContact CG2-CG 3.58Å; V423-E427 WeakPolarHBondContact CG2-OE2 3.45Å; S424-E427 PolarHBondContact O-N 3.22Å; S424-E427 WeakPolarHBondContact OG-CB 3.4Å; S424-E427 PolarHBondContact OG-N 3.09Å; S424-E427 PolarHBondContact OG-OE2 2.97Å; S424-E427 VanDerWaalsContact OG-OE2 3.06Å; E427-K429 PolarHBondContact O-N 2.94Å; E427-V430 WeakPolarHBondContact O-CA 3.03Å; E427-V430 PolarHBondContact O-N 2.78Å; E427-D431 PolarHBondContact O-N 3.23Å; E427-D431 VanDerWaalsContact O-N 3.07Å
428	F	91.3	Very high	89.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-24.1	171.1	-172.3	-100.1	0	0	0	113.6	V421 V423 S424 A426 L432 F435 I459 T499 V501 Y541	V421-F428 HydrophobicContact CG1-CE2 4.44Å; V421-F428 HydrophobicContact CG2-CE2 4.16Å; V423-F428 HydrophobicContact CG1-CB 3.97Å; V423-F428 HydrophobicContact CG1-CD2 3.78Å; V423-F428 HydrophobicContact CG1-CG 4.29Å; S424-F428 WeakPolarHBondContact O-CB 3.25Å; S424-F428 PolarHBondContact O-N 2.72Å; A426-F428 PolarHBondContact O-N 3.07Å; F428-L432 HydrophobicContact CE1-CD1 3.93Å; F428-L432 HydrophobicContact CZ-CD1 4.28Å; F428-L432 PolarHBondContact O-N 3.42Å; F428-F435 HydrophobicContact CE2-CB 4.47Å; F428-F435 HydrophobicContact CE2-CD1 4.19Å; F428-F435 AromaticContact CE2-CD2 3.55Å; F428-F435 HydrophobicContact CE2-CD2 3.55Å; F428-F435 HydrophobicContact CE2-CE1 4.34Å; F428-F435 AromaticContact CE2-CE2 3.72Å; F428-F435 HydrophobicContact CE2-CE2 3.72Å; F428-F435 AromaticContact CE2-CG 3.81Å; F428-F435 HydrophobicContact CE2-CG 3.81Å; F428-F435 HydrophobicContact CE2-CZ 4.12Å; F428-F435 AromaticContact CZ-CD1 3.83Å; F428-F435 HydrophobicContact CZ-CD1 3.83Å; F428-F435 HydrophobicContact CZ-CD2 4.03Å; F428-F435 AromaticContact CZ-CE1 3.85Å; F428-F435 HydrophobicContact CZ-CE1 3.85Å; F428-F435 HydrophobicContact CZ-CE2 4.04Å; F428-F435 AromaticContact CZ-CG 3.94Å; F428-F435 HydrophobicContact CZ-CG 3.94Å; F428-F435 AromaticContact CZ-CZ 3.94Å; F428-F435 HydrophobicContact CZ-CZ 3.94Å; F428-I459 HydrophobicContact CD1-CD1 4.28Å; F428-I459 HydrophobicContact CD1-CG2 3.74Å; F428-I459 HydrophobicContact CE1-CD1 4.18Å; F428-I459 HydrophobicContact CE1-CG1 4.31Å; F428-I459 HydrophobicContact CE1-CG2 4.22Å; F428-T499 HydrophobicContact CB-CG2 4.2Å; F428-T499 HydrophobicContact CD1-CG2 3.83Å; F428-T499 HydrophobicContact CE1-CG2 4.45Å; F428-T499 HydrophobicContact CG-CG2 4.01Å; F428-V501 HydrophobicContact CE1-CB 3.97Å; F428-V501 HydrophobicContact CE1-CG1 4.35Å; F428-V501 HydrophobicContact CE1-CG2 3.92Å; F428-V501 HydrophobicContact CZ-CB 4.13Å; F428-V501 HydrophobicContact CZ-CG1 3.99Å; F428-V501 HydrophobicContact CZ-CG2 4.18Å; F428-Y541 HydrophobicContact CD2-CE2 4.38Å; F428-Y541 HydrophobicContact CE2-CE2 4.47Å
429	K	90.7	Very high	89.7	Confident	105 Å²	105	33.2 Å²	33.2	46%	0.457	19%	0.187	S	C	.	.	H	α-helix	trans	-84.8	-25.3	171.2	-65.5	171.4	-171.3	146.4	0	111.4	S425 A426 E427 I459	S425-K429 WeakPolarHBondContact O-CD 3.37Å; S425-K429 WeakPolarHBondContact O-CE 3.38Å; S425-K429 WeakPolarHBondContact O-CG 3.5Å; S425-K429 PolarHBondContact O-NZ 2.87Å; A426-K429 WeakPolarHBondContact O-CA 3.45Å; A426-K429 WeakPolarHBondContact O-CB 3.4Å; A426-K429 PolarHBondContact O-N 2.92Å; E427-K429 PolarHBondContact O-N 2.94Å; K429-I459 HydrophobicContact CG-CD1 4.18Å; K429-I459 HydrophobicContact CG-CG2 4.32Å
430	V	88.8	Confident	89.7	Confident	135 Å²	135	33 Å²	33	82%	0.818	19%	0.186	S	C	*	.	H	α-helix	trans	-40.7	-65.9	157.6	-164.8	0	0	0	0	111.1	A426 E427 L432	A426-V430 PolarHBondContact O-N 2.78Å; E427-V430 WeakPolarHBondContact O-CA 3.03Å; E427-V430 PolarHBondContact O-N 2.78Å; V430-L432 PolarHBondContact O-N 3.23Å
431	D	88.8	Confident	89.7	Confident	42 Å²	42	35.4 Å²	35.4	23%	0.225	20%	0.199	C	C	.	.	S	Bend	trans	-96.5	15.2	-162.1	-161.2	56.4	0	0	0	114.4	E427 G433 R434 F435 Y541	E427-D431 PolarHBondContact O-N 3.23Å; E427-D431 VanDerWaalsContact O-N 3.07Å; D431-G433 PolarHBondContact O-N 3.45Å; D431-R434 PolarHBondContact O-N 2.04Å; D431-R434 WeakPolarHBondContact OD1-CD 3.47Å; D431-F435 PolarHBondContact O-N 2.88Å; D431-Y541 HydrophobicContact CB-CE1 4.34Å; D431-Y541 VanDerWaalsContact OD2-CE1 3.24Å; D431-Y541 WeakPolarHBondContact OD2-CE1 3.45Å; D431-Y541 VanDerWaalsContact OD2-CZ 3.29Å; D431-Y541 PolarHBondContact OD2-OH 3.12Å
432	L	92.3	Very high	89.7	Confident	17 Å²	17	36.3 Å²	36.3	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-42.2	-163.8	-178.7	61.1	0	0	0	113.6	F428 V430 F435 L436 V449 K457 I459	F428-L432 HydrophobicContact CE1-CD1 3.93Å; F428-L432 HydrophobicContact CZ-CD1 4.28Å; F428-L432 PolarHBondContact O-N 3.42Å; V430-L432 PolarHBondContact O-N 3.23Å; L432-F435 HydrophobicContact CD1-CD1 4.46Å; L432-F435 WeakPolarHBondContact O-CB 2.87Å; L432-F435 PolarHBondContact O-N 3.18Å; L432-L436 HydrophobicContact CD1-CD1 4.46Å; L432-L436 HydrophobicContact CD1-CG 4.31Å; L432-L436 HydrophobicContact CG-CD1 4.31Å; L432-L436 WeakPolarHBondContact O-CG 3.42Å; L432-L436 PolarHBondContact O-N 2.86Å; L432-V449 HydrophobicContact CD1-CG2 3.74Å; L432-V449 HydrophobicContact CD2-CG2 4.19Å; L432-V449 HydrophobicContact CG-CG2 4.46Å; L432-K457 HydrophobicContact CD2-CD 4.08Å; L432-I459 HydrophobicContact CD1-CD1 4.24Å; L432-I459 HydrophobicContact CD2-CD1 3.93Å
433	G	91	Very high	89.9	Confident	6 Å²	6	35 Å²	35	6%	0.062	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-44.1	179.7	0	0	0	0	0	111.7	E378 D431 F435 L436 I437	E378-G433 VanDerWaalsContact O-CA 3.29Å; E378-G433 WeakPolarHBondContact O-CA 3.4Å; D431-G433 PolarHBondContact O-N 3.45Å; G433-F435 VanDerWaalsContact C-N 3.34Å; G433-F435 PolarHBondContact O-N 3.21Å; G433-L436 PolarHBondContact O-N 2.79Å; G433-L436 VanDerWaalsContact O-N 3.14Å; G433-I437 WeakPolarHBondContact O-CG1 3.29Å; G433-I437 PolarHBondContact O-N 2.97Å
434	R	90.9	Very high	89.9	Confident	79 Å²	79	36.5 Å²	36.5	30%	0.298	20%	0.199	S	C	.	.	H	α-helix	trans	-55.7	-45.6	171.5	-171.3	-171	179.5	99.5	-4.3	111.8	E378 D431 L436 I437 V438 Q538 L539	E378-R434 HydrophobicContact CG-CB 4.12Å; E378-R434 HydrophobicContact CG-CG 4.41Å; E378-R434 WeakPolarHBondContact OE1-CD 3.18Å; E378-R434 WeakPolarHBondContact OE1-CG 3.35Å; E378-R434 IonicContact OE1-CZ 3.47Å; E378-R434 IonicContact OE1-NE 3.48Å; E378-R434 IonicContact OE1-NH1 3.6Å; E378-R434 PolarHBondContact OE1-NH1 2.9Å; D431-R434 PolarHBondContact O-N 2.04Å; D431-R434 WeakPolarHBondContact OD1-CD 3.47Å; R434-L436 PolarHBondContact O-N 2.81Å; R434-I437 PolarHBondContact O-N 2.86Å; R434-V438 HydrophobicContact CG-CG2 4.34Å; R434-V438 WeakPolarHBondContact O-CB 3.21Å; R434-V438 WeakPolarHBondContact O-CG2 3.33Å; R434-V438 PolarHBondContact O-N 2.85Å; R434-Q538 PolarHBondContact NE-O 2.76Å; R434-Q538 PolarHBondContact NH2-O 3.47Å; R434-L539 HydrophobicContact CG-CD2 3.71Å
435	F	93.6	Very high	90.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-44.7	174.8	174.6	-89	0	0	0	112.4	F428 D431 L432 G433 L439 L503 L539 Y541 I543	F428-F435 HydrophobicContact CE2-CB 4.47Å; F428-F435 HydrophobicContact CE2-CD1 4.19Å; F428-F435 AromaticContact CE2-CD2 3.55Å; F428-F435 HydrophobicContact CE2-CD2 3.55Å; F428-F435 HydrophobicContact CE2-CE1 4.34Å; F428-F435 AromaticContact CE2-CE2 3.72Å; F428-F435 HydrophobicContact CE2-CE2 3.72Å; F428-F435 AromaticContact CE2-CG 3.81Å; F428-F435 HydrophobicContact CE2-CG 3.81Å; F428-F435 HydrophobicContact CE2-CZ 4.12Å; F428-F435 AromaticContact CZ-CD1 3.83Å; F428-F435 HydrophobicContact CZ-CD1 3.83Å; F428-F435 HydrophobicContact CZ-CD2 4.03Å; F428-F435 AromaticContact CZ-CE1 3.85Å; F428-F435 HydrophobicContact CZ-CE1 3.85Å; F428-F435 HydrophobicContact CZ-CE2 4.04Å; F428-F435 AromaticContact CZ-CG 3.94Å; F428-F435 HydrophobicContact CZ-CG 3.94Å; F428-F435 AromaticContact CZ-CZ 3.94Å; F428-F435 HydrophobicContact CZ-CZ 3.94Å; D431-F435 PolarHBondContact O-N 2.88Å; L432-F435 HydrophobicContact CD1-CD1 4.46Å; L432-F435 WeakPolarHBondContact O-CB 2.87Å; L432-F435 PolarHBondContact O-N 3.18Å; G433-F435 VanDerWaalsContact C-N 3.34Å; G433-F435 PolarHBondContact O-N 3.21Å; F435-L439 HydrophobicContact CE1-CD2 3.69Å; F435-L439 HydrophobicContact CE2-CD2 4.28Å; F435-L439 HydrophobicContact CZ-CD2 3.53Å; F435-L439 WeakPolarHBondContact O-CB 3.48Å; F435-L439 PolarHBondContact O-N 3.43Å; F435-L503 HydrophobicContact CE1-CD1 3.91Å; F435-L503 HydrophobicContact CE1-CD2 4.12Å; F435-L503 HydrophobicContact CZ-CD1 4.08Å; F435-L539 HydrophobicContact CB-CD1 4.26Å; F435-L539 HydrophobicContact CD2-CD1 3.64Å; F435-L539 HydrophobicContact CE2-CD1 4.48Å; F435-L539 HydrophobicContact CG-CD1 4.35Å; F435-Y541 HydrophobicContact CD2-CE2 4.18Å; F435-I543 HydrophobicContact CE2-CD1 4.4Å
436	L	93.9	Very high	90.3	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-70.3	-37.9	-179.7	-65.4	175.9	0	0	0	113	N396 S399 L432 G433 R434 G440 I447 V449 L503	N396-L436 PolarHBondContact ND2-O 2.95Å; S399-L436 WeakPolarHBondContact OG-CB 3Å; L432-L436 HydrophobicContact CD1-CD1 4.46Å; L432-L436 HydrophobicContact CD1-CG 4.31Å; L432-L436 HydrophobicContact CG-CD1 4.31Å; L432-L436 WeakPolarHBondContact O-CG 3.42Å; L432-L436 PolarHBondContact O-N 2.86Å; G433-L436 PolarHBondContact O-N 2.79Å; G433-L436 VanDerWaalsContact O-N 3.14Å; R434-L436 PolarHBondContact O-N 2.81Å; L436-G440 PolarHBondContact O-N 2.04Å; L436-G440 VanDerWaalsContact O-N 3.08Å; L436-I447 HydrophobicContact CD2-CB 4.27Å; L436-I447 HydrophobicContact CD2-CG2 3.88Å; L436-V449 HydrophobicContact CD2-CG2 4.23Å; L436-L503 HydrophobicContact CD2-CD2 4.36Å
437	I	89.9	Confident	90.6	Very high	14 Å²	14	31.3 Å²	31.3	7%	0.072	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-55.8	174.7	-66.3	164.8	0	0	0	110.1	C377 A381 G433 R434 L439 G440 N441	C377-I437 HydrophobicContact CB-CD1 4.43Å; A381-I437 HydrophobicContact CB-CD1 3.8Å; A381-I437 HydrophobicContact CB-CG1 3.93Å; G433-I437 WeakPolarHBondContact O-CG1 3.29Å; G433-I437 PolarHBondContact O-N 2.97Å; R434-I437 PolarHBondContact O-N 2.86Å; I437-L439 PolarHBondContact O-N 2.79Å; I437-G440 PolarHBondContact O-N 2.84Å; I437-N441 WeakPolarHBondContact O-CB 3.31Å; I437-N441 VanDerWaalsContact O-CG 3.28Å; I437-N441 PolarHBondContact O-N 3.42Å
438	V	90.5	Very high	90.8	Very high	20 Å²	20	27.8 Å²	27.8	12%	0.121	14%	0.14	C	C	.	.	H	α-helix	trans	-60	-48.5	-177.4	169	0	0	0	0	111.2	R434 G440 L442 Q538 L539	R434-V438 HydrophobicContact CG-CG2 4.34Å; R434-V438 WeakPolarHBondContact O-CB 3.21Å; R434-V438 WeakPolarHBondContact O-CG2 3.33Å; R434-V438 PolarHBondContact O-N 2.85Å; V438-G440 VanDerWaalsContact C-N 3.32Å; V438-G440 PolarHBondContact O-N 2.03Å; V438-L442 WeakPolarHBondContact O-CB 3.42Å; V438-L442 PolarHBondContact O-N 3.43Å; V438-L442 VanDerWaalsContact O-N 3.11Å; V438-Q538 HydrophobicContact CG1-CB 3.91Å; V438-Q538 HydrophobicContact CG2-CB 4.45Å; V438-L539 HydrophobicContact CB-CD2 3.98Å; V438-L539 HydrophobicContact CB-CG 4.44Å; V438-L539 HydrophobicContact CG1-CD1 4.46Å; V438-L539 HydrophobicContact CG1-CD2 4.22Å; V438-L539 HydrophobicContact CG1-CG 4.18Å; V438-L539 HydrophobicContact CG2-CD2 3.81Å
439	L	92.7	Very high	90.8	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-67	-33.3	-178.3	-174.1	58.6	0	0	0	112.4	F435 I437 L443 I447 L503 L526 I535	F435-L439 HydrophobicContact CE1-CD2 3.69Å; F435-L439 HydrophobicContact CE2-CD2 4.28Å; F435-L439 HydrophobicContact CZ-CD2 3.53Å; F435-L439 WeakPolarHBondContact O-CB 3.48Å; F435-L439 PolarHBondContact O-N 3.43Å; I437-L439 PolarHBondContact O-N 2.79Å; L439-L443 HydrophobicContact CD1-CD1 4.02Å; L439-L443 HydrophobicContact CD1-CG 4.48Å; L439-L443 HydrophobicContact CG-CD1 4.05Å; L439-L443 WeakPolarHBondContact O-CB 3.47Å; L439-L443 WeakPolarHBondContact O-CD1 3.27Å; L439-L443 VanDerWaalsContact O-CG 3.23Å; L439-L443 WeakPolarHBondContact O-CG 3.49Å; L439-L443 PolarHBondContact O-N 2.85Å; L439-I447 HydrophobicContact CD2-CG2 4.25Å; L439-I447 HydrophobicContact CG-CG1 4.39Å; L439-L503 HydrophobicContact CD2-CD1 3.78Å; L439-L526 HydrophobicContact CD1-CD1 4.17Å; L439-L526 HydrophobicContact CD1-CD2 3.53Å; L439-I535 HydrophobicContact CD1-CD1 4.06Å
440	G	91.1	Very high	90.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-78.4	-40.6	179.2	0	0	0	0	0	114.5	N396 L436 I437 V438 L442 L443 Q444 A445	N396-G440 WeakPolarHBondContact ND2-CA 3.23Å; L436-G440 PolarHBondContact O-N 2.04Å; L436-G440 VanDerWaalsContact O-N 3.08Å; I437-G440 PolarHBondContact O-N 2.84Å; V438-G440 VanDerWaalsContact C-N 3.32Å; V438-G440 PolarHBondContact O-N 2.03Å; G440-L442 PolarHBondContact O-N 3.16Å; G440-L443 CarbonylContact O-C 3.56Å; G440-L443 PolarHBondContact O-N 3.05Å; G440-L443 VanDerWaalsContact O-N 3.1Å; G440-Q444 WeakPolarHBondContact O-CA 3.37Å; G440-Q444 PolarHBondContact O-N 3.49Å; G440-A445 CarbonylContact C-O 3.54Å; G440-A445 WeakPolarHBondContact CA-O 3.3Å; G440-A445 PolarHBondContact O-N 3.15Å; G440-A445 VanDerWaalsContact O-N 3.1Å
441	N	87.4	Confident	90.8	Very high	53 Å²	53	21.3 Å²	21.3	28%	0.283	11%	0.109	S	C	.	.	H	α-helix	trans	-58.7	-40.5	171.3	-71	-4.1	0	0	0	110.8	T393 T394 N396 I437 L443 Q444	T393-N441 PolarHBondContact O-OD1 2.88Å; T394-N441 PolarHBondContact O-ND2 3.49Å; N396-N441 WeakPolarHBondContact CB-OD1 3.46Å; I437-N441 WeakPolarHBondContact O-CB 3.31Å; I437-N441 VanDerWaalsContact O-CG 3.28Å; I437-N441 PolarHBondContact O-N 3.42Å; N441-L443 VanDerWaalsContact C-N 3.29Å; N441-L443 PolarHBondContact O-N 3.16Å; N441-Q444 PolarHBondContact O-N 2.87Å; N441-Q444 PolarHBondContact O-NE2 2.02Å
442	L	89.3	Confident	90.6	Very high	19 Å²	19	20.6 Å²	20.6	10%	0.099	11%	0.105	C	C	.	.	H	α-helix	trans	-67.6	-24.1	177.2	-172.9	66.6	0	0	0	114	V438 G440 F525 V531 I534 I535	V438-L442 WeakPolarHBondContact O-CB 3.42Å; V438-L442 PolarHBondContact O-N 3.43Å; V438-L442 VanDerWaalsContact O-N 3.11Å; G440-L442 PolarHBondContact O-N 3.16Å; L442-F525 HydrophobicContact CG-CE1 4.48Å; L442-F525 WeakPolarHBondContact O-CE1 3.17Å; L442-F525 WeakPolarHBondContact O-CZ 3.24Å; L442-V531 HydrophobicContact CD2-CG1 3.75Å; L442-V531 HydrophobicContact CG-CG1 4.19Å; L442-I534 HydrophobicContact CD1-CG2 4.08Å; L442-I535 HydrophobicContact CD2-CD1 3.7Å; L442-I535 HydrophobicContact CD2-CG1 3.33Å
443	L	90.7	Very high	90.2	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-105.8	-4.9	-179.6	-72.5	175.1	0	0	0	114.1	F360 L439 G440 N441 A445 I447 F516 V522 F525 L526	F360-L443 WeakPolarHBondContact CZ-O 3.35Å; L439-L443 HydrophobicContact CD1-CD1 4.02Å; L439-L443 HydrophobicContact CD1-CG 4.48Å; L439-L443 HydrophobicContact CG-CD1 4.05Å; L439-L443 WeakPolarHBondContact O-CB 3.47Å; L439-L443 WeakPolarHBondContact O-CD1 3.27Å; L439-L443 VanDerWaalsContact O-CG 3.23Å; L439-L443 WeakPolarHBondContact O-CG 3.49Å; L439-L443 PolarHBondContact O-N 2.85Å; G440-L443 CarbonylContact O-C 3.56Å; G440-L443 PolarHBondContact O-N 3.05Å; G440-L443 VanDerWaalsContact O-N 3.1Å; N441-L443 VanDerWaalsContact C-N 3.29Å; N441-L443 PolarHBondContact O-N 3.16Å; L443-A445 HydrophobicContact CB-CB 4.31Å; L443-A445 PolarHBondContact O-N 3.08Å; L443-I447 HydrophobicContact CD1-CD1 3.67Å; L443-I447 HydrophobicContact CD1-CG1 4.33Å; L443-F516 HydrophobicContact CD2-CE2 4.15Å; L443-V522 HydrophobicContact CD1-CG1 3.49Å; L443-V522 VanDerWaalsContact CD1-CG1 3.49Å; L443-V522 HydrophobicContact CD2-CG1 3.76Å; L443-V522 HydrophobicContact CG-CG1 4.23Å; L443-F525 HydrophobicContact CD2-CB 4.47Å; L443-F525 HydrophobicContact CD2-CD1 3.48Å; L443-F525 VanDerWaalsContact CD2-CD1 3.48Å; L443-F525 HydrophobicContact CD2-CE1 3.85Å; L443-F525 HydrophobicContact CD2-CG 4.1Å; L443-L526 HydrophobicContact CD1-CD1 4.29Å; L443-L526 HydrophobicContact CD1-CD2 4.25Å; L443-L526 HydrophobicContact CD1-CG 4.47Å; L443-L526 HydrophobicContact CD2-CD2 3.96Å; L443-L526 HydrophobicContact CD2-CG 4.23Å; L443-L526 HydrophobicContact CG-CD2 4.27Å
444	Q	88.7	Confident	90	Very high	36 Å²	36	35.1 Å²	35.1	17%	0.168	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	41.9	-169.8	-64.7	-69.9	-65.9	0	0	112.3	F360 L363 G440 N441 I508	F360-Q444 HydrophobicContact CD1-CG 4.3Å; F360-Q444 HydrophobicContact CD2-CG 4.24Å; F360-Q444 HydrophobicContact CE1-CB 4.35Å; F360-Q444 HydrophobicContact CE1-CG 4.46Å; F360-Q444 HydrophobicContact CE2-CB 4.47Å; F360-Q444 HydrophobicContact CE2-CG 4.42Å; F360-Q444 HydrophobicContact CG-CG 4.18Å; F360-Q444 HydrophobicContact CZ-CB 4.24Å; L363-Q444 HydrophobicContact CD1-CB 4.42Å; L363-Q444 HydrophobicContact CD1-CG 3.77Å; G440-Q444 WeakPolarHBondContact O-CA 3.37Å; G440-Q444 PolarHBondContact O-N 3.49Å; N441-Q444 PolarHBondContact O-N 2.87Å; N441-Q444 PolarHBondContact O-NE2 2.02Å; Q444-I508 WeakPolarHBondContact O-CD1 3.38Å
445	A	89.8	Confident	89.5	Confident	6 Å²	6	34 Å²	34	5%	0.05	18%	0.181	C	C	.	.	S	Bend	trans	-149.8	150.2	-175	0	0	0	0	0	112.3	N396 G440 L443 I447 V505	N396-A445 PolarHBondContact ND2-O 2.88Å; N396-A445 PolarHBondContact OD1-O 2.75Å; G440-A445 CarbonylContact C-O 3.54Å; G440-A445 WeakPolarHBondContact CA-O 3.3Å; G440-A445 PolarHBondContact O-N 3.15Å; G440-A445 VanDerWaalsContact O-N 3.1Å; L443-A445 HydrophobicContact CB-CB 4.31Å; L443-A445 PolarHBondContact O-N 3.08Å; A445-I447 HydrophobicContact CB-CD1 4.41Å; A445-I447 PolarHBondContact O-N 2.83Å; A445-V505 HydrophobicContact CB-CG1 3.65Å
446	I	91.4	Very high	89.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	119.3	175.9	-71.7	170.5	0	0	0	108.4	F397 S399 L403 R448 H506 I508	F397-I446 HydrophobicContact CB-CD1 4.17Å; S399-I446 WeakPolarHBondContact O-CG2 3.35Å; L403-I446 HydrophobicContact CD1-CD1 3.95Å; L403-I446 HydrophobicContact CD1-CG2 4.19Å; L403-I446 HydrophobicContact CD2-CD1 4.04Å; L403-I446 HydrophobicContact CG-CD1 4.23Å; I446-R448 HydrophobicContact CG2-CG 4.28Å; I446-H506 HydrophobicContact CB-CB 4.19Å; I446-H506 HydrophobicContact CG2-CB 4.24Å; I446-H506 PolarHBondContact N-O 2.66Å; I446-H506 PolarHBondContact O-N 2.87Å; I446-I508 HydrophobicContact CD1-CG1 4.44Å; I446-I508 HydrophobicContact CG1-CG1 4.13Å
447	I	92.3	Very high	89	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.3	-178	-51.5	-61.4	0	0	0	108.9	L436 L439 L443 A445 L503 V505	L436-I447 HydrophobicContact CD2-CB 4.27Å; L436-I447 HydrophobicContact CD2-CG2 3.88Å; L439-I447 HydrophobicContact CD2-CG2 4.25Å; L439-I447 HydrophobicContact CG-CG1 4.39Å; L443-I447 HydrophobicContact CD1-CD1 3.67Å; L443-I447 HydrophobicContact CD1-CG1 4.33Å; A445-I447 HydrophobicContact CB-CD1 4.41Å; A445-I447 PolarHBondContact O-N 2.83Å; I447-L503 HydrophobicContact CG2-CB 4.32Å; I447-L503 HydrophobicContact CG2-CD1 4.12Å; I447-L503 HydrophobicContact CG2-CD2 4.27Å; I447-L503 HydrophobicContact CG2-CG 4.48Å; I447-V505 HydrophobicContact CD1-CB 4.3Å; I447-V505 HydrophobicContact CD1-CG1 3.95Å; I447-V505 HydrophobicContact CD1-CG2 3.84Å
448	R	91.8	Very high	89	Confident	43 Å²	43	42.9 Å²	42.9	16%	0.162	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.4	178.9	-62.1	-177.4	66.8	79.2	-7.1	110.5	S399 G400 D401 I446 L503 T504	S399-R448 VanDerWaalsContact O-CG 3.31Å; S399-R448 WeakPolarHBondContact O-CG 3.42Å; S399-R448 PolarHBondContact O-NH1 2.88Å; G400-R448 VanDerWaalsContact C-NH1 3.28Å; G400-R448 PolarHBondContact O-NH1 2.92Å; D401-R448 IonicContact OD1-CZ 3.15Å; D401-R448 IonicContact OD1-NH1 2.72Å; D401-R448 PolarHBondContact OD1-NH1 3.43Å; D401-R448 IonicContact OD1-NH2 2.67Å; D401-R448 PolarHBondContact OD1-NH2 2.89Å; I446-R448 HydrophobicContact CG2-CG 4.28Å; R448-L503 CarbonylContact O-C 3.52Å; R448-L503 VanDerWaalsContact O-CA 3.26Å; R448-L503 WeakPolarHBondContact O-CA 3.49Å; R448-T504 PolarHBondContact N-O 3.3Å; R448-T504 PolarHBondContact O-N 3.34Å
449	V	92.3	Very high	89	Confident	16 Å²	16	42.6 Å²	42.6	10%	0.097	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.2	171.2	-173.4	0	0	0	0	109.1	L432 L436 K457 I459 V501 L503	L432-V449 HydrophobicContact CD1-CG2 3.74Å; L432-V449 HydrophobicContact CD2-CG2 4.19Å; L432-V449 HydrophobicContact CG-CG2 4.46Å; L436-V449 HydrophobicContact CD2-CG2 4.23Å; V449-K457 HydrophobicContact CB-CB 4.43Å; V449-K457 HydrophobicContact CB-CD 4.46Å; V449-K457 HydrophobicContact CB-CG 4.41Å; V449-K457 HydrophobicContact CG1-CB 3.88Å; V449-K457 HydrophobicContact CG1-CG 4.39Å; V449-I459 HydrophobicContact CG1-CD1 4.27Å; V449-I459 HydrophobicContact CG1-CG1 3.88Å; V449-I459 HydrophobicContact CG2-CD1 4.48Å; V449-V501 HydrophobicContact CG1-CG2 4.19Å; V449-V501 HydrophobicContact CG2-CG2 4.46Å; V449-L503 HydrophobicContact CG2-CD2 4.02Å
450	D	90.2	Very high	88.8	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.102	22%	0.223	C	C	.	.			trans	-66	159.4	178	-163.5	-0.7	0	0	0	111.2	R416 K457 M458 V502 T504	R416-D450 WeakPolarHBondContact CD-OD2 3.05Å; R416-D450 IonicContact CZ-OD2 2.77Å; R416-D450 IonicContact NE-OD2 3.51Å; R416-D450 IonicContact NH1-OD1 3.38Å; R416-D450 PolarHBondContact NH1-OD1 3.16Å; R416-D450 IonicContact NH1-OD2 2.79Å; R416-D450 PolarHBondContact NH1-OD2 3.11Å; D450-K457 CarbonylContact O-C 3.59Å; D450-K457 WeakPolarHBondContact O-CA 3.49Å; D450-M458 HydrophobicContact CB-SD 4.08Å; D450-M458 WeakPolarHBondContact O-CB 3.46Å; D450-M458 WeakPolarHBondContact O-CG 3.46Å; D450-M458 PolarHBondContact O-N 3.2Å; D450-V502 HydrophobicContact CB-CB 4.21Å; D450-V502 HydrophobicContact CB-CG1 3.9Å; D450-V502 PolarHBondContact N-O 3.29Å; D450-T504 HydrophobicContact CB-CG2 4.06Å
451	T	88.5	Confident	88.5	Confident	70 Å²	70	47 Å²	47	43%	0.429	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-119.5	140.3	-179.9	59.3	0	0	0	0	112.3	R456	T451-R456 WeakPolarHBondContact CA-O 3Å
452	D	84.4	Confident	88.2	Confident	26 Å²	26	45.5 Å²	45.5	14%	0.139	22%	0.223	C	C	.	.			trans	-72.1	177.5	173.4	76	5.3	0	0	0	112.2	Q454 G455 R456 M458	D452-Q454 PolarHBondContact O-N 2.65Å; D452-Q454 WeakPolarHBondContact OD1-CA 2.98Å; D452-Q454 WeakPolarHBondContact OD1-CB 3.37Å; D452-Q454 PolarHBondContact OD1-N 3.44Å; D452-G455 PolarHBondContact O-N 3.08Å; D452-G455 PolarHBondContact OD1-N 3.3Å; D452-R456 PolarHBondContact N-O 2.99Å; D452-R456 WeakPolarHBondContact OD1-CB 3.31Å; D452-R456 PolarHBondContact OD1-N 3.04Å; D452-R456 IonicContact OD1-NE 3.99Å; D452-R456 PolarHBondContact OD1-NE 2.94Å; D452-R456 IonicContact OD2-CZ 3.21Å; D452-R456 IonicContact OD2-NE 2.69Å; D452-R456 PolarHBondContact OD2-NE 2.82Å; D452-R456 IonicContact OD2-NH2 2.61Å; D452-R456 PolarHBondContact OD2-NH2 2.79Å; D452-M458 HydrophobicContact CB-CG 4.23Å
453	K	84.7	Confident	87.2	Confident	210 Å²	210	46.5 Å²	46.5	91%	0.913	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	6.4	-179.5	-59	-165.3	177.9	-164.9	0	114.2
454	Q	85.1	Confident	85.9	Confident	119 Å²	119	47.8 Å²	47.8	56%	0.556	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.1	11.3	173.3	-63.4	96.1	-39.2	0	0	111.8	D452 R456	D452-Q454 PolarHBondContact O-N 2.65Å; D452-Q454 WeakPolarHBondContact OD1-CA 2.98Å; D452-Q454 WeakPolarHBondContact OD1-CB 3.37Å; D452-Q454 PolarHBondContact OD1-N 3.44Å; Q454-R456 HydrophobicContact CB-CG 4.19Å
455	G	82	Confident	84.4	Confident	55 Å²	55	54.4 Å²	54.4	57%	0.567	27%	0.266	S	S	*	.	S	Bend	trans	77.3	15	178.3	0	0	0	0	0	114.5	D452	D452-G455 PolarHBondContact O-N 3.08Å; D452-G455 PolarHBondContact OD1-N 3.3Å
456	R	86.7	Confident	82.8	Confident	98 Å²	98	60.9 Å²	60.9	37%	0.37	29%	0.294	S	S	.	.			trans	-97.6	129.3	-172.2	-51.7	177.1	-61.7	170.9	8.2	110.6	T451 D452 Q454 M458 Y473	T451-R456 WeakPolarHBondContact CA-O 3Å; D452-R456 PolarHBondContact N-O 2.99Å; D452-R456 WeakPolarHBondContact OD1-CB 3.31Å; D452-R456 PolarHBondContact OD1-N 3.04Å; D452-R456 IonicContact OD1-NE 3.99Å; D452-R456 PolarHBondContact OD1-NE 2.94Å; D452-R456 IonicContact OD2-CZ 3.21Å; D452-R456 IonicContact OD2-NE 2.69Å; D452-R456 PolarHBondContact OD2-NE 2.82Å; D452-R456 IonicContact OD2-NH2 2.61Å; D452-R456 PolarHBondContact OD2-NH2 2.79Å; Q454-R456 HydrophobicContact CB-CG 4.19Å; R456-M458 PolarHBondContact O-N 2.91Å; R456-Y473 PolarHBondContact NH1-OH 3.22Å
457	K	88.7	Confident	81.2	Confident	90 Å²	90	63.2 Å²	63.2	39%	0.391	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-50.3	124.8	176.1	-69.5	-172.2	177.5	-178.3	0	110.8	G382 L432 V449 D450 I459	G382-K457 WeakPolarHBondContact O-CE 3.45Å; G382-K457 PolarHBondContact O-NZ 3.42Å; L432-K457 HydrophobicContact CD2-CD 4.08Å; V449-K457 HydrophobicContact CB-CB 4.43Å; V449-K457 HydrophobicContact CB-CD 4.46Å; V449-K457 HydrophobicContact CB-CG 4.41Å; V449-K457 HydrophobicContact CG1-CB 3.88Å; V449-K457 HydrophobicContact CG1-CG 4.39Å; D450-K457 CarbonylContact O-C 3.59Å; D450-K457 WeakPolarHBondContact O-CA 3.49Å; K457-I459 VanDerWaalsContact C-N 3.27Å; K457-I459 HydrophobicContact CB-CD1 4.37Å; K457-I459 PolarHBondContact O-N 2.97Å
458	M	91.1	Very high	79.5	Confident	15 Å²	15	64.8 Å²	64.8	7%	0.074	33%	0.329	C	S	.	.			trans	-78.6	67.3	-172.1	-70.4	-173.2	67.9	0	0	112.7	D450 D452 R456 Y460 V501 V502	D450-M458 HydrophobicContact CB-SD 4.08Å; D450-M458 WeakPolarHBondContact O-CB 3.46Å; D450-M458 WeakPolarHBondContact O-CG 3.46Å; D450-M458 PolarHBondContact O-N 3.2Å; D452-M458 HydrophobicContact CB-CG 4.23Å; R456-M458 PolarHBondContact O-N 2.91Å; M458-Y460 HydrophobicContact CB-CE2 3.84Å; M458-Y460 HydrophobicContact CE-CE2 4.18Å; M458-Y460 HydrophobicContact CG-CE2 4.39Å; M458-V501 WeakPolarHBondContact O-CA 3.24Å; M458-V502 HydrophobicContact CB-CB 3.87Å; M458-V502 HydrophobicContact CB-CG2 4.21Å; M458-V502 HydrophobicContact CE-CB 4.22Å; M458-V502 HydrophobicContact CE-CG1 4.49Å; M458-V502 HydrophobicContact CE-CG2 3.9Å; M458-V502 PolarHBondContact O-N 3.22Å; M458-V502 VanDerWaalsContact O-N 3.07Å; M458-V502 HydrophobicContact SD-CB 4.38Å
459	I	91.1	Very high	77.8	Confident	14 Å²	14	64.8 Å²	64.8	7%	0.072	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.7	179.7	-56.3	171.8	0	0	0	109.5	F428 K429 L432 V449 K457 T499 V501	F428-I459 HydrophobicContact CD1-CD1 4.28Å; F428-I459 HydrophobicContact CD1-CG2 3.74Å; F428-I459 HydrophobicContact CE1-CD1 4.18Å; F428-I459 HydrophobicContact CE1-CG1 4.31Å; F428-I459 HydrophobicContact CE1-CG2 4.22Å; K429-I459 HydrophobicContact CG-CD1 4.18Å; K429-I459 HydrophobicContact CG-CG2 4.32Å; L432-I459 HydrophobicContact CD1-CD1 4.24Å; L432-I459 HydrophobicContact CD2-CD1 3.93Å; V449-I459 HydrophobicContact CG1-CD1 4.27Å; V449-I459 HydrophobicContact CG1-CG1 3.88Å; V449-I459 HydrophobicContact CG2-CD1 4.48Å; K457-I459 VanDerWaalsContact C-N 3.27Å; K457-I459 HydrophobicContact CB-CD1 4.37Å; K457-I459 PolarHBondContact O-N 2.97Å; I459-T499 HydrophobicContact CG2-CG2 3.61Å; I459-V501 HydrophobicContact CG1-CG2 4.12Å
460	Y	87.8	Confident	76.1	Confident	51 Å²	51	68.1 Å²	68.1	20%	0.2	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.9	-169.7	-54.4	-74.9	0	0	0	112.8	M458 W462 V469 T499 L500	M458-Y460 HydrophobicContact CB-CE2 3.84Å; M458-Y460 HydrophobicContact CE-CE2 4.18Å; M458-Y460 HydrophobicContact CG-CE2 4.39Å; Y460-W462 PolarHBondContact O-N 3.05Å; Y460-V469 HydrophobicContact CD1-CG1 4.38Å; Y460-V469 HydrophobicContact CG-CG1 4.33Å; Y460-V469 HydrophobicContact CG-CG2 4.49Å; Y460-T499 WeakPolarHBondContact O-CA 3.48Å; Y460-L500 HydrophobicContact CD2-CD2 3.91Å; Y460-L500 PolarHBondContact N-O 2.8Å; Y460-L500 PolarHBondContact O-N 3.15Å
461	Q	85.2	Confident	74	Confident	45 Å²	45	69.8 Å²	69.8	21%	0.21	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	116	172.4	-173	59.6	47.1	0	0	110.1	S425 V469 V470 S498	S425-Q461 VanDerWaalsContact CB-OE1 3.27Å; S425-Q461 WeakPolarHBondContact OG-CB 3.43Å; S425-Q461 PolarHBondContact OG-OE1 2.9Å; Q461-V469 WeakPolarHBondContact O-CA 3.17Å; Q461-V470 HydrophobicContact CB-CB 4.38Å; Q461-V470 HydrophobicContact CG-CB 4.39Å; Q461-V470 HydrophobicContact CG-CG2 4.14Å; Q461-V470 PolarHBondContact O-N 2.7Å; Q461-S498 PolarHBondContact NE2-O 3.15Å
462	W	79.7	Confident	71.5	Confident	20 Å²	20	77 Å²	77	8%	0.076	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	148.9	174.5	-175.1	-112.1	0	0	0	111	I420 Y460 G467 V469 F490 S498 L500	I420-W462 HydrophobicContact CD1-CD2 4.02Å; I420-W462 HydrophobicContact CD1-CE3 4.48Å; I420-W462 HydrophobicContact CD1-CG 4.49Å; I420-W462 HydrophobicContact CD1-CH2 4.18Å; I420-W462 HydrophobicContact CD1-CZ2 3.7Å; I420-W462 HydrophobicContact CG2-CB 4.46Å; I420-W462 HydrophobicContact CG2-CG 4.05Å; Y460-W462 PolarHBondContact O-N 3.05Å; W462-G467 WeakPolarHBondContact CH2-O 2.88Å; W462-G467 VanDerWaalsContact CZ2-C 3.48Å; W462-V469 HydrophobicContact CE3-CG2 4.23Å; W462-F490 HydrophobicContact CH2-CD2 4.09Å; W462-F490 HydrophobicContact CH2-CE2 4.11Å; W462-F490 AromaticContact CZ2-CD2 3.88Å; W462-F490 HydrophobicContact CZ2-CD2 3.88Å; W462-F490 HydrophobicContact CZ2-CE2 4.3Å; W462-F490 HydrophobicContact CZ2-CG 4.38Å; W462-S498 WeakPolarHBondContact CB-O 3.43Å; W462-S498 PolarHBondContact N-O 2.82Å; W462-L500 HydrophobicContact CB-CB 4.4Å; W462-L500 HydrophobicContact CE3-CB 4.21Å; W462-L500 HydrophobicContact CE3-CD1 3.71Å; W462-L500 HydrophobicContact CZ3-CD1 3.68Å
463	N	69.6	Low	69.3	Low	41 Å²	41	83.1 Å²	83.1	22%	0.219	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	103.1	172.8	-167.2	-44.1	0	0	0	110.4	K465 F466 G467 S468 V470	N463-K465 PolarHBondContact O-N 3.25Å; N463-K465 WeakPolarHBondContact OD1-CB 3.32Å; N463-K465 PolarHBondContact OD1-N 3.18Å; N463-F466 HydrophobicContact CB-CD2 4.4Å; N463-F466 PolarHBondContact O-N 3.31Å; N463-F466 VanDerWaalsContact O-N 3.14Å; N463-G467 PolarHBondContact O-N 2.74Å; N463-S468 WeakPolarHBondContact CB-O 3.43Å; N463-S468 PolarHBondContact N-O 3.11Å; N463-S468 PolarHBondContact O-N 3Å; N463-V470 HydrophobicContact CB-CG2 3.74Å
464	S	63.4	Low	66.6	Low	29 Å²	29	77.2 Å²	77.2	20%	0.203	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.5	178.3	52.9	0	0	0	0	113.9	F466 F495	S464-F466 VanDerWaalsContact C-N 3.34Å; S464-F466 PolarHBondContact O-N 3.04Å; S464-F495 PolarHBondContact OG-O 3.48Å
465	K	56.6	Low	64.4	Low	175 Å²	175	75.8 Å²	75.8	76%	0.761	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.5	179.9	-171	175	-179.5	176.4	0	113.5	N463	N463-K465 PolarHBondContact O-N 3.25Å; N463-K465 WeakPolarHBondContact OD1-CB 3.32Å; N463-K465 PolarHBondContact OD1-N 3.18Å
466	F	56.6	Low	61.9	Low	142 Å²	142	77.2 Å²	77.2	62%	0.623	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	3	-177.8	-60.1	-59.7	0	0	0	113.8	N463 S464 S468	N463-F466 HydrophobicContact CB-CD2 4.4Å; N463-F466 PolarHBondContact O-N 3.31Å; N463-F466 VanDerWaalsContact O-N 3.14Å; S464-F466 VanDerWaalsContact C-N 3.34Å; S464-F466 PolarHBondContact O-N 3.04Å; F466-S468 VanDerWaalsContact CB-OG 3.28Å; F466-S468 WeakPolarHBondContact CB-OG 3.26Å; F466-S468 WeakPolarHBondContact O-CB 3.32Å; F466-S468 PolarHBondContact O-N 3.43Å; F466-S468 VanDerWaalsContact O-N 3.14Å; F466-S468 PolarHBondContact O-OG 3.37Å
467	G	56.5	Low	59.3	Low	48 Å²	48	83.1 Å²	83.1	50%	0.495	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	33.7	-176.2	0	0	0	0	0	113.6	W462 N463	W462-G467 WeakPolarHBondContact CH2-O 2.88Å; W462-G467 VanDerWaalsContact CZ2-C 3.48Å; N463-G467 PolarHBondContact O-N 2.74Å
468	S	57.2	Low	56.5	Low	35 Å²	35	82.8 Å²	82.8	25%	0.245	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	165.1	-167.9	49.6	0	0	0	0	113.8	N463 F466	N463-S468 WeakPolarHBondContact CB-O 3.43Å; N463-S468 PolarHBondContact N-O 3.11Å; N463-S468 PolarHBondContact O-N 3Å; F466-S468 VanDerWaalsContact CB-OG 3.28Å; F466-S468 WeakPolarHBondContact CB-OG 3.26Å; F466-S468 WeakPolarHBondContact O-CB 3.32Å; F466-S468 PolarHBondContact O-N 3.43Å; F466-S468 VanDerWaalsContact O-N 3.14Å; F466-S468 PolarHBondContact O-OG 3.37Å
469	V	57.5	Low	53.4	Low	43 Å²	43	91.4 Å²	91.4	26%	0.261	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.6	179.7	168.9	0	0	0	0	111.4	Y460 Q461 W462 G471	Y460-V469 HydrophobicContact CD1-CG1 4.38Å; Y460-V469 HydrophobicContact CG-CG1 4.33Å; Y460-V469 HydrophobicContact CG-CG2 4.49Å; Q461-V469 WeakPolarHBondContact O-CA 3.17Å; W462-V469 HydrophobicContact CE3-CG2 4.23Å; V469-G471 PolarHBondContact O-N 3.11Å
470	V	55.2	Low	50.4	Low	85 Å²	85	96 Å²	96	52%	0.515	49%	0.494	S	S	.	.			trans	-78.5	113.4	177.3	-173.2	0	0	0	0	111.1	Q461 N463	Q461-V470 HydrophobicContact CB-CB 4.38Å; Q461-V470 HydrophobicContact CG-CB 4.39Å; Q461-V470 HydrophobicContact CG-CG2 4.14Å; Q461-V470 PolarHBondContact O-N 2.7Å; N463-V470 HydrophobicContact CB-CG2 3.74Å
471	G	45.7	Very low	47.4	Very low	55 Å²	55	103.9 Å²	103.9	57%	0.567	52%	0.523	S	S	*	.	S	Bend	trans	148	176.2	163.9	0	0	0	0	0	115.6	V469 Y473	V469-G471 PolarHBondContact O-N 3.11Å; G471-Y473 PolarHBondContact O-N 2.74Å; G471-Y473 VanDerWaalsContact O-N 3.16Å
472	K	37.2	Very low	44.4	Very low	220 Å²	220	107.1 Å²	107.1	96%	0.957	55%	0.546	S	S	*	.	S	Bend	trans	-72.3	3.8	178.8	-89.5	-176.8	175.4	176.2	0	114.9	S474	K472-S474 PolarHBondContact O-N 3.35Å
473	Y	36.8	Very low	42	Very low	155 Å²	155	110.1 Å²	110.1	61%	0.608	57%	0.567	S	S	*	*			trans	-75.8	95.1	173.3	-72.5	-73.9	0	0	0	109.5	R456 G471 I475	R456-Y473 PolarHBondContact NH1-OH 3.22Å; G471-Y473 PolarHBondContact O-N 2.74Å; G471-Y473 VanDerWaalsContact O-N 3.16Å; Y473-I475 PolarHBondContact O-N 2.91Å
474	S	29.6	Very low	39.9	Very low	87 Å²	87	116.3 Å²	116.3	61%	0.608	59%	0.594	S	S	*	*			trans	-61.3	120.5	-178.2	51.1	0	0	0	0	111.2	K472 A476 R477	K472-S474 PolarHBondContact O-N 3.35Å; S474-A476 PolarHBondContact O-N 3.11Å; S474-R477 PolarHBondContact O-N 3.34Å
475	I	38	Very low	38.3	Very low	88 Å²	88	118.9 Å²	118.9	45%	0.451	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-55.6	-19.6	178.4	-64.1	169.8	0	0	0	111.4	Y473 R477 L478	Y473-I475 PolarHBondContact O-N 2.91Å; I475-R477 PolarHBondContact O-N 3.1Å; I475-L478 HydrophobicContact CG2-CB 4.47Å; I475-L478 CarbonylContact O-C 3.44Å; I475-L478 WeakPolarHBondContact O-CA 3.43Å; I475-L478 WeakPolarHBondContact O-CB 3.44Å; I475-L478 PolarHBondContact O-N 3.49Å
476	A	29.7	Very low	36.8	Very low	85 Å²	85	116.9 Å²	116.9	70%	0.702	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-50	-9.6	173.2	0	0	0	0	0	117.7	S474	S474-A476 PolarHBondContact O-N 3.11Å
477	R	31.4	Very low	35.5	Very low	223 Å²	223	113.4 Å²	113.4	84%	0.842	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-98.9	-23.5	167.5	-73.6	-169	178.5	-170.8	1.3	114.8	S474 I475 K479	S474-R477 PolarHBondContact O-N 3.34Å; I475-R477 PolarHBondContact O-N 3.1Å; R477-K479 PolarHBondContact O-N 3.07Å
478	L	31.5	Very low	34.5	Very low	83 Å²	83	114.7 Å²	114.7	44%	0.435	60%	0.602	S	S	.	*	S	Bend	trans	-76.1	97	159.6	-80.2	165.7	0	0	0	107.1	I475 M480	I475-L478 HydrophobicContact CG2-CB 4.47Å; I475-L478 CarbonylContact O-C 3.44Å; I475-L478 WeakPolarHBondContact O-CA 3.43Å; I475-L478 WeakPolarHBondContact O-CB 3.44Å; I475-L478 PolarHBondContact O-N 3.49Å; L478-M480 PolarHBondContact O-N 2.99Å
479	K	25.3	Very low	33.3	Very low	195 Å²	195	121.7 Å²	121.7	85%	0.848	63%	0.628	S	S	*	*			trans	-74.5	50.6	168.5	-85	-169.5	175.1	-179.6	0	111.8	R477 R481	R477-K479 PolarHBondContact O-N 3.07Å; K479-R481 PolarHBondContact O-N 3.16Å
480	M	28.9	Very low	32.7	Very low	112 Å²	112	123.9 Å²	123.9	55%	0.552	63%	0.634	S	S	*	*			trans	-56.7	94.8	136.2	-73.1	176.7	171.9	0	0	105.9	L478	L478-M480 PolarHBondContact O-N 2.99Å
481	R	23.3	Very low	31.9	Very low	215 Å²	215	123.2 Å²	123.2	81%	0.811	63%	0.632	S	S	*	*			trans	-51	153.3	154.7	-86.1	178	161.7	164.2	-7.5	107.2	K479 V483	K479-R481 PolarHBondContact O-N 3.16Å; R481-V483 PolarHBondContact O-N 2.91Å; R481-V483 VanDerWaalsContact O-N 3.08Å
482	T	23.4	Very low	31.6	Very low	113 Å²	113	126 Å²	126	69%	0.693	64%	0.643	S	S	*	*			trans	-33.9	120	163.8	37.1	0	0	0	0	109.9	E484	T482-E484 PolarHBondContact O-N 3.48Å
483	V	29.6	Very low	31.7	Very low	83 Å²	83	117.2 Å²	117.2	50%	0.503	61%	0.61	S	S	.	*			trans	-74.8	71.8	-177.5	157.4	0	0	0	0	108.5	R481 T485	R481-V483 PolarHBondContact O-N 2.91Å; R481-V483 VanDerWaalsContact O-N 3.08Å; V483-T485 WeakPolarHBondContact CG1-O 3.49Å; V483-T485 WeakPolarHBondContact CG1-OG1 3.43Å; V483-T485 PolarHBondContact O-N 3.09Å
484	E	24.6	Very low	32.4	Very low	172 Å²	172	118.9 Å²	118.9	80%	0.804	62%	0.621	S	S	*	*			trans	-80.5	25.8	158.2	-62.8	179	143.8	0	0	110	T482	T482-E484 PolarHBondContact O-N 3.48Å
485	T	29.5	Very low	33.5	Very low	82 Å²	82	120.2 Å²	120.2	50%	0.503	62%	0.616	S	S	.	*	S	Bend	trans	-89.5	111.5	149	56.7	0	0	0	0	105.9	V483 S487	V483-T485 WeakPolarHBondContact CG1-O 3.49Å; V483-T485 WeakPolarHBondContact CG1-OG1 3.43Å; V483-T485 PolarHBondContact O-N 3.09Å; T485-S487 PolarHBondContact O-N 2.76Å
486	P	24.4	Very low	34.3	Very low	134 Å²	134	120.4 Å²	120.4	87%	0.87	62%	0.623	S	S	*	*	S	Bend	trans	-79.1	39.1	-157.3	33.1	-39.3	0	0	0	114.6
487	S	30	Very low	36.3	Very low	69 Å²	69	122 Å²	122	48%	0.483	62%	0.616	S	S	.	*			trans	-160.5	38.6	-160.7	64.8	0	0	0	0	114.8	D324 T485	D324-S487 WeakPolarHBondContact CB-O 3.46Å; T485-S487 PolarHBondContact O-N 2.76Å
488	I	35.1	Very low	38.7	Very low	75 Å²	75	111.4 Å²	111.4	39%	0.385	58%	0.576	S	S	.	*			trans	-138.9	109.6	154.7	-54.3	-178.9	0	0	0	108.5	D324 F490	D324-I488 WeakPolarHBondContact OD2-CA 3.3Å; I488-F490 HydrophobicContact CG2-CD1 4.07Å; I488-F490 HydrophobicContact CG2-CD2 4.43Å; I488-F490 HydrophobicContact CG2-CE1 3.61Å; I488-F490 HydrophobicContact CG2-CE2 4.01Å; I488-F490 HydrophobicContact CG2-CG 4.46Å; I488-F490 HydrophobicContact CG2-CZ 3.59Å
489	K	33.7	Very low	41.5	Very low	181 Å²	181	107.4 Å²	107.4	79%	0.787	56%	0.555	S	S	*	*			trans	-126.5	86.1	174.9	-78.3	-177.1	178.1	174.6	0	109.2	D324 P491	D324-K489 PolarHBondContact OD2-N 2.94Å; K489-P491 WeakPolarHBondContact O-CD 3.31Å; K489-P491 VanDerWaalsContact O-N 3.11Å
490	F	43.9	Very low	44.6	Very low	89 Å²	89	99.3 Å²	99.3	39%	0.39	52%	0.521	S	S	.	.			trans	-52.8	120.1	174.8	-56.9	-59.2	0	0	0	110.9	I420 W462 I488 S545	I420-F490 HydrophobicContact CD1-CD1 3.77Å; I420-F490 HydrophobicContact CD1-CD2 4.35Å; I420-F490 HydrophobicContact CD1-CE1 3.68Å; I420-F490 HydrophobicContact CD1-CE2 4.27Å; I420-F490 HydrophobicContact CD1-CG 4.1Å; I420-F490 HydrophobicContact CD1-CZ 3.94Å; W462-F490 HydrophobicContact CH2-CD2 4.09Å; W462-F490 HydrophobicContact CH2-CE2 4.11Å; W462-F490 AromaticContact CZ2-CD2 3.88Å; W462-F490 HydrophobicContact CZ2-CD2 3.88Å; W462-F490 HydrophobicContact CZ2-CE2 4.3Å; W462-F490 HydrophobicContact CZ2-CG 4.38Å; I488-F490 HydrophobicContact CG2-CD1 4.07Å; I488-F490 HydrophobicContact CG2-CD2 4.43Å; I488-F490 HydrophobicContact CG2-CE1 3.61Å; I488-F490 HydrophobicContact CG2-CE2 4.01Å; I488-F490 HydrophobicContact CG2-CG 4.46Å; I488-F490 HydrophobicContact CG2-CZ 3.59Å; F490-S545 WeakPolarHBondContact CD1-OG 3.28Å; F490-S545 VanDerWaalsContact CE1-OG 3.27Å; F490-S545 WeakPolarHBondContact CE1-OG 3.24Å
491	P	38.9	Very low	47.7	Very low	72 Å²	72	94 Å²	94	47%	0.468	49%	0.494	S	S	.	.			trans	-65.4	139.1	-177.1	24.6	-33	0	0	0	110.5	K489 A493	K489-P491 WeakPolarHBondContact O-CD 3.31Å; K489-P491 VanDerWaalsContact O-N 3.11Å; P491-A493 PolarHBondContact O-N 2.78Å
492	S	38.4	Very low	51	Low	114 Å²	114	84.1 Å²	84.1	80%	0.797	46%	0.458	S	S	*	.			trans	-78	44.1	-174.6	61.2	0	0	0	0	113.1	K494	S492-K494 PolarHBondContact O-N 2.7Å
493	A	40.1	Very low	54.3	Low	34 Å²	34	78.9 Å²	78.9	28%	0.281	43%	0.426	S	S	.	.			trans	-91.7	96.6	-163.4	0	0	0	0	0	113.5	P491 F495	P491-A493 PolarHBondContact O-N 2.78Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 VanDerWaalsContact O-CD2 3.27Å; A493-F495 WeakPolarHBondContact O-CD2 3.13Å; A493-F495 PolarHBondContact O-N 3.46Å
494	K	51.2	Low	57.4	Low	190 Å²	190	75.3 Å²	75.3	83%	0.826	40%	0.404	S	S	*	.	S	Bend	trans	51.6	-17.4	147.6	-71.1	-177.2	175.4	177.2	0	122.4	S492 P496	S492-K494 PolarHBondContact O-N 2.7Å; K494-P496 WeakPolarHBondContact O-CD 3.26Å
495	F	52.4	Low	60.6	Low	116 Å²	116	67.2 Å²	67.2	51%	0.509	37%	0.366	S	S	.	.			trans	-95	118.5	-174.2	-62.5	-74.1	0	0	0	112.4	S464 A493 H497	S464-F495 PolarHBondContact OG-O 3.48Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 VanDerWaalsContact O-CD2 3.27Å; A493-F495 WeakPolarHBondContact O-CD2 3.13Å; A493-F495 PolarHBondContact O-N 3.46Å; F495-H497 VanDerWaalsContact C-N 3.34Å
496	P	54.7	Low	63.5	Low	92 Å²	92	63.5 Å²	63.5	60%	0.597	34%	0.343	S	S	*	.	S	Bend	trans	-81.2	-11.9	177.7	31.8	-34.1	0	0	0	113.7	K494	K494-P496 WeakPolarHBondContact O-CD 3.26Å
497	H	71.6	Confident	66.6	Low	118 Å²	118	60.6 Å²	60.6	55%	0.546	32%	0.317	S	S	.	.			trans	-119.1	104.4	-179.2	-55.3	-58.8	0	0	0	109.4	F495	F495-H497 VanDerWaalsContact C-N 3.34Å
498	S	82.9	Confident	69.2	Low	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.4	175.7	-51.7	0	0	0	0	110.4	V421 V423 Q461 W462	V421-S498 CarbonylContact O-C 3.44Å; V421-S498 WeakPolarHBondContact O-CA 2.97Å; V421-S498 WeakPolarHBondContact O-CB 3.4Å; V423-S498 CarbonylContact O-C 3.59Å; V423-S498 WeakPolarHBondContact O-CA 3.16Å; Q461-S498 PolarHBondContact NE2-O 3.15Å; W462-S498 WeakPolarHBondContact CB-O 3.43Å; W462-S498 PolarHBondContact N-O 2.82Å
499	T	90.2	Very high	71.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.3	-173.5	-63.8	0	0	0	0	110.2	I420 V421 V423 S424 S425 F428 I459 Y460	I420-T499 CarbonylContact C-O 3.42Å; I420-T499 WeakPolarHBondContact CA-O 3.03Å; V421-T499 PolarHBondContact N-O 3.49Å; V421-T499 PolarHBondContact O-N 3.4Å; V423-T499 PolarHBondContact O-N 2.81Å; V423-T499 PolarHBondContact O-OG1 3.28Å; S424-T499 VanDerWaalsContact C-OG1 3.24Å; S425-T499 WeakPolarHBondContact CA-OG1 3.11Å; S425-T499 WeakPolarHBondContact CB-OG1 3.42Å; S425-T499 PolarHBondContact N-OG1 2.83Å; S425-T499 VanDerWaalsContact N-OG1 3.08Å; F428-T499 HydrophobicContact CB-CG2 4.2Å; F428-T499 HydrophobicContact CD1-CG2 3.83Å; F428-T499 HydrophobicContact CE1-CG2 4.45Å; F428-T499 HydrophobicContact CG-CG2 4.01Å; I459-T499 HydrophobicContact CG2-CG2 3.61Å; Y460-T499 WeakPolarHBondContact O-CA 3.48Å
500	L	90.5	Very high	72.9	Confident	24 Å²	24	55.8 Å²	55.8	13%	0.126	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.2	168	-175.9	154.1	0	0	0	108.3	V418 A419 Y460 W462 V502	V418-L500 HydrophobicContact CG1-CD1 4.12Å; V418-L500 HydrophobicContact CG1-CD2 4Å; V418-L500 HydrophobicContact CG1-CG 3.99Å; A419-L500 WeakPolarHBondContact O-CA 3.11Å; Y460-L500 HydrophobicContact CD2-CD2 3.91Å; Y460-L500 PolarHBondContact N-O 2.8Å; Y460-L500 PolarHBondContact O-N 3.15Å; W462-L500 HydrophobicContact CB-CB 4.4Å; W462-L500 HydrophobicContact CE3-CB 4.21Å; W462-L500 HydrophobicContact CE3-CD1 3.71Å; W462-L500 HydrophobicContact CZ3-CD1 3.68Å; L500-V502 HydrophobicContact CD2-CG2 4.11Å
501	V	92.7	Very high	73.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141.2	176.9	62.2	0	0	0	0	110.3	A419 V421 F428 V449 M458 I459 L503	A419-V501 HydrophobicContact CB-CG1 4.07Å; A419-V501 PolarHBondContact N-O 3.23Å; A419-V501 PolarHBondContact O-N 2.88Å; V421-V501 HydrophobicContact CG2-CG1 4.16Å; F428-V501 HydrophobicContact CE1-CB 3.97Å; F428-V501 HydrophobicContact CE1-CG1 4.35Å; F428-V501 HydrophobicContact CE1-CG2 3.92Å; F428-V501 HydrophobicContact CZ-CB 4.13Å; F428-V501 HydrophobicContact CZ-CG1 3.99Å; F428-V501 HydrophobicContact CZ-CG2 4.18Å; V449-V501 HydrophobicContact CG1-CG2 4.19Å; V449-V501 HydrophobicContact CG2-CG2 4.46Å; M458-V501 WeakPolarHBondContact O-CA 3.24Å; I459-V501 HydrophobicContact CG1-CG2 4.12Å; V501-L503 HydrophobicContact CG1-CG 4.39Å; V501-L503 HydrophobicContact CG2-CD2 3.64Å; V501-L503 HydrophobicContact CG2-CG 4.12Å
502	V	93	Very high	74.7	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.055	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.7	171.2	-172.4	0	0	0	0	109.4	R416 I417 V418 D450 M458 L500	R416-V502 HydrophobicContact CB-CG1 3.88Å; R416-V502 HydrophobicContact CG-CG1 4.43Å; I417-V502 CarbonylContact O-C 3.57Å; I417-V502 WeakPolarHBondContact O-CA 3.1Å; V418-V502 HydrophobicContact CG2-CG1 4.49Å; V418-V502 HydrophobicContact CG2-CG2 4.28Å; D450-V502 HydrophobicContact CB-CB 4.21Å; D450-V502 HydrophobicContact CB-CG1 3.9Å; D450-V502 PolarHBondContact N-O 3.29Å; M458-V502 HydrophobicContact CB-CB 3.87Å; M458-V502 HydrophobicContact CB-CG2 4.21Å; M458-V502 HydrophobicContact CE-CB 4.22Å; M458-V502 HydrophobicContact CE-CG1 4.49Å; M458-V502 HydrophobicContact CE-CG2 3.9Å; M458-V502 PolarHBondContact O-N 3.22Å; M458-V502 VanDerWaalsContact O-N 3.07Å; M458-V502 HydrophobicContact SD-CB 4.38Å; L500-V502 HydrophobicContact CD2-CG2 4.11Å
503	L	93.8	Very high	75.8	Confident	3 Å²	3	56 Å²	56	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.5	-172.8	-55.9	171.3	0	0	0	111.4	I417 F435 L436 L439 I447 R448 V449 V501	I417-L503 HydrophobicContact CB-CB 4.28Å; I417-L503 PolarHBondContact N-O 3.24Å; I417-L503 PolarHBondContact O-N 3.32Å; F435-L503 HydrophobicContact CE1-CD1 3.91Å; F435-L503 HydrophobicContact CE1-CD2 4.12Å; F435-L503 HydrophobicContact CZ-CD1 4.08Å; L436-L503 HydrophobicContact CD2-CD2 4.36Å; L439-L503 HydrophobicContact CD2-CD1 3.78Å; I447-L503 HydrophobicContact CG2-CB 4.32Å; I447-L503 HydrophobicContact CG2-CD1 4.12Å; I447-L503 HydrophobicContact CG2-CD2 4.27Å; I447-L503 HydrophobicContact CG2-CG 4.48Å; R448-L503 CarbonylContact O-C 3.52Å; R448-L503 VanDerWaalsContact O-CA 3.26Å; R448-L503 WeakPolarHBondContact O-CA 3.49Å; V449-L503 HydrophobicContact CG2-CD2 4.02Å; V501-L503 HydrophobicContact CG1-CG 4.39Å; V501-L503 HydrophobicContact CG2-CD2 3.64Å; V501-L503 HydrophobicContact CG2-CG 4.12Å
504	T	92.7	Very high	77.3	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.049	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	150.2	164.9	60.9	0	0	0	0	109.9	R448 D450 H506	R448-T504 PolarHBondContact N-O 3.3Å; R448-T504 PolarHBondContact O-N 3.34Å; D450-T504 HydrophobicContact CB-CG2 4.06Å; T504-H506 PolarHBondContact OG1-NE2 3.13Å
505	V	92.5	Very high	78.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.7	178.8	-174.9	0	0	0	0	108.1	L413 I417 A445 I447 V522	L413-V505 HydrophobicContact CB-CB 4.29Å; L413-V505 HydrophobicContact CD1-CB 3.87Å; L413-V505 HydrophobicContact CD1-CG1 3.58Å; L413-V505 HydrophobicContact CG-CB 4.02Å; L413-V505 HydrophobicContact CG-CG1 4Å; L413-V505 PolarHBondContact N-O 2.8Å; I417-V505 HydrophobicContact CD1-CG2 3.55Å; I417-V505 HydrophobicContact CG1-CG2 4.34Å; A445-V505 HydrophobicContact CB-CG1 3.65Å; I447-V505 HydrophobicContact CD1-CB 4.3Å; I447-V505 HydrophobicContact CD1-CG1 3.95Å; I447-V505 HydrophobicContact CD1-CG2 3.84Å; V505-V522 HydrophobicContact CG1-CG2 4.46Å; V505-V522 HydrophobicContact CG2-CG1 4.35Å; V505-V522 HydrophobicContact CG2-CG2 4.39Å
506	H	91.4	Very high	80.6	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.019	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140	177	-57	-105	0	0	0	109.2	R408 G411 I446 T504	R408-H506 PolarHBondContact O-CE1 3.27Å; R408-H506 PolarHBondContact O-ND1 2.96Å; G411-H506 CarbonylContact O-C 3.56Å; G411-H506 WeakPolarHBondContact O-CA 3.42Å; I446-H506 HydrophobicContact CB-CB 4.19Å; I446-H506 HydrophobicContact CG2-CB 4.24Å; I446-H506 PolarHBondContact N-O 2.66Å; I446-H506 PolarHBondContact O-N 2.87Å; T504-H506 PolarHBondContact OG1-NE2 3.13Å
507	K	88.6	Confident	82.2	Confident	74 Å²	74	42.7 Å²	42.7	32%	0.322	23%	0.227	S	C	.	.			trans	-67	141.8	174.7	-61.7	-171.7	178.3	-140.1	0	110.7	G411 L413 P509 S515 F516	G411-K507 PolarHBondContact O-N 2.9Å; L413-K507 HydrophobicContact CD2-CD 4.34Å; L413-K507 HydrophobicContact CD2-CG 3.84Å; K507-P509 WeakPolarHBondContact O-CD 3.39Å; K507-S515 PolarHBondContact NZ-OG 2.03Å; K507-F516 WeakPolarHBondContact CE-O 3.44Å; K507-F516 PolarHBondContact NZ-O 3.1Å; K507-F516 VanDerWaalsContact NZ-O 3.07Å
508	I	83.8	Confident	83.1	Confident	19 Å²	19	38.6 Å²	38.6	10%	0.097	21%	0.209	C	C	.	.			trans	-66.3	116.8	169.5	-64.3	166.4	0	0	0	107.6	F397 Q444 I446 Y510 N511	F397-I508 HydrophobicContact CD2-CG1 4.32Å; F397-I508 HydrophobicContact CD2-CG2 4.09Å; F397-I508 HydrophobicContact CE2-CB 4.5Å; F397-I508 HydrophobicContact CE2-CD1 4.13Å; F397-I508 HydrophobicContact CE2-CG1 4.2Å; F397-I508 HydrophobicContact CE2-CG2 3.49Å; F397-I508 VanDerWaalsContact CE2-CG2 3.49Å; F397-I508 HydrophobicContact CZ-CG2 3.92Å; Q444-I508 WeakPolarHBondContact O-CD1 3.38Å; I446-I508 HydrophobicContact CD1-CG1 4.44Å; I446-I508 HydrophobicContact CG1-CG1 4.13Å; I508-Y510 PolarHBondContact O-N 3.37Å; I508-Y510 VanDerWaalsContact O-N 3.16Å; I508-N511 HydrophobicContact CB-CB 4.19Å; I508-N511 HydrophobicContact CG2-CB 3.92Å; I508-N511 PolarHBondContact O-N 3.3Å
509	P	76.1	Confident	83.4	Confident	51 Å²	51	38.6 Å²	38.6	33%	0.331	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.9	-170.4	29.3	-36.9	0	0	0	114	L403 Q407 K507	L403-P509 HydrophobicContact CD2-CG 3.72Å; Q407-P509 HydrophobicContact CG-CB 4.2Å; K507-P509 WeakPolarHBondContact O-CD 3.39Å
510	Y	70.7	Confident	83.4	Confident	154 Å²	154	40 Å²	40	60%	0.604	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-3.9	-177.7	-50.1	-56.1	0	0	0	113.7	F397 Q407 I508	F397-Y510 HydrophobicContact CE1-CD2 4.18Å; Q407-Y510 PolarHBondContact NE2-OH 3.22Å; I508-Y510 PolarHBondContact O-N 3.37Å; I508-Y510 VanDerWaalsContact O-N 3.16Å
511	N	64.7	Low	83.4	Confident	64 Å²	64	40.1 Å²	40.1	34%	0.342	22%	0.218	S	C	.	.			trans	-110.6	119.1	-179.7	-168.8	-4.2	0	0	0	111.1	I508 A513	I508-N511 HydrophobicContact CB-CB 4.19Å; I508-N511 HydrophobicContact CG2-CB 3.92Å; I508-N511 PolarHBondContact O-N 3.3Å; N511-A513 WeakPolarHBondContact OD1-CB 3.49Å; N511-A513 PolarHBondContact OD1-N 3.2Å
512	N	56.3	Low	83.4	Confident	175 Å²	175	40.1 Å²	40.1	94%	0.936	22%	0.218	S	C	*	.			trans	-90.1	1.3	177.7	-74.4	-38.3	0	0	0	113.6
513	A	61.4	Low	83.3	Confident	39 Å²	39	39.7 Å²	39.7	32%	0.322	22%	0.215	S	C	.	.	S	Bend	trans	-92.8	153.9	179.7	0	0	0	0	0	113.3	L363 N511 S515	L363-A513 HydrophobicContact CD2-CB 3.85Å; N511-A513 WeakPolarHBondContact OD1-CB 3.49Å; N511-A513 PolarHBondContact OD1-N 3.2Å; A513-S515 VanDerWaalsContact C-N 3.33Å; A513-S515 PolarHBondContact O-N 3.24Å
514	S	71.5	Confident	83.2	Confident	28 Å²	28	40.4 Å²	40.4	20%	0.196	22%	0.219	C	C	.	.	S	Bend	trans	24.7	50.3	162.2	-58.9	0	0	0	0	119.1	N351 F360	N351-S514 PolarHBondContact OD1-OG 2.87Å; F360-S514 WeakPolarHBondContact CE1-O 3.44Å
515	S	83.4	Confident	83.2	Confident	45 Å²	45	40 Å²	40	32%	0.315	22%	0.217	S	C	.	.			trans	-89	136.9	175.3	73.8	0	0	0	0	112.4	F357 K507 A513	F357-S515 WeakPolarHBondContact CZ-O 3.32Å; K507-S515 PolarHBondContact NZ-OG 2.03Å; A513-S515 VanDerWaalsContact C-N 3.33Å; A513-S515 PolarHBondContact O-N 3.24Å
516	F	90.3	Very high	83.2	Confident	5 Å²	5	40.1 Å²	40.1	2%	0.022	22%	0.217	C	C	.	.			trans	-59.4	154.4	167.8	-62.7	-77	0	0	0	112.5	E353 F357 F360 L413 L443 K507 R521 V522 F525	E353-F516 HydrophobicContact CG-CD1 4.2Å; E353-F516 VanDerWaalsContact OE1-CA 3.3Å; E353-F516 WeakPolarHBondContact OE1-CA 3.4Å; F357-F516 HydrophobicContact CD2-CD1 4.15Å; F357-F516 AromaticContact CD2-CE1 3.84Å; F357-F516 HydrophobicContact CD2-CE1 3.84Å; F357-F516 HydrophobicContact CD2-CZ 4.05Å; F357-F516 AromaticContact CE2-CD1 3.67Å; F357-F516 HydrophobicContact CE2-CD1 3.67Å; F357-F516 HydrophobicContact CE2-CD2 4.48Å; F357-F516 AromaticContact CE2-CE1 3.85Å; F357-F516 HydrophobicContact CE2-CE1 3.85Å; F357-F516 HydrophobicContact CE2-CG 4.02Å; F357-F516 HydrophobicContact CE2-CZ 4.34Å; F360-F516 HydrophobicContact CE2-CE2 4.08Å; F360-F516 HydrophobicContact CE2-CZ 4.27Å; F360-F516 HydrophobicContact CZ-CD2 4.48Å; F360-F516 AromaticContact CZ-CE2 3.63Å; F360-F516 HydrophobicContact CZ-CE2 3.63Å; F360-F516 AromaticContact CZ-CZ 3.91Å; F360-F516 HydrophobicContact CZ-CZ 3.91Å; L413-F516 HydrophobicContact CD1-CB 3.83Å; L413-F516 WeakPolarHBondContact CD2-O 3.28Å; L443-F516 HydrophobicContact CD2-CE2 4.15Å; K507-F516 WeakPolarHBondContact CE-O 3.44Å; K507-F516 PolarHBondContact NZ-O 3.1Å; K507-F516 VanDerWaalsContact NZ-O 3.07Å; F516-R521 HydrophobicContact CD1-CB 3.62Å; F516-R521 HydrophobicContact CE1-CB 4.14Å; F516-V522 HydrophobicContact CB-CG2 3.88Å; F516-V522 HydrophobicContact CD1-CG2 4.33Å; F516-V522 HydrophobicContact CD2-CG2 3.75Å; F516-V522 HydrophobicContact CE2-CG2 4.34Å; F516-V522 HydrophobicContact CG-CG2 3.73Å; F516-F525 HydrophobicContact CE1-CB 4.38Å; F516-F525 HydrophobicContact CZ-CB 3.92Å; F516-F525 AromaticContact CZ-CD2 3.8Å; F516-F525 HydrophobicContact CZ-CD2 3.8Å; F516-F525 HydrophobicContact CZ-CG 4Å
517	T	88.4	Confident	83.1	Confident	75 Å²	75	40 Å²	40	46%	0.46	22%	0.217	S	C	.	.	S	Bend	trans	-99.4	-26.9	179.5	58.6	0	0	0	0	113.2	E353	E353-T517 VanDerWaalsContact CD-OG1 3.26Å; E353-T517 PolarHBondContact OE1-N 2.82Å; E353-T517 PolarHBondContact OE1-OG1 3.21Å; E353-T517 WeakPolarHBondContact OE2-CB 3.16Å; E353-T517 WeakPolarHBondContact OE2-CG2 3.27Å; E353-T517 PolarHBondContact OE2-OG1 3.17Å
518	N	89.8	Confident	83.1	Confident	33 Å²	33	37.3 Å²	37.3	18%	0.176	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-155.3	158.4	-177.4	68	89.1	0	0	0	111.1	T414 S520 R521	T414-N518 WeakPolarHBondContact OG1-CB 3.47Å; N518-S520 PolarHBondContact O-N 3.45Å; N518-S520 VanDerWaalsContact O-N 3.16Å; N518-S520 VanDerWaalsContact OD1-CB 3.26Å; N518-S520 WeakPolarHBondContact OD1-CB 3.43Å; N518-S520 PolarHBondContact OD1-N 2.89Å; N518-S520 VanDerWaalsContact OD1-N 3.08Å; N518-R521 PolarHBondContact O-N 3.41Å
519	S	90.3	Very high	83.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-18.8	-173.9	-62.5	0	0	0	0	114.3	T414 G415 R521 V522 T523	T414-S519 WeakPolarHBondContact O-CB 3.5Å; T414-S519 PolarHBondContact O-N 3.2Å; T414-S519 PolarHBondContact O-OG 2.8Å; G415-S519 WeakPolarHBondContact O-CB 3.49Å; G415-S519 PolarHBondContact O-OG 2.85Å; S519-R521 PolarHBondContact O-N 3.17Å; S519-V522 WeakPolarHBondContact O-CB 3.15Å; S519-V522 PolarHBondContact O-N 3.3Å; S519-T523 WeakPolarHBondContact O-CG2 3.44Å; S519-T523 PolarHBondContact O-N 3.08Å
520	S	90	Very high	83.4	Confident	30 Å²	30	36.8 Å²	36.8	21%	0.21	20%	0.204	C	C	.	.	H	α-helix	trans	-71.3	-29.6	179	-174	0	0	0	0	112.8	N518 V522 T523 D524	N518-S520 PolarHBondContact O-N 3.45Å; N518-S520 VanDerWaalsContact O-N 3.16Å; N518-S520 VanDerWaalsContact OD1-CB 3.26Å; N518-S520 WeakPolarHBondContact OD1-CB 3.43Å; N518-S520 PolarHBondContact OD1-N 2.89Å; N518-S520 VanDerWaalsContact OD1-N 3.08Å; S520-V522 VanDerWaalsContact C-N 3.34Å; S520-T523 WeakPolarHBondContact CA-OG1 3.41Å; S520-T523 PolarHBondContact O-N 3.26Å; S520-T523 PolarHBondContact O-OG1 2.95Å; S520-D524 PolarHBondContact O-N 3.34Å
521	R	91	Very high	84.3	Confident	25 Å²	25	29.5 Å²	29.5	9%	0.094	18%	0.175	C	C	.	.	H	α-helix	trans	-75.1	-30.8	175.4	-54.1	-49.5	-161.6	99.6	4.6	111.5	Q330 E353 D354 F516 N518 S519 D524 F525	Q330-R521 VanDerWaalsContact CD-CZ 3.44Å; Q330-R521 VanDerWaalsContact CD-NH2 3.3Å; Q330-R521 VanDerWaalsContact NE2-CZ 3.33Å; Q330-R521 VanDerWaalsContact NE2-NE 3.2Å; E353-R521 HydrophobicContact CG-CB 4.06Å; E353-R521 HydrophobicContact CG-CG 3.9Å; E353-R521 PolarHBondContact O-NH1 2.92Å; E353-R521 WeakPolarHBondContact OE1-CB 3.45Å; E353-R521 VanDerWaalsContact OE1-CG 3.28Å; E353-R521 WeakPolarHBondContact OE1-CG 3.42Å; D354-R521 IonicContact OD1-CZ 3.81Å; D354-R521 IonicContact OD1-NH1 3.32Å; D354-R521 PolarHBondContact OD1-NH1 2.83Å; D354-R521 IonicContact OD1-NH2 2.87Å; D354-R521 PolarHBondContact OD1-NH2 3.44Å; F516-R521 HydrophobicContact CD1-CB 3.62Å; F516-R521 HydrophobicContact CE1-CB 4.14Å; N518-R521 PolarHBondContact O-N 3.41Å; S519-R521 PolarHBondContact O-N 3.17Å; R521-D524 PolarHBondContact O-N 3.5Å; R521-F525 PolarHBondContact O-N 3.06Å
522	V	92.3	Very high	85.4	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-41.3	170.5	-171.3	0	0	0	0	110.5	L413 I417 L443 V505 F516 S519 S520 F525 L526	L413-V522 HydrophobicContact CD1-CG2 4.01Å; I417-V522 HydrophobicContact CD1-CB 3.75Å; I417-V522 HydrophobicContact CD1-CG1 3.42Å; I417-V522 VanDerWaalsContact CD1-CG1 3.42Å; L443-V522 HydrophobicContact CD1-CG1 3.49Å; L443-V522 VanDerWaalsContact CD1-CG1 3.49Å; L443-V522 HydrophobicContact CD2-CG1 3.76Å; L443-V522 HydrophobicContact CG-CG1 4.23Å; V505-V522 HydrophobicContact CG1-CG2 4.46Å; V505-V522 HydrophobicContact CG2-CG1 4.35Å; V505-V522 HydrophobicContact CG2-CG2 4.39Å; F516-V522 HydrophobicContact CB-CG2 3.88Å; F516-V522 HydrophobicContact CD1-CG2 4.33Å; F516-V522 HydrophobicContact CD2-CG2 3.75Å; F516-V522 HydrophobicContact CE2-CG2 4.34Å; F516-V522 HydrophobicContact CG-CG2 3.73Å; S519-V522 WeakPolarHBondContact O-CB 3.15Å; S519-V522 PolarHBondContact O-N 3.3Å; S520-V522 VanDerWaalsContact C-N 3.34Å; V522-F525 PolarHBondContact O-N 2.96Å; V522-L526 HydrophobicContact CG1-CD1 4.29Å; V522-L526 WeakPolarHBondContact O-CG 3.1Å; V522-L526 PolarHBondContact O-N 3.43Å
523	T	91.2	Very high	86.7	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-69.3	-35.7	175	60	0	0	0	0	112.9	L325 I417 S519 S520 F525 L526 S527 V546 T548	L325-T523 WeakPolarHBondContact CD1-O 3.14Å; I417-T523 HydrophobicContact CB-CG2 4.38Å; I417-T523 HydrophobicContact CD1-CG2 4.35Å; I417-T523 HydrophobicContact CG1-CG2 3.92Å; I417-T523 HydrophobicContact CG2-CG2 3.92Å; S519-T523 WeakPolarHBondContact O-CG2 3.44Å; S519-T523 PolarHBondContact O-N 3.08Å; S520-T523 WeakPolarHBondContact CA-OG1 3.41Å; S520-T523 PolarHBondContact O-N 3.26Å; S520-T523 PolarHBondContact O-OG1 2.95Å; T523-F525 VanDerWaalsContact C-N 3.32Å; T523-F525 PolarHBondContact O-N 3.29Å; T523-L526 PolarHBondContact O-N 3.14Å; T523-S527 WeakPolarHBondContact O-CB 3.42Å; T523-S527 PolarHBondContact O-N 2.93Å; T523-V546 HydrophobicContact CG2-CG1 3.53Å; T523-T548 HydrophobicContact CG2-CG2 3.65Å
524	D	91.3	Very high	87.9	Confident	17 Å²	17	26.2 Å²	26.2	9%	0.091	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-43.6	170.8	-70.8	-22.7	0	0	0	110.9	L356 S520 R521 S527	L356-D524 HydrophobicContact CD1-CB 4.37Å; L356-D524 HydrophobicContact CD2-CB 3.8Å; S520-D524 PolarHBondContact O-N 3.34Å; R521-D524 PolarHBondContact O-N 3.5Å; D524-S527 WeakPolarHBondContact O-CB 3.4Å; D524-S527 PolarHBondContact O-N 3.45Å; D524-S527 PolarHBondContact O-OG 3.04Å
525	F	93.1	Very high	88.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.4	-49	175	-173.1	-79.1	0	0	0	112.5	F341 L356 F360 L442 L443 F516 R521 V522 T523 S527 V528 V531	F341-F525 AromaticContact CE2-CD2 3.85Å; F341-F525 HydrophobicContact CE2-CD2 3.85Å; F341-F525 AromaticContact CE2-CE2 3.83Å; F341-F525 HydrophobicContact CE2-CE2 3.83Å; F341-F525 AromaticContact CZ-CD2 3.84Å; F341-F525 HydrophobicContact CZ-CD2 3.84Å; F341-F525 AromaticContact CZ-CE2 3.76Å; F341-F525 HydrophobicContact CZ-CE2 3.76Å; F341-F525 HydrophobicContact CZ-CG 4.37Å; F341-F525 HydrophobicContact CZ-CZ 4.21Å; L356-F525 HydrophobicContact CB-CD2 4.23Å; L356-F525 HydrophobicContact CD2-CB 4.49Å; F360-F525 AromaticContact CD2-CE2 3.69Å; F360-F525 HydrophobicContact CD2-CE2 3.69Å; F360-F525 AromaticContact CD2-CZ 3.69Å; F360-F525 HydrophobicContact CD2-CZ 3.69Å; F360-F525 HydrophobicContact CE2-CD2 4.3Å; F360-F525 AromaticContact CE2-CE2 3.54Å; F360-F525 HydrophobicContact CE2-CE2 3.54Å; F360-F525 AromaticContact CE2-CZ 3.71Å; F360-F525 HydrophobicContact CE2-CZ 3.71Å; F360-F525 HydrophobicContact CZ-CE2 4.46Å; L442-F525 HydrophobicContact CG-CE1 4.48Å; L442-F525 WeakPolarHBondContact O-CE1 3.17Å; L442-F525 WeakPolarHBondContact O-CZ 3.24Å; L443-F525 HydrophobicContact CD2-CB 4.47Å; L443-F525 HydrophobicContact CD2-CD1 3.48Å; L443-F525 VanDerWaalsContact CD2-CD1 3.48Å; L443-F525 HydrophobicContact CD2-CE1 3.85Å; L443-F525 HydrophobicContact CD2-CG 4.1Å; F516-F525 HydrophobicContact CE1-CB 4.38Å; F516-F525 HydrophobicContact CZ-CB 3.92Å; F516-F525 AromaticContact CZ-CD2 3.8Å; F516-F525 HydrophobicContact CZ-CD2 3.8Å; F516-F525 HydrophobicContact CZ-CG 4Å; R521-F525 PolarHBondContact O-N 3.06Å; V522-F525 PolarHBondContact O-N 2.96Å; T523-F525 VanDerWaalsContact C-N 3.32Å; T523-F525 PolarHBondContact O-N 3.29Å; F525-S527 PolarHBondContact O-N 2.76Å; F525-V528 PolarHBondContact O-N 3.46Å; F525-V531 HydrophobicContact CD1-CG1 4.01Å; F525-V531 HydrophobicContact CD1-CG2 4.1Å; F525-V531 HydrophobicContact CE1-CG1 3.79Å; F525-V531 HydrophobicContact CE1-CG2 3.83Å; F525-V531 HydrophobicContact CZ-CG2 4.38Å
526	L	92.1	Very high	88.8	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-68.7	-14.3	178.6	-64	177.6	0	0	0	113.9	L439 L443 V522 T523 V528 V531 I535 V546	L439-L526 HydrophobicContact CD1-CD1 4.17Å; L439-L526 HydrophobicContact CD1-CD2 3.53Å; L443-L526 HydrophobicContact CD1-CD1 4.29Å; L443-L526 HydrophobicContact CD1-CD2 4.25Å; L443-L526 HydrophobicContact CD1-CG 4.47Å; L443-L526 HydrophobicContact CD2-CD2 3.96Å; L443-L526 HydrophobicContact CD2-CG 4.23Å; L443-L526 HydrophobicContact CG-CD2 4.27Å; V522-L526 HydrophobicContact CG1-CD1 4.29Å; V522-L526 WeakPolarHBondContact O-CG 3.1Å; V522-L526 PolarHBondContact O-N 3.43Å; T523-L526 PolarHBondContact O-N 3.14Å; L526-V528 VanDerWaalsContact C-N 3.31Å; L526-V531 HydrophobicContact CD2-CG1 4.05Å; L526-I535 HydrophobicContact CD2-CD1 4.09Å; L526-V546 HydrophobicContact CB-CG1 4.49Å; L526-V546 HydrophobicContact CB-CG2 4.17Å; L526-V546 HydrophobicContact CD1-CG1 4.34Å
527	S	88.7	Confident	88.5	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-72.5	-23.4	175.1	80.6	0	0	0	0	113.2	A322 P327 T523 D524 F525 D529 K532	A322-S527 WeakPolarHBondContact O-CB 3.04Å; P327-S527 WeakPolarHBondContact CG-OG 3.3Å; T523-S527 WeakPolarHBondContact O-CB 3.42Å; T523-S527 PolarHBondContact O-N 2.93Å; D524-S527 WeakPolarHBondContact O-CB 3.4Å; D524-S527 PolarHBondContact O-N 3.45Å; D524-S527 PolarHBondContact O-OG 3.04Å; F525-S527 PolarHBondContact O-N 2.76Å; S527-D529 PolarHBondContact O-N 2.58Å; S527-K532 WeakPolarHBondContact O-CE 3.41Å; S527-K532 PolarHBondContact O-NZ 3.01Å
528	V	88	Confident	88.4	Confident	18 Å²	18	37.5 Å²	37.5	11%	0.109	17%	0.169	C	C	.	.	S	Bend	trans	-72.8	128.9	-173.9	-172.2	0	0	0	0	110.8	P327 F328 F341 L356 F525 L526 S530 V531 K532	P327-V528 HydrophobicContact CB-CG2 3.78Å; P327-V528 HydrophobicContact CG-CG2 4.19Å; F328-V528 HydrophobicContact CE2-CG2 4.16Å; F328-V528 HydrophobicContact CZ-CG2 4.39Å; F341-V528 HydrophobicContact CD1-CG1 4.02Å; F341-V528 HydrophobicContact CE1-CB 3.96Å; F341-V528 HydrophobicContact CE1-CG1 3.71Å; F341-V528 HydrophobicContact CE1-CG2 4.1Å; F341-V528 HydrophobicContact CZ-CB 4.43Å; F341-V528 HydrophobicContact CZ-CG2 4.22Å; L356-V528 HydrophobicContact CD1-CG2 4.28Å; F525-V528 PolarHBondContact O-N 3.46Å; L526-V528 VanDerWaalsContact C-N 3.31Å; V528-S530 VanDerWaalsContact C-N 3.32Å; V528-S530 WeakPolarHBondContact CG1-OG 3.18Å; V528-S530 PolarHBondContact O-N 3.25Å; V528-V531 HydrophobicContact CB-CG2 4.13Å; V528-V531 WeakPolarHBondContact O-CA 2.88Å; V528-V531 WeakPolarHBondContact O-CB 3.43Å; V528-V531 PolarHBondContact O-N 3.38Å; V528-K532 PolarHBondContact O-N 3.19Å; V528-K532 VanDerWaalsContact O-N 3.07Å
529	D	83.7	Confident	88.2	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.15	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-33.3	-174.6	166.8	59.6	0	0	0	114.1	N310 S527 V531 K532 R533	N310-D529 VanDerWaalsContact ND2-CB 3.33Å; N310-D529 WeakPolarHBondContact ND2-CB 3.02Å; N310-D529 PolarHBondContact ND2-OD2 2.99Å; S527-D529 PolarHBondContact O-N 2.58Å; D529-V531 VanDerWaalsContact C-N 3.28Å; D529-V531 PolarHBondContact O-N 3.33Å; D529-K532 PolarHBondContact O-N 3.31Å; D529-R533 WeakPolarHBondContact O-CB 3.25Å; D529-R533 WeakPolarHBondContact O-CG 3.49Å; D529-R533 PolarHBondContact O-N 2.99Å; D529-R533 IonicContact OD1-NE 3.43Å; D529-R533 PolarHBondContact OD1-NE 3.5Å; D529-R533 IonicContact OD2-CZ 2.67Å; D529-R533 IonicContact OD2-NE 2.85Å; D529-R533 PolarHBondContact OD2-NE 2.93Å; D529-R533 IonicContact OD2-NH2 3.16Å; D529-R533 PolarHBondContact OD2-NH2 3.39Å
530	S	83.4	Confident	87.8	Confident	31 Å²	31	39.8 Å²	39.8	22%	0.217	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-38.3	172.7	55.3	0	0	0	0	112.3	V528 I534	V528-S530 VanDerWaalsContact C-N 3.32Å; V528-S530 WeakPolarHBondContact CG1-OG 3.18Å; V528-S530 PolarHBondContact O-N 3.25Å; S530-I534 WeakPolarHBondContact O-CG1 3.45Å; S530-I534 PolarHBondContact O-N 3.1Å; S530-I534 VanDerWaalsContact O-N 3.15Å
531	V	88.5	Confident	87.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.8	-46	176.2	-173.6	0	0	0	0	110.4	F341 L442 F525 L526 V528 D529 R533 I534 I535	F341-V531 HydrophobicContact CE1-CG2 3.78Å; F341-V531 HydrophobicContact CZ-CG2 3.92Å; L442-V531 HydrophobicContact CD2-CG1 3.75Å; L442-V531 HydrophobicContact CG-CG1 4.19Å; F525-V531 HydrophobicContact CD1-CG1 4.01Å; F525-V531 HydrophobicContact CD1-CG2 4.1Å; F525-V531 HydrophobicContact CE1-CG1 3.79Å; F525-V531 HydrophobicContact CE1-CG2 3.83Å; F525-V531 HydrophobicContact CZ-CG2 4.38Å; L526-V531 HydrophobicContact CD2-CG1 4.05Å; V528-V531 HydrophobicContact CB-CG2 4.13Å; V528-V531 WeakPolarHBondContact O-CA 2.88Å; V528-V531 WeakPolarHBondContact O-CB 3.43Å; V528-V531 PolarHBondContact O-N 3.38Å; D529-V531 VanDerWaalsContact C-N 3.28Å; D529-V531 PolarHBondContact O-N 3.33Å; V531-R533 VanDerWaalsContact C-N 3.34Å; V531-R533 PolarHBondContact O-N 2.97Å; V531-I534 PolarHBondContact O-N 2.94Å; V531-I535 HydrophobicContact CG1-CD1 4.18Å; V531-I535 WeakPolarHBondContact O-CG1 3.48Å; V531-I535 PolarHBondContact O-N 3.26Å
532	K	87.9	Confident	87.3	Confident	13 Å²	13	41.5 Å²	41.5	6%	0.057	20%	0.202	C	C	.	.	H	α-helix	trans	-57.3	-44.5	174.8	-66.1	175.8	-178.2	163.5	0	112.1	C321 A322 S527 V528 D529 I534 I535 K536	C321-K532 PolarHBondContact O-NZ 3.38Å; A322-K532 VanDerWaalsContact C-NZ 3.28Å; A322-K532 PolarHBondContact O-NZ 2.69Å; S527-K532 WeakPolarHBondContact O-CE 3.41Å; S527-K532 PolarHBondContact O-NZ 3.01Å; V528-K532 PolarHBondContact O-N 3.19Å; V528-K532 VanDerWaalsContact O-N 3.07Å; D529-K532 PolarHBondContact O-N 3.31Å; K532-I534 VanDerWaalsContact C-N 3.33Å; K532-I534 PolarHBondContact O-N 2.72Å; K532-I535 PolarHBondContact O-N 2.95Å; K532-K536 WeakPolarHBondContact O-CB 3.16Å; K532-K536 PolarHBondContact O-N 3.46Å
533	R	85	Confident	87	Confident	150 Å²	150	41.7 Å²	41.7	57%	0.566	20%	0.203	S	C	*	.	H	α-helix	trans	-63.7	-34.1	177.2	-78.5	-170.3	-88.5	139.6	-8.8	113.1	D529 V531 R537	D529-R533 WeakPolarHBondContact O-CB 3.25Å; D529-R533 WeakPolarHBondContact O-CG 3.49Å; D529-R533 PolarHBondContact O-N 2.99Å; D529-R533 IonicContact OD1-NE 3.43Å; D529-R533 PolarHBondContact OD1-NE 3.5Å; D529-R533 IonicContact OD2-CZ 2.67Å; D529-R533 IonicContact OD2-NE 2.85Å; D529-R533 PolarHBondContact OD2-NE 2.93Å; D529-R533 IonicContact OD2-NH2 3.16Å; D529-R533 PolarHBondContact OD2-NH2 3.39Å; V531-R533 VanDerWaalsContact C-N 3.34Å; V531-R533 PolarHBondContact O-N 2.97Å; R533-R537 PolarHBondContact O-N 3.11Å
534	I	85.3	Confident	86.4	Confident	46 Å²	46	44.4 Å²	44.4	24%	0.236	22%	0.216	C	C	.	.	H	α-helix	trans	-72.8	-44.5	176.6	-73.4	168.6	0	0	0	111.1	R342 L442 S530 V531 K532 K536 R537 Q538	R342-I534 VanDerWaalsContact NH1-CD1 3.31Å; L442-I534 HydrophobicContact CD1-CG2 4.08Å; S530-I534 WeakPolarHBondContact O-CG1 3.45Å; S530-I534 PolarHBondContact O-N 3.1Å; S530-I534 VanDerWaalsContact O-N 3.15Å; V531-I534 PolarHBondContact O-N 2.94Å; K532-I534 VanDerWaalsContact C-N 3.33Å; K532-I534 PolarHBondContact O-N 2.72Å; I534-K536 VanDerWaalsContact C-N 3.31Å; I534-K536 PolarHBondContact O-N 3.1Å; I534-R537 WeakPolarHBondContact O-CB 2.99Å; I534-R537 PolarHBondContact O-N 3.47Å; I534-Q538 PolarHBondContact O-N 2.9Å
535	I	87.4	Confident	85.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-57.7	-46.3	173.6	-63.6	166.7	0	0	0	110.3	L439 L442 L526 V531 K532 R537 Q538 L539 I543	L439-I535 HydrophobicContact CD1-CD1 4.06Å; L442-I535 HydrophobicContact CD2-CD1 3.7Å; L442-I535 HydrophobicContact CD2-CG1 3.33Å; L526-I535 HydrophobicContact CD2-CD1 4.09Å; V531-I535 HydrophobicContact CG1-CD1 4.18Å; V531-I535 WeakPolarHBondContact O-CG1 3.48Å; V531-I535 PolarHBondContact O-N 3.26Å; K532-I535 PolarHBondContact O-N 2.95Å; I535-R537 VanDerWaalsContact C-N 3.27Å; I535-R537 PolarHBondContact O-N 3.38Å; I535-Q538 PolarHBondContact O-N 3.36Å; I535-L539 HydrophobicContact CG2-CD1 3.91Å; I535-L539 HydrophobicContact CG2-CG 4.48Å; I535-L539 PolarHBondContact O-N 2.96Å; I535-I543 HydrophobicContact CD1-CD1 3.83Å; I535-I543 HydrophobicContact CG2-CD1 4.17Å; I535-I543 HydrophobicContact CG2-CG1 4.15Å
536	K	87.7	Confident	85.4	Confident	97 Å²	97	44.8 Å²	44.8	42%	0.422	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-32.7	176.2	-171.8	177.3	-174.8	169.2	0	113.3	K532 I534 G540 Y541 E542	K532-K536 WeakPolarHBondContact O-CB 3.16Å; K532-K536 PolarHBondContact O-N 3.46Å; I534-K536 VanDerWaalsContact C-N 3.31Å; I534-K536 PolarHBondContact O-N 3.1Å; K536-G540 VanDerWaalsContact O-CA 3.25Å; K536-G540 WeakPolarHBondContact O-CA 3.22Å; K536-G540 PolarHBondContact O-N 2.93Å; K536-G540 VanDerWaalsContact O-N 3.1Å; K536-Y541 WeakPolarHBondContact CA-O 3.35Å; K536-E542 HydrophobicContact CB-CB 4.47Å; K536-E542 HydrophobicContact CD-CB 3.99Å; K536-E542 HydrophobicContact CD-CG 4.11Å; K536-E542 WeakPolarHBondContact CD-OE2 3.32Å; K536-E542 VanDerWaalsContact CE-OE2 3.29Å; K536-E542 WeakPolarHBondContact CE-OE2 3.2Å; K536-E542 HydrophobicContact CG-CB 4.18Å; K536-E542 IonicContact NZ-OE2 3.47Å; K536-E542 PolarHBondContact NZ-OE2 2.9Å
537	R	84.5	Confident	85.1	Confident	201 Å²	201	45.2 Å²	45.2	76%	0.758	22%	0.224	S	C	*	.	H	α-helix	trans	-72.8	-43.2	174.9	-172	-174.8	-68.2	-178.7	-1.4	112	R533 I534 I535	R533-R537 PolarHBondContact O-N 3.11Å; I534-R537 WeakPolarHBondContact O-CB 2.99Å; I534-R537 PolarHBondContact O-N 3.47Å; I535-R537 VanDerWaalsContact C-N 3.27Å; I535-R537 PolarHBondContact O-N 3.38Å
538	Q	84.8	Confident	84.9	Confident	89 Å²	89	47.2 Å²	47.2	42%	0.416	24%	0.236	S	C	.	.	H	α-helix	trans	-82.6	-28.3	-173.4	-67.9	-178.6	-67.4	0	0	114.2	R434 V438 I534 I535	R434-Q538 PolarHBondContact NE-O 2.76Å; R434-Q538 PolarHBondContact NH2-O 3.47Å; V438-Q538 HydrophobicContact CG1-CB 3.91Å; V438-Q538 HydrophobicContact CG2-CB 4.45Å; I534-Q538 PolarHBondContact O-N 2.9Å; I535-Q538 PolarHBondContact O-N 3.36Å
539	L	85.6	Confident	84.5	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-110.6	-11.4	-179.3	-56.7	-177.7	0	0	0	114	R434 F435 V438 I535 Y541	R434-L539 HydrophobicContact CG-CD2 3.71Å; F435-L539 HydrophobicContact CB-CD1 4.26Å; F435-L539 HydrophobicContact CD2-CD1 3.64Å; F435-L539 HydrophobicContact CE2-CD1 4.48Å; F435-L539 HydrophobicContact CG-CD1 4.35Å; V438-L539 HydrophobicContact CB-CD2 3.98Å; V438-L539 HydrophobicContact CB-CG 4.44Å; V438-L539 HydrophobicContact CG1-CD1 4.46Å; V438-L539 HydrophobicContact CG1-CD2 4.22Å; V438-L539 HydrophobicContact CG1-CG 4.18Å; V438-L539 HydrophobicContact CG2-CD2 3.81Å; I535-L539 HydrophobicContact CG2-CD1 3.91Å; I535-L539 HydrophobicContact CG2-CG 4.48Å; I535-L539 PolarHBondContact O-N 2.96Å; L539-Y541 HydrophobicContact CB-CD1 4.42Å; L539-Y541 HydrophobicContact CB-CD2 4.34Å; L539-Y541 HydrophobicContact CB-CE1 4.01Å; L539-Y541 HydrophobicContact CB-CE2 3.94Å; L539-Y541 HydrophobicContact CD1-CE2 3.9Å; L539-Y541 VanDerWaalsContact O-CD1 3.23Å; L539-Y541 WeakPolarHBondContact O-CD1 3.45Å; L539-Y541 WeakPolarHBondContact O-CE1 3.42Å; L539-Y541 PolarHBondContact O-N 3.39Å; L539-Y541 VanDerWaalsContact O-N 3.15Å
540	G	83.3	Confident	83.7	Confident	66 Å²	66	53.1 Å²	53.1	68%	0.68	26%	0.263	S	S	*	.	S	Bend	trans	76.6	-11.9	-179.5	0	0	0	0	0	115.6	K536	K536-G540 VanDerWaalsContact O-CA 3.25Å; K536-G540 WeakPolarHBondContact O-CA 3.22Å; K536-G540 PolarHBondContact O-N 2.93Å; K536-G540 VanDerWaalsContact O-N 3.1Å
541	Y	86.1	Confident	82.2	Confident	24 Å²	24	53 Å²	53	9%	0.094	27%	0.267	C	S	.	.	S	Bend	trans	-122.9	159.3	174.2	54	-103.8	0	0	0	112	V421 V423 F428 D431 F435 K536 L539	V421-Y541 HydrophobicContact CG1-CD2 3.3Å; V421-Y541 HydrophobicContact CG1-CE2 3.57Å; V421-Y541 HydrophobicContact CG1-CG 4.39Å; V423-Y541 HydrophobicContact CB-CD1 4.03Å; V423-Y541 HydrophobicContact CB-CD2 4.32Å; V423-Y541 HydrophobicContact CB-CG 3.84Å; V423-Y541 HydrophobicContact CG1-CD1 4.24Å; V423-Y541 HydrophobicContact CG1-CD2 3.91Å; V423-Y541 HydrophobicContact CG1-CE2 4.17Å; V423-Y541 HydrophobicContact CG1-CG 3.94Å; V423-Y541 HydrophobicContact CG2-CD1 3.98Å; V423-Y541 HydrophobicContact CG2-CE1 4.42Å; V423-Y541 HydrophobicContact CG2-CG 4.32Å; F428-Y541 HydrophobicContact CD2-CE2 4.38Å; F428-Y541 HydrophobicContact CE2-CE2 4.47Å; D431-Y541 HydrophobicContact CB-CE1 4.34Å; D431-Y541 VanDerWaalsContact OD2-CE1 3.24Å; D431-Y541 WeakPolarHBondContact OD2-CE1 3.45Å; D431-Y541 VanDerWaalsContact OD2-CZ 3.29Å; D431-Y541 PolarHBondContact OD2-OH 3.12Å; F435-Y541 HydrophobicContact CD2-CE2 4.18Å; K536-Y541 WeakPolarHBondContact CA-O 3.35Å; L539-Y541 HydrophobicContact CB-CD1 4.42Å; L539-Y541 HydrophobicContact CB-CD2 4.34Å; L539-Y541 HydrophobicContact CB-CE1 4.01Å; L539-Y541 HydrophobicContact CB-CE2 3.94Å; L539-Y541 HydrophobicContact CD1-CE2 3.9Å; L539-Y541 VanDerWaalsContact O-CD1 3.23Å; L539-Y541 WeakPolarHBondContact O-CD1 3.45Å; L539-Y541 WeakPolarHBondContact O-CE1 3.42Å; L539-Y541 PolarHBondContact O-N 3.39Å; L539-Y541 VanDerWaalsContact O-N 3.15Å
542	E	83.6	Confident	79.8	Confident	67 Å²	67	60.8 Å²	60.8	31%	0.313	31%	0.308	S	S	.	.			trans	-109.2	144	-167.4	-173.9	172.6	175.9	0	0	112.7	V421 A422 K536 Q544	V421-E542 WeakPolarHBondContact CA-O 3.4Å; A422-E542 HydrophobicContact CB-CB 4.34Å; A422-E542 WeakPolarHBondContact CB-O 3.28Å; A422-E542 PolarHBondContact N-O 2.69Å; K536-E542 HydrophobicContact CB-CB 4.47Å; K536-E542 HydrophobicContact CD-CB 3.99Å; K536-E542 HydrophobicContact CD-CG 4.11Å; K536-E542 WeakPolarHBondContact CD-OE2 3.32Å; K536-E542 VanDerWaalsContact CE-OE2 3.29Å; K536-E542 WeakPolarHBondContact CE-OE2 3.2Å; K536-E542 HydrophobicContact CG-CB 4.18Å; K536-E542 IonicContact NZ-OE2 3.47Å; K536-E542 PolarHBondContact NZ-OE2 2.9Å; E542-Q544 PolarHBondContact O-N 3.18Å
543	I	85.9	Confident	77.3	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.015	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108.7	167.8	-57.2	-174.3	0	0	0	108.4	A419 I420 V421 F435 I535 V546	A419-I543 HydrophobicContact CB-CG2 4.25Å; I420-I543 CarbonylContact O-C 3.56Å; V421-I543 HydrophobicContact CG1-CG1 4.42Å; V421-I543 HydrophobicContact CG2-CG1 4.49Å; F435-I543 HydrophobicContact CE2-CD1 4.4Å; I535-I543 HydrophobicContact CD1-CD1 3.83Å; I535-I543 HydrophobicContact CG2-CD1 4.17Å; I535-I543 HydrophobicContact CG2-CG1 4.15Å; I543-V546 HydrophobicContact CG2-CG2 3.43Å; I543-V546 VanDerWaalsContact CG2-CG2 3.43Å
544	Q	78.2	Confident	74.5	Confident	59 Å²	59	66 Å²	66	28%	0.276	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	-38.2	-176.3	-63.4	176.6	-20.3	0	0	112.1	I420 A422 E542	I420-Q544 PolarHBondContact O-N 2.93Å; A422-Q544 HydrophobicContact CB-CG 4.01Å; E542-Q544 PolarHBondContact O-N 3.18Å
545	S	78.2	Confident	71.7	Confident	12 Å²	12	66.8 Å²	66.8	8%	0.084	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	153.3	-179.2	62.4	0	0	0	0	111.6	A419 I420 F490	A419-S545 WeakPolarHBondContact CA-O 3.2Å; I420-S545 WeakPolarHBondContact CD1-OG 3.21Å; I420-S545 PolarHBondContact N-O 3.29Å; F490-S545 WeakPolarHBondContact CD1-OG 3.28Å; F490-S545 VanDerWaalsContact CE1-OG 3.27Å; F490-S545 WeakPolarHBondContact CE1-OG 3.24Å
546	V	86.2	Confident	68.9	Low	13 Å²	13	70.8 Å²	70.8	8%	0.079	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.2	178.2	-166.8	0	0	0	0	109	L325 I417 V418 A419 T523 L526 I543	L325-V546 WeakPolarHBondContact CD1-O 3.42Å; I417-V546 HydrophobicContact CG2-CG1 3.55Å; V418-V546 CarbonylContact O-C 3.54Å; V418-V546 WeakPolarHBondContact O-CA 3.34Å; A419-V546 HydrophobicContact CB-CG2 4.43Å; T523-V546 HydrophobicContact CG2-CG1 3.53Å; L526-V546 HydrophobicContact CB-CG1 4.49Å; L526-V546 HydrophobicContact CB-CG2 4.17Å; L526-V546 HydrophobicContact CD1-CG1 4.34Å; I543-V546 HydrophobicContact CG2-CG2 3.43Å; I543-V546 VanDerWaalsContact CG2-CG2 3.43Å
547	G	84.1	Confident	66.4	Low	13 Å²	13	75.9 Å²	75.9	13%	0.134	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	174.5	170.4	0	0	0	0	0	112	V418	V418-G547 PolarHBondContact N-O 3.15Å; V418-G547 PolarHBondContact O-N 3.15Å
548	T	84.8	Confident	64.1	Low	42 Å²	42	69.7 Å²	69.7	26%	0.258	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	134.4	-178.9	43.1	0	0	0	0	114.3	R416 T523 H550	R416-T548 CarbonylContact O-C 3.5Å; R416-T548 VanDerWaalsContact O-CA 3.28Å; R416-T548 WeakPolarHBondContact O-CA 3.46Å; T523-T548 HydrophobicContact CG2-CG2 3.65Å; T548-H550 PolarHBondContact OG1-NE2 3.48Å
549	D	81	Confident	62	Low	49 Å²	49	70.3 Å²	70.3	26%	0.262	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	109	160.9	178	31.2	0	0	0	109.9	R416 V418 G551	R416-D549 HydrophobicContact CB-CB 4.36Å; R416-D549 PolarHBondContact N-O 3.21Å; R416-D549 PolarHBondContact O-N 3.47Å; V418-D549 HydrophobicContact CG2-CB 4.12Å; D549-G551 PolarHBondContact O-N 3.03Å
550	H	65.5	Low	60	Low	122 Å²	122	75.5 Å²	75.5	57%	0.565	48%	0.481	S	S	*	.			trans	-79.8	73.9	167.6	-64.1	-72.3	0	0	0	109.3	T548 N552	T548-H550 PolarHBondContact OG1-NE2 3.48Å; H550-N552 PolarHBondContact O-N 2.83Å
551	G	52.3	Low	58.2	Low	28 Å²	28	78.9 Å²	78.9	29%	0.289	48%	0.483	S	S	.	.			trans	-47	121.2	-178	0	0	0	0	0	112.1	D549 E553	D549-G551 PolarHBondContact O-N 3.03Å; G551-E553 PolarHBondContact O-N 3.26Å
552	N	38.4	Very low	56.5	Low	163 Å²	163	83.4 Å²	83.4	87%	0.872	51%	0.508	S	S	*	.			trans	-74.7	90.9	-163.7	-164.8	-11.9	0	0	0	112.3	H550 G554	H550-N552 PolarHBondContact O-N 2.83Å; N552-G554 PolarHBondContact O-N 3.23Å
553	E	35	Very low	55.1	Low	183 Å²	183	83.7 Å²	83.7	86%	0.855	51%	0.514	S	S	*	.			trans	-67.9	98	179.1	-69	-159.2	149	0	0	112.4	G551 G555	G551-E553 PolarHBondContact O-N 3.26Å; E553-G555 PolarHBondContact O-N 2.77Å
554	G	26.7	Very low	53.9	Low	90 Å²	90	87.3 Å²	87.3	93%	0.928	53%	0.533	S	S	*	.			trans	-72	67.7	170.2	0	0	0	0	0	113.1	N552	N552-G554 PolarHBondContact O-N 3.23Å
555	G	27.6	Very low	53	Low	63 Å²	63	87.4 Å²	87.4	65%	0.649	54%	0.538	S	S	*	.			trans	-125.3	114.3	176.7	0	0	0	0	0	111.9	E553 K557	E553-G555 PolarHBondContact O-N 2.77Å; G555-K557 PolarHBondContact O-N 3.15Å
556	G	27.2	Very low	52.5	Low	86 Å²	86	90.6 Å²	90.6	89%	0.887	56%	0.556	S	S	*	*			trans	-75.8	114.3	-168.9	0	0	0	0	0	115.3
557	K	36.5	Very low	51.5	Low	205 Å²	205	95.4 Å²	95.4	89%	0.891	58%	0.581	S	S	*	*			trans	-112.6	76.6	154.8	-75.2	-175.9	179.9	173.3	0	110.2	G555 T559	G555-K557 PolarHBondContact O-N 3.15Å; K557-T559 PolarHBondContact O-N 3.1Å
558	G	34.3	Very low	50.7	Low	70 Å²	70	101 Å²	101	72%	0.722	60%	0.602	S	S	*	*			trans	-78	103.2	179.5	0	0	0	0	0	112.7
559	T	42.1	Very low	50.1	Low	102 Å²	102	103.9 Å²	103.9	63%	0.626	61%	0.614	S	S	*	*	S	Bend	trans	-152.5	-50.8	164.2	33.8	0	0	0	0	111.3	K557 L561 L562 T563	K557-T559 PolarHBondContact O-N 3.1Å; T559-L561 PolarHBondContact O-N 3.3Å; T559-L562 WeakPolarHBondContact O-CB 3.37Å; T559-L562 PolarHBondContact O-N 3.44Å; T559-L562 VanDerWaalsContact O-N 3.09Å; T559-T563 PolarHBondContact O-N 2.81Å
560	M	42.3	Very low	49.5	Very low	126 Å²	126	104.6 Å²	104.6	62%	0.621	62%	0.623	S	S	*	*	H	α-helix	trans	-64.8	-34.1	-174.6	-100.2	-72.5	-89.8	0	0	114.8	L562 T563 I564	M560-L562 VanDerWaalsContact C-N 3.25Å; M560-L562 PolarHBondContact O-N 3.36Å; M560-T563 WeakPolarHBondContact CA-OG1 3.38Å; M560-T563 PolarHBondContact O-N 2.85Å; M560-T563 PolarHBondContact O-OG1 2.73Å; M560-I564 HydrophobicContact CE-CD1 3.78Å; M560-I564 HydrophobicContact CE-CG1 4.48Å; M560-I564 WeakPolarHBondContact O-CB 3.23Å; M560-I564 WeakPolarHBondContact O-CG1 3.39Å; M560-I564 PolarHBondContact O-N 3.18Å; M560-I564 HydrophobicContact SD-CD1 4.31Å; M560-I564 HydrophobicContact SD-CG1 4.47Å
561	L	46.1	Very low	49.6	Very low	137 Å²	137	102 Å²	102	72%	0.717	62%	0.616	S	S	*	*	H	α-helix	trans	-70.3	-25.8	176.1	-152.2	74.7	0	0	0	111.9	T559 T565	T559-L561 PolarHBondContact O-N 3.3Å; L561-T565 VanDerWaalsContact O-CB 3.29Å; L561-T565 WeakPolarHBondContact O-CB 3.4Å; L561-T565 VanDerWaalsContact O-CG2 3.25Å; L561-T565 WeakPolarHBondContact O-CG2 3.29Å; L561-T565 PolarHBondContact O-N 3.32Å; L561-T565 PolarHBondContact O-OG1 3.13Å
562	L	51.1	Low	50.1	Low	118 Å²	118	105.8 Å²	105.8	62%	0.618	63%	0.627	S	S	*	*	H	α-helix	trans	-74.1	-41.2	173.1	-98.4	163.2	0	0	0	111.8	T559 M560 T565 V566	T559-L562 WeakPolarHBondContact O-CB 3.37Å; T559-L562 PolarHBondContact O-N 3.44Å; T559-L562 VanDerWaalsContact O-N 3.09Å; M560-L562 VanDerWaalsContact C-N 3.25Å; M560-L562 PolarHBondContact O-N 3.36Å; L562-T565 WeakPolarHBondContact CA-OG1 3.33Å; L562-T565 PolarHBondContact O-OG1 3.45Å; L562-V566 VanDerWaalsContact O-CB 3.3Å; L562-V566 WeakPolarHBondContact O-CB 3.24Å; L562-V566 VanDerWaalsContact O-CG2 3.23Å; L562-V566 WeakPolarHBondContact O-CG2 3.41Å; L562-V566 PolarHBondContact O-N 2.74Å
563	T	54.5	Low	51.5	Low	74 Å²	74	101.6 Å²	101.6	45%	0.454	61%	0.61	S	S	.	*	H	α-helix	trans	-68.5	-41.3	175.7	49.9	0	0	0	0	112	T559 M560 L567	T559-T563 PolarHBondContact O-N 2.81Å; M560-T563 WeakPolarHBondContact CA-OG1 3.38Å; M560-T563 PolarHBondContact O-N 2.85Å; M560-T563 PolarHBondContact O-OG1 2.73Å; T563-L567 WeakPolarHBondContact O-CB 3.41Å; T563-L567 WeakPolarHBondContact O-CG 3.23Å; T563-L567 PolarHBondContact O-N 2.94Å
564	I	59.5	Low	52.9	Low	78 Å²	78	98.1 Å²	98.1	40%	0.4	60%	0.596	S	S	.	*	H	α-helix	trans	-68.1	-41.7	176.8	-66.9	171.5	0	0	0	111.1	M560 L567 F568	M560-I564 HydrophobicContact CE-CD1 3.78Å; M560-I564 HydrophobicContact CE-CG1 4.48Å; M560-I564 WeakPolarHBondContact O-CB 3.23Å; M560-I564 WeakPolarHBondContact O-CG1 3.39Å; M560-I564 PolarHBondContact O-N 3.18Å; M560-I564 HydrophobicContact SD-CD1 4.31Å; M560-I564 HydrophobicContact SD-CG1 4.47Å; I564-L567 PolarHBondContact O-N 3.09Å; I564-F568 HydrophobicContact CG2-CD2 4.26Å; I564-F568 WeakPolarHBondContact O-CB 3.17Å; I564-F568 PolarHBondContact O-N 3.36Å
565	T	59.6	Low	54.4	Low	62 Å²	62	97.6 Å²	97.6	38%	0.38	58%	0.575	S	S	.	*	H	α-helix	trans	-69.1	-38.1	175.4	50.6	0	0	0	0	112.6	L561 L562 F568 I569	L561-T565 VanDerWaalsContact O-CB 3.29Å; L561-T565 WeakPolarHBondContact O-CB 3.4Å; L561-T565 VanDerWaalsContact O-CG2 3.25Å; L561-T565 WeakPolarHBondContact O-CG2 3.29Å; L561-T565 PolarHBondContact O-N 3.32Å; L561-T565 PolarHBondContact O-OG1 3.13Å; L562-T565 WeakPolarHBondContact CA-OG1 3.33Å; L562-T565 PolarHBondContact O-OG1 3.45Å; T565-F568 PolarHBondContact O-N 3.48Å; T565-I569 VanDerWaalsContact O-CB 3.26Å; T565-I569 WeakPolarHBondContact O-CB 3.01Å; T565-I569 WeakPolarHBondContact O-CD1 3.02Å; T565-I569 WeakPolarHBondContact O-CG1 3.32Å; T565-I569 PolarHBondContact O-N 3.47Å
566	V	68	Low	55.9	Low	78 Å²	78	101.7 Å²	101.7	47%	0.473	58%	0.576	S	S	.	*	H	α-helix	trans	-62.6	-42.7	173.2	167.9	0	0	0	0	111.1	L562 I569 C570	L562-V566 VanDerWaalsContact O-CB 3.3Å; L562-V566 WeakPolarHBondContact O-CB 3.24Å; L562-V566 VanDerWaalsContact O-CG2 3.23Å; L562-V566 WeakPolarHBondContact O-CG2 3.41Å; L562-V566 PolarHBondContact O-N 2.74Å; V566-I569 PolarHBondContact O-N 2.84Å; V566-C570 WeakPolarHBondContact O-CB 3.38Å; V566-C570 PolarHBondContact O-N 3.17Å; V566-C570 PolarHBondContact O-SG 3.07Å
567	L	64.8	Low	57.1	Low	114 Å²	114	102.4 Å²	102.4	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-66.7	-41	175.9	-75.6	167.8	0	0	0	112.7	T563 I564 I569 C570 T571	T563-L567 WeakPolarHBondContact O-CB 3.41Å; T563-L567 WeakPolarHBondContact O-CG 3.23Å; T563-L567 PolarHBondContact O-N 2.94Å; I564-L567 PolarHBondContact O-N 3.09Å; L567-I569 VanDerWaalsContact C-N 3.35Å; L567-C570 PolarHBondContact O-N 2.97Å; L567-T571 PolarHBondContact O-N 3.49Å; L567-T571 PolarHBondContact O-OG1 2.92Å
568	F	67.1	Low	57.9	Low	131 Å²	131	98 Å²	98	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-66.6	-34.4	172.9	-107.9	-89.7	0	0	0	112.6	I564 T565 T571 M572	I564-F568 HydrophobicContact CG2-CD2 4.26Å; I564-F568 WeakPolarHBondContact O-CB 3.17Å; I564-F568 PolarHBondContact O-N 3.36Å; T565-F568 PolarHBondContact O-N 3.48Å; F568-T571 WeakPolarHBondContact CA-OG1 3.36Å; F568-T571 PolarHBondContact O-OG1 3.41Å; F568-M572 WeakPolarHBondContact O-CB 3.33Å; F568-M572 WeakPolarHBondContact O-CG 3.46Å; F568-M572 PolarHBondContact O-N 3.4Å
569	I	71.7	Confident	58.6	Low	102 Å²	102	101.8 Å²	101.8	52%	0.523	55%	0.554	S	S	.	*	H	α-helix	trans	-67.9	-40.8	173.4	-72.6	163.4	0	0	0	109.7	T565 V566 L567 C573	T565-I569 VanDerWaalsContact O-CB 3.26Å; T565-I569 WeakPolarHBondContact O-CB 3.01Å; T565-I569 WeakPolarHBondContact O-CD1 3.02Å; T565-I569 WeakPolarHBondContact O-CG1 3.32Å; T565-I569 PolarHBondContact O-N 3.47Å; V566-I569 PolarHBondContact O-N 2.84Å; L567-I569 VanDerWaalsContact C-N 3.35Å; I569-C573 VanDerWaalsContact O-CB 3.28Å; I569-C573 WeakPolarHBondContact O-CB 3.5Å; I569-C573 PolarHBondContact O-N 3.01Å; I569-C573 PolarHBondContact O-SG 3.39Å
570	C	69.3	Low	58.4	Low	64 Å²	64	102.6 Å²	102.6	43%	0.432	55%	0.554	S	S	.	*	H	α-helix	trans	-62.1	-47.9	173.2	-72.2	0	0	0	0	112.4	V566 L567 C573 I574	V566-C570 WeakPolarHBondContact O-CB 3.38Å; V566-C570 PolarHBondContact O-N 3.17Å; V566-C570 PolarHBondContact O-SG 3.07Å; L567-C570 PolarHBondContact O-N 2.97Å; C570-C573 PolarHBondContact O-N 2.9Å; C570-I574 WeakPolarHBondContact O-CD1 3.25Å; C570-I574 VanDerWaalsContact O-CG1 3.25Å; C570-I574 WeakPolarHBondContact O-CG1 3.44Å; C570-I574 PolarHBondContact O-N 2.04Å
571	T	67.6	Low	58.3	Low	69 Å²	69	103.1 Å²	103.1	42%	0.423	56%	0.564	S	S	.	*	H	α-helix	trans	-67.3	-40.6	178	56.4	0	0	0	0	111.9	L567 F568 I574 T575	L567-T571 PolarHBondContact O-N 3.49Å; L567-T571 PolarHBondContact O-OG1 2.92Å; F568-T571 WeakPolarHBondContact CA-OG1 3.36Å; F568-T571 PolarHBondContact O-OG1 3.41Å; T571-I574 PolarHBondContact O-N 3.46Å; T571-T575 PolarHBondContact O-N 3.07Å; T571-T575 PolarHBondContact O-OG1 2.86Å; T571-T575 VanDerWaalsContact O-OG1 3.08Å
572	M	63.8	Low	58	Low	106 Å²	106	101.3 Å²	101.3	52%	0.522	56%	0.56	S	S	.	*	H	α-helix	trans	-60.3	-45.1	172.9	-72.5	-78.3	97.1	0	0	111.7	F568 I574 T575 H576	F568-M572 WeakPolarHBondContact O-CB 3.33Å; F568-M572 WeakPolarHBondContact O-CG 3.46Å; F568-M572 PolarHBondContact O-N 3.4Å; M572-I574 VanDerWaalsContact C-N 3.34Å; M572-I574 PolarHBondContact O-N 2.88Å; M572-T575 WeakPolarHBondContact CA-OG1 3.39Å; M572-T575 PolarHBondContact O-N 2.97Å; M572-T575 PolarHBondContact O-OG1 2.87Å; M572-T575 VanDerWaalsContact O-OG1 3.12Å; M572-H576 WeakPolarHBondContact O-CB 3.04Å; M572-H576 PolarHBondContact O-N 3.3Å
573	C	67.5	Low	57.4	Low	75 Å²	75	101.2 Å²	101.2	51%	0.507	57%	0.565	S	S	.	*	H	α-helix	trans	-60	-42.9	174.5	-76	0	0	0	0	112	I569 C570 H576 C577	I569-C573 VanDerWaalsContact O-CB 3.28Å; I569-C573 WeakPolarHBondContact O-CB 3.5Å; I569-C573 PolarHBondContact O-N 3.01Å; I569-C573 PolarHBondContact O-SG 3.39Å; C570-C573 PolarHBondContact O-N 2.9Å; C573-H576 PolarHBondContact O-N 2.92Å; C573-C577 PolarHBondContact O-N 2.91Å; C573-C577 VanDerWaalsContact O-N 3.15Å; C573-C577 PolarHBondContact O-SG 3.48Å; C573-C577 VanDerWaalsContact O-SG 3.35Å
574	I	64.5	Low	56.4	Low	110 Å²	110	103.5 Å²	103.5	56%	0.564	57%	0.574	S	S	*	*	H	α-helix	trans	-63.6	-47	177.5	-69	163.7	0	0	0	111	C570 T571 M572	C570-I574 WeakPolarHBondContact O-CD1 3.25Å; C570-I574 VanDerWaalsContact O-CG1 3.25Å; C570-I574 WeakPolarHBondContact O-CG1 3.44Å; C570-I574 PolarHBondContact O-N 2.04Å; T571-I574 PolarHBondContact O-N 3.46Å; M572-I574 VanDerWaalsContact C-N 3.34Å; M572-I574 PolarHBondContact O-N 2.88Å
575	T	57.7	Low	55.1	Low	79 Å²	79	109 Å²	109	49%	0.485	59%	0.59	S	S	.	*	H	α-helix	trans	-70.7	-32.9	178.5	53.6	0	0	0	0	113.1	T571 M572 C577 I578	T571-T575 PolarHBondContact O-N 3.07Å; T571-T575 PolarHBondContact O-OG1 2.86Å; T571-T575 VanDerWaalsContact O-OG1 3.08Å; M572-T575 WeakPolarHBondContact CA-OG1 3.39Å; M572-T575 PolarHBondContact O-N 2.97Å; M572-T575 PolarHBondContact O-OG1 2.87Å; M572-T575 VanDerWaalsContact O-OG1 3.12Å; T575-C577 VanDerWaalsContact C-N 3.35Å; T575-I578 PolarHBondContact O-N 3.22Å
576	H	57.8	Low	53.8	Low	149 Å²	149	115.7 Å²	115.7	69%	0.69	61%	0.608	S	S	*	*	H	α-helix	trans	-81.2	-17	-175.6	-150	4.9	0	0	0	112.8	M572 C573	M572-H576 WeakPolarHBondContact O-CB 3.04Å; M572-H576 PolarHBondContact O-N 3.3Å; C573-H576 PolarHBondContact O-N 2.92Å
577	C	54.2	Low	51.9	Low	102 Å²	102	117.3 Å²	117.3	69%	0.689	62%	0.618	S	S	*	*	H	α-helix	trans	-76.5	-23.9	166.5	-74.3	0	0	0	0	113.6	C573 T575	C573-C577 PolarHBondContact O-N 2.91Å; C573-C577 VanDerWaalsContact O-N 3.15Å; C573-C577 PolarHBondContact O-SG 3.48Å; C573-C577 VanDerWaalsContact O-SG 3.35Å; T575-C577 VanDerWaalsContact C-N 3.35Å
578	I	53.1	Low	50.1	Low	113 Å²	113	122.2 Å²	122.2	58%	0.579	63%	0.629	S	S	*	*	S	Bend	trans	-101	94.2	-178.1	-57.7	175.1	0	0	0	109	T575	T575-I578 PolarHBondContact O-N 3.22Å
579	I	47.5	Very low	48.2	Very low	148 Å²	148	123.1 Å²	123.1	76%	0.759	64%	0.638	S	S	*	*			trans	63.7	80.2	166.3	-49.4	168.1	0	0	0	111
580	L	39.7	Very low	46.1	Very low	119 Å²	119	122.3 Å²	122.3	62%	0.623	65%	0.647	S	S	*	*			cis	46.7	134.3	49.8	-82.4	175.1	0	0	0	113.6
581	V	40	Very low	44.2	Very low	138 Å²	138	129.3 Å²	129.3	84%	0.836	66%	0.664	S	S	*	*			trans	84.1	125.7	-175.8	-170.5	0	0	0	0	114.1
582	P	38.6	Very low	42.2	Very low	98 Å²	98	134.8 Å²	134.8	64%	0.636	68%	0.677	S	S	*	*			trans	-139.8	-164.1	-142.3	28.4	-0.8	0	0	0	115.1
583	T	39.1	Very low	40.8	Very low	117 Å²	117	135.2 Å²	135.2	72%	0.718	69%	0.685	S	S	*	*			trans	75.5	162.7	158	81.6	0	0	0	0	116.6
584	N	33.3	Very low	39.6	Very low	122 Å²	122	136.8 Å²	136.8	65%	0.652	70%	0.695	S	S	*	*			cis	-163.8	147.8	-33.6	-110.7	-49.9	0	0	0	109.1
585	R	32.2	Very low	38.3	Very low	193 Å²	193	137.4 Å²	137.4	73%	0.728	71%	0.706	S	S	*	*			trans	54.8	137.2	139.5	-71.2	176.4	171.7	-168.6	-3.8	121.9
586	R	31.4	Very low	37.2	Very low	202 Å²	202	137.1 Å²	137.1	76%	0.762	71%	0.711	S	S	*	*			trans	88.7	119	131.8	-80.5	169.5	176.2	-171.7	-3.4	121.3
587	V	29.6	Very low	35.9	Very low	113 Å²	113	138.4 Å²	138.4	69%	0.685	72%	0.718	S	S	*	*				88	112.7	117.2	170.5	0	0	0	0	120.5
588	R	26.8	Very low	34.9	Very low	217 Å²	217	141.8 Å²	141.8	82%	0.819	73%	0.728	S	S	*	*			trans	75.3	118.7	142	-74.6	175	-175.9	175.7	-1.7	122.9
589	I	26.2	Very low	33.8	Very low	149 Å²	149	144.2 Å²	144.2	76%	0.764	74%	0.737	S	S	*	*				73.5	130.6	118.9	-62.4	170.4	0	0	0	120.8
590	A	28	Very low	33.1	Very low	85 Å²	85	146 Å²	146	70%	0.702	74%	0.744	S	S	*	*			trans	89	102.4	149.5	0	0	0	0	0	123.4
591	R	29.2	Very low	32.5	Very low	211 Å²	211	145.2 Å²	145.2	80%	0.796	74%	0.744	S	S	*	*				69.2	141.3	99.1	-145.1	-176.1	177.7	-162	-1.4	121.6
592	W	27.1	Very low	32.1	Very low	185 Å²	185	145 Å²	145	70%	0.701	73%	0.734	S	S	*	*			trans	93.8	96.5	161.9	-71.5	96.1	0	0	0	121.5
593	V	32.9	Very low	31.6	Very low	115 Å²	115	149.7 Å²	149.7	70%	0.697	74%	0.739	S	S	*	*				77	143.2	114.2	157.8	0	0	0	0	122.7
594	P	43.4	Very low	31.1	Very low	108 Å²	108	149 Å²	149	70%	0.701	75%	0.746	S	S	*	*			trans	-100.4	-166.4	-175.1	42.1	-36.9	0	0	0	114
595	P	36	Very low	30.9	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	75%	0.749	S	S	*	*				-155.4	-174.6	104.7	42.6	-24.9	0	0	0	117.4
596	A	34.7	Very low	30.7	Very low	72 Å²	72	143.3 Å²	143.3	60%	0.595	75%	0.75	S	S	*	*			trans	90.6	109.5	142.5	0	0	0	0	0	122.6
597	E	31.2	Very low	30.4	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	75%	0.746	S	S	*	*				53.1	129.8	118.2	-61.2	164.7	131.1	0	0	122.2
598	L	32.6	Very low	30.5	Very low	172 Å²	172	142.1 Å²	142.1	90%	0.901	76%	0.756	S	S	*	*				-155.9	154.3	98.1	-132.7	80.7	0	0	0	112.8
599	E	29.8	Very low	30.4	Very low	164 Å²	164	137.2 Å²	137.2	77%	0.766	75%	0.751	S	S	*	*			trans	-85.6	173.6	177.8	-49.7	173.4	112.9	0	0	112.7
600	M	33.2	Very low	30.4	Very low	187 Å²	187	136.2 Å²	136.2	92%	0.921	75%	0.751	S	S	*	*				-158.7	156.8	118.3	-104.2	-174.1	85.5	0	0	111.5
601	T	27.9	Very low	30.2	Very low	101 Å²	101	137.5 Å²	137.5	62%	0.62	75%	0.751	S	S	*	*			trans	-119.7	164	-165.5	50.7	0	0	0	0	112.5
602	E	30.6	Very low	30	Very low	133 Å²	133	134.9 Å²	134.9	62%	0.621	75%	0.752	S	S	*	*				171.2	144.3	111.9	-92	-158.7	161.7	0	0	117.1
603	R	29.1	Very low	30	Very low	198 Å²	198	130.9 Å²	130.9	75%	0.747	75%	0.752	S	S	*	*			trans	61.6	97.7	140.6	-67.9	-179.1	177	127.5	14	122.9
604	A	27.1	Very low	29.9	Very low	103 Å²	103	134 Å²	134	85%	0.851	76%	0.759	S	S	*	*				56.5	133.5	99	0	0	0	0	0	121.5
605	G	30.9	Very low	29.6	Very low	70 Å²	70	134.5 Å²	134.5	72%	0.722	76%	0.762	S	S	*	*			trans	-170	40.3	178.1	0	0	0	0	0	115.9
606	T	27.8	Very low	29.1	Very low	124 Å²	124	132.5 Å²	132.5	76%	0.761	76%	0.756	S	S	*	*			trans	34.2	107.6	142.1	56.9	0	0	0	0	121
607	S	24.5	Very low	28.6	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	77%	0.766	S	S	*	*				38.1	132.5	128.5	63.5	0	0	0	0	121.6
608	H	32.2	Very low	28.4	Very low	195 Å²	195	136.7 Å²	136.7	90%	0.903	77%	0.767	S	S	*	*				-141.1	124.2	127.5	-114.8	-75.1	0	0	0	112.9
609	T	23.6	Very low	28	Very low	114 Å²	114	135.8 Å²	135.8	70%	0.699	76%	0.758	S	S	*	*			trans	-98.1	141	174.7	49.1	0	0	0	0	111.3
610	T	27	Very low	27.7	Very low	127 Å²	127	139.5 Å²	139.5	78%	0.779	77%	0.765	S	S	*	*			trans	-174.7	111.1	144.4	33.3	0	0	0	0	107.4
611	T	23.7	Very low	27.3	Very low	112 Å²	112	134.9 Å²	134.9	69%	0.687	75%	0.751	S	S	*	*				57.5	116.9	75	67.3	0	0	0	0	115.1
612	L	24.8	Very low	27.4	Very low	157 Å²	157	138 Å²	138	82%	0.822	76%	0.759	S	S	*	*				177.6	152.5	106.9	-100.9	145.7	0	0	0	114.7
613	S	27.4	Very low	27.2	Very low	101 Å²	101	138.9 Å²	138.9	71%	0.706	77%	0.766	S	S	*	*			trans	57.7	97.7	148.7	60.5	0	0	0	0	121.8
614	E	29.8	Very low	26.9	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	77%	0.766	S	S	*	*				-29.7	171.3	119	-72.5	-176.6	138.4	0	0	116.5
615	P	38.8	Very low	27.4	Very low	117 Å²	117	138 Å²	138	76%	0.76	77%	0.766	S	S	*	*			cis	-139.2	-150	-33.5	39.4	-19.9	0	0	0	111.1
616	A	24	Very low	27.7	Very low	81 Å²	81	139.6 Å²	139.6	67%	0.669	76%	0.763	S	S	*	*			trans	113.3	121.5	145	0	0	0	0	0	119.4
617	E	24.2	Very low	27.8	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	76%	0.757	S	S	*	*			trans	36.3	106.9	138.1	-57.4	-173.6	103.8	0	0	120.9
618	I	28.3	Very low	27.8	Very low	165 Å²	165	140.3 Å²	140.3	85%	0.846	77%	0.765	S	S	*	*				-127.6	104.3	124	-59.8	-175.2	0	0	0	109.4
619	Q	23.7	Very low	27.7	Very low	153 Å²	153	137.7 Å²	137.7	72%	0.715	76%	0.756	S	S	*	*			trans	17.5	129.4	136.4	-64.7	175.7	-4.4	0	0	117.9
620	R	24.1	Very low	27.9	Very low	242 Å²	242	137.4 Å²	137.4	91%	0.913	76%	0.759	S	S	*	*				47	132.5	86.6	-71.1	-175.3	175.8	-179.8	-0.8	112.8
621	S	23.9	Very low	28.6	Very low	89 Å²	89	136.6 Å²	136.6	62%	0.622	76%	0.756	S	S	*	*			cis	-157.3	-175.3	38.8	60.1	0	0	0	0	114
622	E	29.9	Very low	28.8	Very low	167 Å²	167	138.3 Å²	138.3	78%	0.78	76%	0.756	S	S	*	*			trans	-53.8	161.2	161.5	-44	106.8	125.1	0	0	112.5
623	I	25.6	Very low	28.9	Very low	151 Å²	151	135.5 Å²	135.5	77%	0.774	74%	0.742	S	S	*	*			trans	-159.8	115	140.7	-102.5	146.2	0	0	0	113.2
624	L	23.4	Very low	29	Very low	145 Å²	145	139.8 Å²	139.8	76%	0.759	75%	0.747	S	S	*	*			trans	31.8	117.6	148.3	-70.8	82.1	0	0	0	122.8
625	V	38.7	Very low	29	Very low	139 Å²	139	135.7 Å²	135.7	84%	0.842	74%	0.739	S	S	*	*				-61.3	136.7	127.8	-179.9	0	0	0	0	107.4
626	P	37.2	Very low	28.4	Very low	102 Å²	102	138.7 Å²	138.7	66%	0.662	74%	0.743	S	S	*	*				-161.2	178	68.9	45.3	-23.8	0	0	0	120.7
627	A	28.1	Very low	28.7	Very low	77 Å²	77	143.8 Å²	143.8	64%	0.636	75%	0.75	S	S	*	*			trans	76.3	135	141.9	0	0	0	0	0	122.8
628	L	25.9	Very low	29	Very low	159 Å²	159	141.5 Å²	141.5	83%	0.832	74%	0.743	S	S	*	*				175.1	97.6	127.1	-90.4	161.8	0	0	0	107.4
629	I	29.3	Very low	29.1	Very low	140 Å²	140	140.1 Å²	140.1	72%	0.718	73%	0.733	S	S	*	*				67.1	125.3	82.8	-64.2	174.1	0	0	0	111.2
630	S	28.9	Very low	29.5	Very low	108 Å²	108	138 Å²	138	76%	0.755	73%	0.727	S	S	*	*			cis	-145.8	160.7	42.3	-138.2	0	0	0	0	115.1
631	P	40.9	Very low	29.8	Very low	110 Å²	110	133.7 Å²	133.7	71%	0.714	72%	0.717	S	S	*	*			trans	-102.6	179.6	-173.8	41.2	-35.7	0	0	0	113.9
632	E	27.8	Very low	30.1	Very low	147 Å²	147	134.7 Å²	134.7	69%	0.687	72%	0.715	S	S	*	*				-161.8	125.1	127.2	-117.9	-159.6	-146.2	0	0	116.6
633	N	27.2	Very low	30.3	Very low	99 Å²	99	133.5 Å²	133.5	53%	0.529	71%	0.71	S	S	.	*			trans	73.7	104.1	145.6	-83	-56.5	0	0	0	122.9
634	K	29	Very low	30.8	Very low	190 Å²	190	130.5 Å²	130.5	83%	0.826	69%	0.691	S	S	*	*			trans	84.3	134.2	137.9	-63.2	165.5	-175.8	173.5	0	118.5
635	S	29.8	Very low	31.4	Very low	96 Å²	96	127 Å²	127	67%	0.671	68%	0.675	S	S	*	*			cis	-156.3	114.6	-1.8	51.8	0	0	0	0	114.7	K637	S635-K637 PolarHBondContact O-N 2.91Å
636	E	27.3	Very low	31.4	Very low	179 Å²	179	124.5 Å²	124.5	84%	0.836	66%	0.66	S	S	*	*				52.9	54	108.8	-153.9	169.2	-140	0	0	117.9
637	K	29.7	Very low	31.4	Very low	188 Å²	188	124.4 Å²	124.4	82%	0.817	65%	0.651	S	S	*	*	S	Bend	trans	-157.1	-32.3	145.5	-121.9	168.7	-174.6	179.3	0	116.2	S635 H639	S635-K637 PolarHBondContact O-N 2.91Å; K637-H639 VanDerWaalsContact C-N 3.31Å; K637-H639 PolarHBondContact O-N 2.82Å
638	D	30.2	Very low	32.1	Very low	125 Å²	125	125.1 Å²	125.1	67%	0.668	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	11	-170.1	-45.7	-36.5	0	0	0	114.1
639	H	30.4	Very low	32.9	Very low	136 Å²	136	119.5 Å²	119.5	63%	0.63	62%	0.617	S	S	*	*	H	α-helix	trans	-70.4	-33.5	-176	-95.9	-80.2	0	0	0	113.7	K637 E641 E643	K637-H639 VanDerWaalsContact C-N 3.31Å; K637-H639 PolarHBondContact O-N 2.82Å; H639-E641 PolarHBondContact O-N 2.92Å; H639-E643 WeakPolarHBondContact O-CB 3.07Å; H639-E643 PolarHBondContact O-N 3.01Å; H639-E643 VanDerWaalsContact O-N 3.11Å
640	D	32.4	Very low	33.7	Very low	110 Å²	110	116.6 Å²	116.6	59%	0.588	60%	0.603	S	S	*	*	H	α-helix	trans	-73.4	-6.8	-174.9	-167.1	46.1	0	0	0	113.3	K644	D640-K644 WeakPolarHBondContact O-CG 3.01Å; D640-K644 PolarHBondContact O-NZ 3.39Å; D640-K644 IonicContact OD1-NZ 2.79Å; D640-K644 PolarHBondContact OD1-NZ 2.9Å; D640-K644 IonicContact OD2-NZ 3.2Å; D640-K644 PolarHBondContact OD2-NZ 2.85Å
641	E	31.1	Very low	34.6	Very low	150 Å²	150	116.9 Å²	116.9	70%	0.701	59%	0.591	S	S	*	*	H	α-helix	trans	-99.8	-49.4	170.5	-66.6	-169.2	154.5	0	0	111.9	H639 E643 K644 V645	H639-E641 PolarHBondContact O-N 2.92Å; E641-E643 VanDerWaalsContact C-N 3.32Å; E641-E643 PolarHBondContact O-N 3.3Å; E641-K644 PolarHBondContact O-N 3.25Å; E641-K644 VanDerWaalsContact O-N 3.11Å; E641-V645 WeakPolarHBondContact O-CG2 3.08Å; E641-V645 PolarHBondContact O-N 3.03Å
642	N	30.2	Very low	34.9	Very low	111 Å²	111	112.9 Å²	112.9	59%	0.594	56%	0.563	S	S	*	*	H	α-helix	trans	-60.9	-37.6	179.4	-92.3	-44.7	0	0	0	113.2	K644 V645 V646	N642-K644 VanDerWaalsContact C-N 3.33Å; N642-V645 PolarHBondContact O-N 3.4Å; N642-V646 WeakPolarHBondContact O-CG2 3.4Å; N642-V646 PolarHBondContact O-N 2.89Å; N642-V646 VanDerWaalsContact O-N 3.11Å
643	E	34.1	Very low	35.9	Very low	141 Å²	141	108.7 Å²	108.7	66%	0.659	55%	0.545	S	S	*	.	H	α-helix	trans	-66.7	-36.8	177	-164.2	157.1	-149.4	0	0	111.1	H639 E641 E647	H639-E643 WeakPolarHBondContact O-CB 3.07Å; H639-E643 PolarHBondContact O-N 3.01Å; H639-E643 VanDerWaalsContact O-N 3.11Å; E641-E643 VanDerWaalsContact C-N 3.32Å; E641-E643 PolarHBondContact O-N 3.3Å; E643-E647 VanDerWaalsContact O-CB 3.31Å; E643-E647 WeakPolarHBondContact O-CB 3.33Å; E643-E647 PolarHBondContact O-N 2.96Å
644	K	34.6	Very low	36.9	Very low	89 Å²	89	109.8 Å²	109.8	39%	0.387	55%	0.548	S	S	.	.	H	α-helix	trans	-69.1	-40.4	173.1	-68.2	-169.3	-172	81.4	0	113	D640 E641 N642 V646 E647 I648	D640-K644 WeakPolarHBondContact O-CG 3.01Å; D640-K644 PolarHBondContact O-NZ 3.39Å; D640-K644 IonicContact OD1-NZ 2.79Å; D640-K644 PolarHBondContact OD1-NZ 2.9Å; D640-K644 IonicContact OD2-NZ 3.2Å; D640-K644 PolarHBondContact OD2-NZ 2.85Å; E641-K644 PolarHBondContact O-N 3.25Å; E641-K644 VanDerWaalsContact O-N 3.11Å; N642-K644 VanDerWaalsContact C-N 3.33Å; K644-V646 VanDerWaalsContact C-N 3.34Å; K644-V646 PolarHBondContact O-N 2.79Å; K644-E647 PolarHBondContact O-N 3.39Å; K644-I648 VanDerWaalsContact O-CB 3.31Å; K644-I648 WeakPolarHBondContact O-CB 3.39Å; K644-I648 WeakPolarHBondContact O-CD1 3.29Å; K644-I648 WeakPolarHBondContact O-CG1 3.22Å; K644-I648 PolarHBondContact O-N 2.77Å
645	V	35.6	Very low	37.7	Very low	70 Å²	70	102.7 Å²	102.7	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-43.2	177.5	171	0	0	0	0	111	E641 N642 S649	E641-V645 WeakPolarHBondContact O-CG2 3.08Å; E641-V645 PolarHBondContact O-N 3.03Å; N642-V645 PolarHBondContact O-N 3.4Å; V645-S649 WeakPolarHBondContact O-CB 3.34Å; V645-S649 PolarHBondContact O-N 2.86Å; V645-S649 PolarHBondContact O-OG 3.43Å
646	V	38.7	Very low	38.7	Very low	87 Å²	87	100.9 Å²	100.9	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-38.7	175.6	175.4	0	0	0	0	111.4	N642 K644 N650	N642-V646 WeakPolarHBondContact O-CG2 3.4Å; N642-V646 PolarHBondContact O-N 2.89Å; N642-V646 VanDerWaalsContact O-N 3.11Å; K644-V646 VanDerWaalsContact C-N 3.34Å; K644-V646 PolarHBondContact O-N 2.79Å; V646-N650 WeakPolarHBondContact CG1-ND2 3.04Å; V646-N650 WeakPolarHBondContact O-CB 3.43Å; V646-N650 PolarHBondContact O-N 2.88Å; V646-N650 PolarHBondContact O-ND2 3.2Å
647	E	38.4	Very low	39.6	Very low	101 Å²	101	95.2 Å²	95.2	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-66.1	-40.4	175.7	-159.9	-163.7	178.9	0	0	112.1	E643 K644 N650 K651	E643-E647 VanDerWaalsContact O-CB 3.31Å; E643-E647 WeakPolarHBondContact O-CB 3.33Å; E643-E647 PolarHBondContact O-N 2.96Å; K644-E647 PolarHBondContact O-N 3.39Å; E647-N650 PolarHBondContact O-N 3.11Å; E647-K651 HydrophobicContact CG-CD 4.38Å; E647-K651 WeakPolarHBondContact O-CB 3.45Å; E647-K651 VanDerWaalsContact O-CG 3.28Å; E647-K651 WeakPolarHBondContact O-CG 3.01Å; E647-K651 PolarHBondContact O-N 3.45Å; E647-K651 WeakPolarHBondContact OE1-CE 3.35Å; E647-K651 IonicContact OE1-NZ 2.69Å; E647-K651 PolarHBondContact OE1-NZ 3.36Å; E647-K651 IonicContact OE2-NZ 2.65Å; E647-K651 PolarHBondContact OE2-NZ 3.4Å
648	I	41.7	Very low	40.4	Very low	92 Å²	92	93.7 Å²	93.7	47%	0.472	47%	0.472	S	S	.	.	H	α-helix	trans	-65.8	-47.3	175.8	-71.4	163.9	0	0	0	110.4	K644 N650 K651 L652	K644-I648 VanDerWaalsContact O-CB 3.31Å; K644-I648 WeakPolarHBondContact O-CB 3.39Å; K644-I648 WeakPolarHBondContact O-CD1 3.29Å; K644-I648 WeakPolarHBondContact O-CG1 3.22Å; K644-I648 PolarHBondContact O-N 2.77Å; I648-N650 VanDerWaalsContact C-N 3.28Å; I648-N650 PolarHBondContact O-N 3.12Å; I648-K651 PolarHBondContact O-N 3.46Å; I648-K651 VanDerWaalsContact O-N 3.13Å; I648-L652 HydrophobicContact CG2-CD1 4.39Å; I648-L652 WeakPolarHBondContact O-CB 3.39Å; I648-L652 PolarHBondContact O-N 2.9Å
649	S	43.5	Very low	41.1	Very low	40 Å²	40	90 Å²	90	28%	0.28	45%	0.449	S	S	.	.	H	α-helix	trans	-59.3	-38.9	177.2	-60.5	0	0	0	0	112.3	V645 L653	V645-S649 WeakPolarHBondContact O-CB 3.34Å; V645-S649 PolarHBondContact O-N 2.86Å; V645-S649 PolarHBondContact O-OG 3.43Å; S649-L653 WeakPolarHBondContact O-CB 3.43Å; S649-L653 PolarHBondContact O-N 3.23Å
650	N	45.8	Very low	41.8	Very low	80 Å²	80	86 Å²	86	43%	0.428	43%	0.432	S	S	.	.	H	α-helix	trans	-74.2	-33.4	175.5	-77.8	-67.8	0	0	0	113	V646 E647 I648 L653 M654	V646-N650 WeakPolarHBondContact CG1-ND2 3.04Å; V646-N650 WeakPolarHBondContact O-CB 3.43Å; V646-N650 PolarHBondContact O-N 2.88Å; V646-N650 PolarHBondContact O-ND2 3.2Å; E647-N650 PolarHBondContact O-N 3.11Å; I648-N650 VanDerWaalsContact C-N 3.28Å; I648-N650 PolarHBondContact O-N 3.12Å; N650-L653 PolarHBondContact O-N 2.62Å; N650-M654 WeakPolarHBondContact O-CB 3.31Å; N650-M654 WeakPolarHBondContact O-CG 3.28Å; N650-M654 PolarHBondContact O-N 3.35Å
651	K	48.2	Very low	42.2	Very low	113 Å²	113	88.7 Å²	88.7	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-43.4	171.8	-77.1	167	-176.9	166.6	0	111.6	E647 I648 M654 A655	E647-K651 HydrophobicContact CG-CD 4.38Å; E647-K651 WeakPolarHBondContact O-CB 3.45Å; E647-K651 VanDerWaalsContact O-CG 3.28Å; E647-K651 WeakPolarHBondContact O-CG 3.01Å; E647-K651 PolarHBondContact O-N 3.45Å; E647-K651 WeakPolarHBondContact OE1-CE 3.35Å; E647-K651 IonicContact OE1-NZ 2.69Å; E647-K651 PolarHBondContact OE1-NZ 3.36Å; E647-K651 IonicContact OE2-NZ 2.65Å; E647-K651 PolarHBondContact OE2-NZ 3.4Å; I648-K651 PolarHBondContact O-N 3.46Å; I648-K651 VanDerWaalsContact O-N 3.13Å; K651-M654 PolarHBondContact O-N 3.34Å; K651-A655 WeakPolarHBondContact O-CB 3.44Å; K651-A655 PolarHBondContact O-N 3.03Å
652	L	48.1	Very low	42.6	Very low	27 Å²	27	85.8 Å²	85.8	14%	0.141	43%	0.428	C	S	.	.	H	α-helix	trans	-56.5	-50.9	171.3	-110.4	155.5	0	0	0	111.4	I648 M654 A655 W656 T683 L687	I648-L652 HydrophobicContact CG2-CD1 4.39Å; I648-L652 WeakPolarHBondContact O-CB 3.39Å; I648-L652 PolarHBondContact O-N 2.9Å; L652-M654 VanDerWaalsContact C-N 3.32Å; L652-M654 PolarHBondContact O-N 2.99Å; L652-A655 PolarHBondContact O-N 3.35Å; L652-W656 VanDerWaalsContact O-CB 3.26Å; L652-W656 WeakPolarHBondContact O-CB 3.23Å; L652-W656 PolarHBondContact O-N 2.97Å; L652-T683 HydrophobicContact CD1-CG2 3.99Å; L652-T683 HydrophobicContact CD2-CG2 3.55Å; L652-T683 HydrophobicContact CG-CG2 3.66Å; L652-L687 HydrophobicContact CD1-CD1 4.22Å; L652-L687 HydrophobicContact CD1-CD2 3.81Å; L652-L687 HydrophobicContact CD1-CG 4.33Å
653	L	48.1	Very low	42.8	Very low	59 Å²	59	85.2 Å²	85.2	31%	0.309	44%	0.439	S	S	.	.	H	α-helix	trans	-61.1	-39.2	177.9	-173.7	64.1	0	0	0	112.2	S649 N650 W656 L657	S649-L653 WeakPolarHBondContact O-CB 3.43Å; S649-L653 PolarHBondContact O-N 3.23Å; N650-L653 PolarHBondContact O-N 2.62Å; L653-W656 HydrophobicContact CD1-CE3 4.22Å; L653-L657 HydrophobicContact CG-CD1 4.18Å; L653-L657 VanDerWaalsContact O-CB 3.32Å; L653-L657 WeakPolarHBondContact O-CB 3.25Å; L653-L657 WeakPolarHBondContact O-CG 3.43Å; L653-L657 PolarHBondContact O-N 3.04Å
654	M	46.9	Very low	42.9	Very low	121 Å²	121	84.8 Å²	84.8	60%	0.596	44%	0.441	S	S	*	.	H	α-helix	trans	-74.5	-33.4	178.4	-73.3	-71	175.8	0	0	113.5	N650 K651 L652 L657 K658	N650-M654 WeakPolarHBondContact O-CB 3.31Å; N650-M654 WeakPolarHBondContact O-CG 3.28Å; N650-M654 PolarHBondContact O-N 3.35Å; K651-M654 PolarHBondContact O-N 3.34Å; L652-M654 VanDerWaalsContact C-N 3.32Å; L652-M654 PolarHBondContact O-N 2.99Å; M654-L657 HydrophobicContact SD-CD1 4.33Å; M654-K658 PolarHBondContact O-N 3.28Å
655	A	46.7	Very low	43.1	Very low	41 Å²	41	85.7 Å²	85.7	34%	0.339	46%	0.458	S	S	.	.	H	α-helix	trans	-66.5	-45.8	170.7	0	0	0	0	0	110.7	K651 L652 L657 K658 W659	K651-A655 WeakPolarHBondContact O-CB 3.44Å; K651-A655 PolarHBondContact O-N 3.03Å; L652-A655 PolarHBondContact O-N 3.35Å; A655-L657 PolarHBondContact O-N 2.95Å; A655-K658 WeakPolarHBondContact O-CB 3.2Å; A655-K658 PolarHBondContact O-N 2.96Å; A655-W659 PolarHBondContact O-N 2.88Å
656	W	50.2	Low	43.3	Very low	58 Å²	58	90.4 Å²	90.4	22%	0.22	48%	0.475	C	S	.	.	H	α-helix	trans	-64.6	-35.2	176.1	-178.9	83.5	0	0	0	113.3	L652 L653 W659 N660 F680 F704 I713	L652-W656 VanDerWaalsContact O-CB 3.26Å; L652-W656 WeakPolarHBondContact O-CB 3.23Å; L652-W656 PolarHBondContact O-N 2.97Å; L653-W656 HydrophobicContact CD1-CE3 4.22Å; W656-W659 WeakPolarHBondContact O-CB 3.05Å; W656-W659 PolarHBondContact O-N 3.22Å; W656-N660 VanDerWaalsContact CE2-ND2 3.26Å; W656-N660 WeakPolarHBondContact CZ2-ND2 3.38Å; W656-N660 PolarHBondContact O-N 2.88Å; W656-F680 AromaticContact CD1-CE2 3.91Å; W656-F704 HydrophobicContact CH2-CE1 4.04Å; W656-F704 HydrophobicContact CZ2-CD1 4.5Å; W656-F704 AromaticContact CZ2-CE1 3.78Å; W656-F704 HydrophobicContact CZ2-CE1 3.78Å; W656-I713 HydrophobicContact CZ2-CD1 3.45Å; W656-I713 VanDerWaalsContact CZ2-CD1 3.45Å
657	L	47.4	Very low	43.3	Very low	60 Å²	60	89.8 Å²	89.8	31%	0.314	47%	0.474	S	S	.	.	H	α-helix	trans	-68.7	-41.8	171.2	-77.2	168.2	0	0	0	112.1	L653 M654 A655 W659 N660 Y661	L653-L657 HydrophobicContact CG-CD1 4.18Å; L653-L657 VanDerWaalsContact O-CB 3.32Å; L653-L657 WeakPolarHBondContact O-CB 3.25Å; L653-L657 WeakPolarHBondContact O-CG 3.43Å; L653-L657 PolarHBondContact O-N 3.04Å; M654-L657 HydrophobicContact SD-CD1 4.33Å; A655-L657 PolarHBondContact O-N 2.95Å; L657-W659 VanDerWaalsContact C-N 3.25Å; L657-W659 PolarHBondContact O-N 2.96Å; L657-N660 PolarHBondContact O-N 3.46Å; L657-Y661 HydrophobicContact CD2-CD2 4.27Å; L657-Y661 HydrophobicContact CD2-CE2 4.42Å; L657-Y661 WeakPolarHBondContact O-CB 2.99Å; L657-Y661 PolarHBondContact O-N 3.5Å
658	K	46	Very low	43.4	Very low	157 Å²	157	91.2 Å²	91.2	68%	0.683	49%	0.494	S	S	*	.	H	α-helix	trans	-56.2	-42.1	170.8	-89.5	-176.8	169.9	-172.5	0	111.7	M654 A655 N660 T662	M654-K658 PolarHBondContact O-N 3.28Å; A655-K658 WeakPolarHBondContact O-CB 3.2Å; A655-K658 PolarHBondContact O-N 2.96Å; K658-N660 VanDerWaalsContact C-N 3.32Å; K658-N660 PolarHBondContact O-N 3.18Å; K658-T662 PolarHBondContact O-OG1 3.09Å
659	W	45.5	Very low	43.1	Very low	47 Å²	47	91.5 Å²	91.5	18%	0.178	50%	0.497	C	S	.	.	H	α-helix	trans	-57.6	-43.8	178.9	-153	64.6	0	0	0	112.3	A655 W656 L657 R676 E677	A655-W659 PolarHBondContact O-N 2.88Å; W656-W659 WeakPolarHBondContact O-CB 3.05Å; W656-W659 PolarHBondContact O-N 3.22Å; L657-W659 VanDerWaalsContact C-N 3.25Å; L657-W659 PolarHBondContact O-N 2.96Å; W659-R676 PolarHBondContact NE1-O 3.28Å; W659-E677 WeakPolarHBondContact CH2-OE2 3.47Å; W659-E677 HydrophobicContact CZ2-CB 4.37Å; W659-E677 WeakPolarHBondContact CZ2-OE2 3.43Å
660	N	43.7	Very low	43.1	Very low	51 Å²	51	96 Å²	96	27%	0.273	52%	0.516	S	S	.	.	H	α-helix	trans	-87.8	-22.8	-175.2	-86.4	-54.5	0	0	0	115.9	W656 L657 K658 T709	W656-N660 VanDerWaalsContact CE2-ND2 3.26Å; W656-N660 WeakPolarHBondContact CZ2-ND2 3.38Å; W656-N660 PolarHBondContact O-N 2.88Å; L657-N660 PolarHBondContact O-N 3.46Å; K658-N660 VanDerWaalsContact C-N 3.32Å; K658-N660 PolarHBondContact O-N 3.18Å; N660-T709 VanDerWaalsContact OD1-CG2 3.31Å; N660-T709 WeakPolarHBondContact OD1-CG2 3.45Å
661	Y	41.4	Very low	42.9	Very low	168 Å²	168	94.4 Å²	94.4	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-113.4	-3.2	-166.5	-86.5	-86	0	0	0	117.3	L657 A663	L657-Y661 HydrophobicContact CD2-CD2 4.27Å; L657-Y661 HydrophobicContact CD2-CE2 4.42Å; L657-Y661 WeakPolarHBondContact O-CB 2.99Å; L657-Y661 PolarHBondContact O-N 3.5Å; Y661-A663 PolarHBondContact O-N 2.87Å
662	T	38.8	Very low	42.5	Very low	88 Å²	88	91.3 Å²	91.3	54%	0.54	50%	0.504	S	S	.	.			trans	-96.8	65.7	168	61.1	0	0	0	0	111.9	K658 D664	K658-T662 PolarHBondContact O-OG1 3.09Å; T662-D664 PolarHBondContact O-N 3.48Å
663	A	35.7	Very low	42.3	Very low	100 Å²	100	95.9 Å²	95.9	83%	0.826	53%	0.525	S	S	*	.			trans	-78.6	46.7	163.5	0	0	0	0	0	111.2	Y661	Y661-A663 PolarHBondContact O-N 2.87Å
664	D	34.9	Very low	42.4	Very low	132 Å²	132	99.7 Å²	99.7	71%	0.706	54%	0.541	S	S	*	.			trans	-73.3	134.6	174	-104.4	-41.7	0	0	0	109.8	T662 H666	T662-D664 PolarHBondContact O-N 3.48Å; D664-H666 PolarHBondContact O-N 2.86Å
665	S	39.2	Very low	42.5	Very low	107 Å²	107	100.9 Å²	100.9	75%	0.748	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	29.3	-162.1	62.3	0	0	0	0	116.8
666	H	40.6	Very low	42.8	Very low	169 Å²	169	102.4 Å²	102.4	78%	0.782	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	2	-169.7	-78.1	2.6	0	0	0	115.4	D664 C668	D664-H666 PolarHBondContact O-N 2.86Å; H666-C668 PolarHBondContact O-N 3.01Å
667	C	38.3	Very low	43	Very low	75 Å²	75	102 Å²	102	51%	0.507	54%	0.542	S	S	.	.			trans	-85.2	97.8	173.2	-143.3	0	0	0	0	110.1	C672	C667-C672 WeakPolarHBondContact SG-CB 3.42Å
668	C	40	Very low	43.3	Very low	130 Å²	130	103.8 Å²	103.8	88%	0.878	55%	0.552	S	S	*	*			trans	-108.5	15.6	179.3	-60.1	0	0	0	0	113.2	H666	H666-C668 PolarHBondContact O-N 3.01Å
669	D	37.1	Very low	43.7	Very low	99 Å²	99	102.3 Å²	102.3	53%	0.529	55%	0.548	S	S	.	.			trans	-126.6	122.8	-170.5	-159.2	-38.7	0	0	0	110.2	S671 C672	D669-S671 PolarHBondContact O-N 2.88Å; D669-S671 WeakPolarHBondContact OD1-CB 3.07Å; D669-S671 PolarHBondContact OD1-N 2.89Å; D669-S671 PolarHBondContact OD1-OG 3.17Å; D669-C672 PolarHBondContact O-N 3.38Å
670	L	42.9	Very low	44.4	Very low	133 Å²	133	101.3 Å²	101.3	70%	0.696	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.1	-176.6	-77.3	152.7	0	0	0	112.3	C672 E673 E674	L670-C672 PolarHBondContact O-N 2.77Å; L670-E673 PolarHBondContact O-N 2.86Å; L670-E674 PolarHBondContact O-N 3.22Å
671	S	41	Very low	45.2	Very low	48 Å²	48	101.6 Å²	101.6	34%	0.336	54%	0.544	S	S	.	.	H	α-helix	trans	-56.4	-34.4	176.9	55.8	0	0	0	0	112.7	D669 E673 E674 E675	D669-S671 PolarHBondContact O-N 2.88Å; D669-S671 WeakPolarHBondContact OD1-CB 3.07Å; D669-S671 PolarHBondContact OD1-N 2.89Å; D669-S671 PolarHBondContact OD1-OG 3.17Å; S671-E673 VanDerWaalsContact C-N 3.25Å; S671-E673 PolarHBondContact O-N 3.32Å; S671-E674 PolarHBondContact O-N 3.2Å; S671-E675 PolarHBondContact O-N 3.18Å
672	C	40.3	Very low	46.1	Very low	48 Å²	48	98.4 Å²	98.4	32%	0.324	54%	0.539	S	S	.	.	H	α-helix	trans	-78.2	-1.7	179	-63.6	0	0	0	0	114	C667 D669 L670 R676	C667-C672 WeakPolarHBondContact SG-CB 3.42Å; D669-C672 PolarHBondContact O-N 3.38Å; L670-C672 PolarHBondContact O-N 2.77Å; C672-R676 VanDerWaalsContact O-CZ 3.24Å; C672-R676 PolarHBondContact O-NE 2.03Å; C672-R676 PolarHBondContact O-NH2 3.47Å
673	E	44.6	Very low	47.1	Very low	123 Å²	123	96.5 Å²	96.5	58%	0.575	53%	0.527	S	S	*	.	H	α-helix	trans	-95.2	-39.5	165.4	-61	-163.5	132.3	0	0	111	L670 S671 R676 E677	L670-E673 PolarHBondContact O-N 2.86Å; S671-E673 VanDerWaalsContact C-N 3.25Å; S671-E673 PolarHBondContact O-N 3.32Å; E673-R676 WeakPolarHBondContact O-CB 3.46Å; E673-R676 PolarHBondContact O-N 3.38Å; E673-E677 PolarHBondContact O-N 3.12Å
674	E	49.6	Very low	48.5	Very low	138 Å²	138	91.8 Å²	91.8	65%	0.645	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-53.8	178.7	-64.3	-178.1	144.2	0	0	112.4	L670 S671 R676 E677 D678	L670-E674 PolarHBondContact O-N 3.22Å; S671-E674 PolarHBondContact O-N 3.2Å; E674-R676 PolarHBondContact O-N 3.38Å; E674-E677 PolarHBondContact O-N 3.04Å; E674-D678 PolarHBondContact O-N 2.04Å
675	E	47.7	Very low	49.9	Very low	146 Å²	146	89.2 Å²	89.2	68%	0.682	49%	0.485	S	S	*	.	H	α-helix	trans	-56.4	-29.6	177	-69.5	-172.3	151.3	0	0	112.7	S671 E679	S671-E675 PolarHBondContact O-N 3.18Å; E675-E679 PolarHBondContact O-N 2.65Å
676	R	53.2	Low	51.3	Low	74 Å²	74	90.9 Å²	90.9	28%	0.279	48%	0.484	S	S	.	.	H	α-helix	trans	-80.5	-37.7	-176.7	-112.7	-166.9	-58.9	161.6	8	112	W659 C672 E673 E674	W659-R676 PolarHBondContact NE1-O 3.28Å; C672-R676 VanDerWaalsContact O-CZ 3.24Å; C672-R676 PolarHBondContact O-NE 2.03Å; C672-R676 PolarHBondContact O-NH2 3.47Å; E673-R676 WeakPolarHBondContact O-CB 3.46Å; E673-R676 PolarHBondContact O-N 3.38Å; E674-R676 PolarHBondContact O-N 3.38Å
677	E	54.5	Low	52.4	Low	48 Å²	48	84.2 Å²	84.2	22%	0.224	45%	0.454	C	S	.	.	H	α-helix	trans	-66.8	-42.7	170.7	-176.8	71.3	-130.8	0	0	109.9	W659 E673 E674 E679 F680 Q681 R712	W659-E677 WeakPolarHBondContact CH2-OE2 3.47Å; W659-E677 HydrophobicContact CZ2-CB 4.37Å; W659-E677 WeakPolarHBondContact CZ2-OE2 3.43Å; E673-E677 PolarHBondContact O-N 3.12Å; E674-E677 PolarHBondContact O-N 3.04Å; E677-E679 VanDerWaalsContact C-N 3.35Å; E677-E679 PolarHBondContact O-N 2.93Å; E677-F680 WeakPolarHBondContact O-CB 3.47Å; E677-F680 PolarHBondContact O-N 2.84Å; E677-F680 VanDerWaalsContact O-N 3.08Å; E677-Q681 HydrophobicContact CG-CG 4.08Å; E677-Q681 VanDerWaalsContact O-CG 3.24Å; E677-Q681 WeakPolarHBondContact O-CG 3.47Å; E677-Q681 PolarHBondContact O-N 3.02Å; E677-Q681 PolarHBondContact OE1-NE2 3.04Å; E677-R712 IonicContact OE2-CZ 2.62Å; E677-R712 IonicContact OE2-NH2 3.5Å; E677-R712 PolarHBondContact OE2-NH2 3.17Å
678	D	54.6	Low	54.1	Low	98 Å²	98	84.1 Å²	84.1	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-56.7	-41.5	177.2	-88.8	-12.5	0	0	0	113.1	E674 F680 Q681 N682	E674-D678 PolarHBondContact O-N 2.04Å; D678-F680 VanDerWaalsContact C-N 3.33Å; D678-F680 PolarHBondContact O-N 3.39Å; D678-Q681 PolarHBondContact O-N 3.29Å; D678-N682 VanDerWaalsContact O-CB 3.3Å; D678-N682 WeakPolarHBondContact O-CB 3.29Å; D678-N682 PolarHBondContact O-N 3.04Å; D678-N682 PolarHBondContact O-ND2 3.25Å
679	E	54.2	Low	55.8	Low	127 Å²	127	83.1 Å²	83.1	59%	0.593	43%	0.434	S	S	*	.	H	α-helix	trans	-63.7	-37.6	176.9	-170.3	175.1	-155.2	0	0	112.2	E675 E677 T683	E675-E679 PolarHBondContact O-N 2.65Å; E677-E679 VanDerWaalsContact C-N 3.35Å; E677-E679 PolarHBondContact O-N 2.93Å; E679-T683 WeakPolarHBondContact O-CB 3.41Å; E679-T683 PolarHBondContact O-N 2.82Å; E679-T683 PolarHBondContact O-OG1 3.02Å
680	F	59.2	Low	57.5	Low	25 Å²	25	86.1 Å²	86.1	11%	0.11	44%	0.444	C	S	.	.	H	α-helix	trans	-67.6	-52.9	175.4	-179.9	-114.6	0	0	0	111	W656 E677 D678 N682 T683 V684 E716	W656-F680 AromaticContact CD1-CE2 3.91Å; E677-F680 WeakPolarHBondContact O-CB 3.47Å; E677-F680 PolarHBondContact O-N 2.84Å; E677-F680 VanDerWaalsContact O-N 3.08Å; D678-F680 VanDerWaalsContact C-N 3.33Å; D678-F680 PolarHBondContact O-N 3.39Å; F680-N682 PolarHBondContact O-N 2.79Å; F680-T683 PolarHBondContact O-N 3.38Å; F680-V684 HydrophobicContact CD1-CG2 4.43Å; F680-V684 HydrophobicContact CD2-CG2 4.05Å; F680-V684 HydrophobicContact CE1-CG2 4.11Å; F680-V684 HydrophobicContact CE2-CG2 3.7Å; F680-V684 HydrophobicContact CG-CG2 4.4Å; F680-V684 HydrophobicContact CZ-CG2 3.73Å; F680-V684 WeakPolarHBondContact O-CG2 3.42Å; F680-V684 PolarHBondContact O-N 3.16Å; F680-E716 HydrophobicContact CD1-CG 4.49Å; F680-E716 HydrophobicContact CE1-CB 4.12Å; F680-E716 HydrophobicContact CE1-CG 3.91Å
681	Q	61.5	Low	58.9	Low	57 Å²	57	82.3 Å²	82.3	27%	0.266	43%	0.425	S	S	.	.	H	α-helix	trans	-53.4	-50.2	178.4	-67.7	-74.9	-23.4	0	0	112	E677 D678 T683 V684 A685 E716	E677-Q681 HydrophobicContact CG-CG 4.08Å; E677-Q681 VanDerWaalsContact O-CG 3.24Å; E677-Q681 WeakPolarHBondContact O-CG 3.47Å; E677-Q681 PolarHBondContact O-N 3.02Å; E677-Q681 PolarHBondContact OE1-NE2 3.04Å; D678-Q681 PolarHBondContact O-N 3.29Å; Q681-T683 VanDerWaalsContact C-N 3.25Å; Q681-T683 PolarHBondContact O-N 3.48Å; Q681-V684 PolarHBondContact O-N 3.17Å; Q681-A685 WeakPolarHBondContact O-CB 3.43Å; Q681-A685 PolarHBondContact O-N 2.03Å; Q681-A685 VanDerWaalsContact O-N 3.1Å; Q681-E716 VanDerWaalsContact NE2-CD 3.25Å; Q681-E716 PolarHBondContact NE2-OE2 3.23Å; Q681-E716 PolarHBondContact OE1-OE2 3.03Å
682	N	60.7	Low	60.7	Low	101 Å²	101	80.4 Å²	80.4	54%	0.54	41%	0.41	S	S	.	.	H	α-helix	trans	-60.7	-32.6	177.3	-81.7	-74	0	0	0	112.9	D678 F680 I686	D678-N682 VanDerWaalsContact O-CB 3.3Å; D678-N682 WeakPolarHBondContact O-CB 3.29Å; D678-N682 PolarHBondContact O-N 3.04Å; D678-N682 PolarHBondContact O-ND2 3.25Å; F680-N682 PolarHBondContact O-N 2.79Å; N682-I686 WeakPolarHBondContact O-CD1 3.34Å; N682-I686 VanDerWaalsContact O-CG1 3.32Å; N682-I686 WeakPolarHBondContact O-CG1 3.35Å
683	T	59.8	Low	62.8	Low	48 Å²	48	78.7 Å²	78.7	29%	0.294	40%	0.398	S	S	.	.	H	α-helix	trans	-81.7	-39	-178.1	-48.8	0	0	0	0	112.1	L652 E679 F680 Q681 A685 I686	L652-T683 HydrophobicContact CD1-CG2 3.99Å; L652-T683 HydrophobicContact CD2-CG2 3.55Å; L652-T683 HydrophobicContact CG-CG2 3.66Å; E679-T683 WeakPolarHBondContact O-CB 3.41Å; E679-T683 PolarHBondContact O-N 2.82Å; E679-T683 PolarHBondContact O-OG1 3.02Å; F680-T683 PolarHBondContact O-N 3.38Å; Q681-T683 VanDerWaalsContact C-N 3.25Å; Q681-T683 PolarHBondContact O-N 3.48Å; T683-A685 VanDerWaalsContact C-N 3.31Å; T683-A685 PolarHBondContact O-N 2.81Å; T683-I686 PolarHBondContact O-N 2.04Å
684	V	63.7	Low	64.3	Low	2 Å²	2	75 Å²	75	1%	0.012	39%	0.385	C	S	.	.	H	α-helix	trans	-63.9	-38.9	175.7	-177.9	0	0	0	0	110.6	F680 Q681 I686 L687 L692 L717 S720	F680-V684 HydrophobicContact CD1-CG2 4.43Å; F680-V684 HydrophobicContact CD2-CG2 4.05Å; F680-V684 HydrophobicContact CE1-CG2 4.11Å; F680-V684 HydrophobicContact CE2-CG2 3.7Å; F680-V684 HydrophobicContact CG-CG2 4.4Å; F680-V684 HydrophobicContact CZ-CG2 3.73Å; F680-V684 WeakPolarHBondContact O-CG2 3.42Å; F680-V684 PolarHBondContact O-N 3.16Å; Q681-V684 PolarHBondContact O-N 3.17Å; V684-I686 PolarHBondContact O-N 3.09Å; V684-L687 PolarHBondContact O-N 3.15Å; V684-L687 VanDerWaalsContact O-N 3.15Å; V684-L692 HydrophobicContact CG1-CD2 3.56Å; V684-L717 HydrophobicContact CG1-CD2 4.24Å; V684-S720 VanDerWaalsContact CG1-CB 3.45Å; V684-S720 WeakPolarHBondContact CG1-OG 3.43Å
685	A	65.8	Low	65.7	Low	78 Å²	78	71.3 Å²	71.3	65%	0.645	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-10.8	177.8	0	0	0	0	0	115.6	Q681 T683	Q681-A685 WeakPolarHBondContact O-CB 3.43Å; Q681-A685 PolarHBondContact O-N 2.03Å; Q681-A685 VanDerWaalsContact O-N 3.1Å; T683-A685 VanDerWaalsContact C-N 3.31Å; T683-A685 PolarHBondContact O-N 2.81Å
686	I	68.9	Low	67.5	Low	142 Å²	142	64.4 Å²	64.4	73%	0.728	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-16.9	179.5	-61.2	164.5	0	0	0	111.8	N682 T683 V684	N682-I686 WeakPolarHBondContact O-CD1 3.34Å; N682-I686 VanDerWaalsContact O-CG1 3.32Å; N682-I686 WeakPolarHBondContact O-CG1 3.35Å; T683-I686 PolarHBondContact O-N 2.04Å; V684-I686 PolarHBondContact O-N 3.09Å
687	L	63.8	Low	69	Low	29 Å²	29	62 Å²	62	15%	0.152	33%	0.327	C	S	.	.	S	Bend	trans	-71	140.8	-175.2	-73.3	173.7	0	0	0	112.6	L652 V684 D691 L692 F695	L652-L687 HydrophobicContact CD1-CD1 4.22Å; L652-L687 HydrophobicContact CD1-CD2 3.81Å; L652-L687 HydrophobicContact CD1-CG 4.33Å; V684-L687 PolarHBondContact O-N 3.15Å; V684-L687 VanDerWaalsContact O-N 3.15Å; L687-D691 HydrophobicContact CD2-CB 4.32Å; L687-L692 HydrophobicContact CB-CD2 3.82Å; L687-L692 HydrophobicContact CB-CG 3.83Å; L687-L692 HydrophobicContact CD1-CD2 3.99Å; L687-F695 HydrophobicContact CD1-CD2 4.06Å; L687-F695 HydrophobicContact CD1-CE2 4.02Å
688	P	73.3	Confident	70.3	Confident	73 Å²	73	64.3 Å²	64.3	47%	0.474	34%	0.337	S	S	.	.			trans	-68.1	151.3	171.7	31.1	-34.9	0	0	0	110.5	E690 D691 L692	P688-E690 PolarHBondContact O-N 2.8Å; P688-D691 WeakPolarHBondContact CD-OD2 3.17Å; P688-D691 HydrophobicContact CG-CB 4.02Å; P688-D691 WeakPolarHBondContact CG-OD2 3.31Å; P688-D691 PolarHBondContact O-N 3.22Å; P688-L692 PolarHBondContact O-N 3.06Å; P688-L692 VanDerWaalsContact O-N 3.09Å
689	K	74.6	Confident	71.7	Confident	109 Å²	109	60.3 Å²	60.3	47%	0.474	32%	0.316	S	S	.	.	H	α-helix	trans	-56.6	-29.9	-176.4	-164.9	-179	-179.5	-164.7	0	113.5	N693 G721 D723	K689-N693 VanDerWaalsContact O-CB 3.26Å; K689-N693 WeakPolarHBondContact O-CB 3.43Å; K689-N693 PolarHBondContact O-N 3.48Å; K689-N693 PolarHBondContact O-OD1 2.77Å; K689-G721 VanDerWaalsContact CE-O 3.24Å; K689-G721 WeakPolarHBondContact CE-O 3.47Å; K689-D723 IonicContact NZ-OD2 3.22Å; K689-D723 PolarHBondContact NZ-OD2 3.15Å
690	E	73	Confident	73.3	Confident	161 Å²	161	54.2 Å²	54.2	75%	0.752	29%	0.288	S	S	*	.	H	α-helix	trans	-67.1	-39.7	177.4	-64.4	-179	-170.8	0	0	112.1	P688 C694	P688-E690 PolarHBondContact O-N 2.8Å; E690-C694 PolarHBondContact O-N 3.46Å; E690-C694 VanDerWaalsContact O-N 3.15Å; E690-C694 PolarHBondContact O-SG 3.43Å
691	D	72.9	Confident	74.5	Confident	54 Å²	54	56.4 Å²	56.4	29%	0.289	30%	0.301	S	S	.	.	H	α-helix	trans	-71.2	-45.5	174.5	-69.8	-23.5	0	0	0	111	L687 P688 N693 C694 F695	L687-D691 HydrophobicContact CD2-CB 4.32Å; P688-D691 WeakPolarHBondContact CD-OD2 3.17Å; P688-D691 HydrophobicContact CG-CB 4.02Å; P688-D691 WeakPolarHBondContact CG-OD2 3.31Å; P688-D691 PolarHBondContact O-N 3.22Å; D691-N693 VanDerWaalsContact C-N 3.26Å; D691-N693 PolarHBondContact O-N 3.47Å; D691-C694 CarbonylContact O-C 3.6Å; D691-C694 WeakPolarHBondContact O-CA 3.32Å; D691-C694 WeakPolarHBondContact O-CB 3.49Å; D691-C694 PolarHBondContact O-N 2.87Å; D691-F695 HydrophobicContact CB-CD2 4.35Å; D691-F695 HydrophobicContact CB-CE2 4.3Å; D691-F695 WeakPolarHBondContact O-CD2 3.33Å; D691-F695 PolarHBondContact O-N 3.49Å
692	L	79.6	Confident	75.2	Confident	7 Å²	7	56.4 Å²	56.4	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-53.7	-43.5	175	-71.1	174.6	0	0	0	111.8	V684 L687 P688 F695 L696 L717 A722	V684-L692 HydrophobicContact CG1-CD2 3.56Å; L687-L692 HydrophobicContact CB-CD2 3.82Å; L687-L692 HydrophobicContact CB-CG 3.83Å; L687-L692 HydrophobicContact CD1-CD2 3.99Å; P688-L692 PolarHBondContact O-N 3.06Å; P688-L692 VanDerWaalsContact O-N 3.09Å; L692-F695 PolarHBondContact O-N 2.93Å; L692-L696 WeakPolarHBondContact O-CB 3.36Å; L692-L696 PolarHBondContact O-N 2.93Å; L692-L717 HydrophobicContact CD2-CD2 3.89Å; L692-A722 HydrophobicContact CB-CB 4.01Å
693	N	82.9	Confident	75.7	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.07	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-38.5	175.1	-76.7	2.4	0	0	0	112.8	K689 D691 I697 D723 N726	K689-N693 VanDerWaalsContact O-CB 3.26Å; K689-N693 WeakPolarHBondContact O-CB 3.43Å; K689-N693 PolarHBondContact O-N 3.48Å; K689-N693 PolarHBondContact O-OD1 2.77Å; D691-N693 VanDerWaalsContact C-N 3.26Å; D691-N693 PolarHBondContact O-N 3.47Å; N693-I697 PolarHBondContact O-N 3.41Å; N693-D723 PolarHBondContact OD1-N 3.34Å; N693-N726 HydrophobicContact CB-CB 4.27Å; N693-N726 PolarHBondContact ND2-OD1 2.96Å; N693-N726 VanDerWaalsContact ND2-OD1 3.12Å
694	C	77.5	Confident	76.3	Confident	45 Å²	45	56.3 Å²	56.3	30%	0.304	31%	0.307	S	S	.	.	H	α-helix	trans	-68.9	-44.6	175.9	-69.6	0	0	0	0	111.9	E690 D691 L696 I697 K698	E690-C694 PolarHBondContact O-N 3.46Å; E690-C694 VanDerWaalsContact O-N 3.15Å; E690-C694 PolarHBondContact O-SG 3.43Å; D691-C694 CarbonylContact O-C 3.6Å; D691-C694 WeakPolarHBondContact O-CA 3.32Å; D691-C694 WeakPolarHBondContact O-CB 3.49Å; D691-C694 PolarHBondContact O-N 2.87Å; C694-L696 VanDerWaalsContact C-N 3.32Å; C694-L696 PolarHBondContact O-N 3.23Å; C694-I697 PolarHBondContact O-N 3.34Å; C694-K698 WeakPolarHBondContact O-CB 3.26Å; C694-K698 PolarHBondContact O-N 3.43Å
695	F	78	Confident	76.7	Confident	60 Å²	60	61.8 Å²	61.8	26%	0.263	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-37.1	175.1	-78	-67.1	0	0	0	112.2	L687 D691 L692 K698 S699 L717	L687-F695 HydrophobicContact CD1-CD2 4.06Å; L687-F695 HydrophobicContact CD1-CE2 4.02Å; D691-F695 HydrophobicContact CB-CD2 4.35Å; D691-F695 HydrophobicContact CB-CE2 4.3Å; D691-F695 WeakPolarHBondContact O-CD2 3.33Å; D691-F695 PolarHBondContact O-N 3.49Å; L692-F695 PolarHBondContact O-N 2.93Å; F695-K698 PolarHBondContact O-N 3.27Å; F695-S699 WeakPolarHBondContact O-CB 3.49Å; F695-S699 PolarHBondContact O-N 3.35Å; F695-S699 PolarHBondContact O-OG 3.37Å; F695-L717 HydrophobicContact CB-CD1 4.06Å; F695-L717 HydrophobicContact CB-CD2 3.95Å
696	L	86.3	Confident	77.1	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-45.2	175.9	178.9	61.6	0	0	0	111.9	L692 C694 K698 S699 A700 I714 L717 I718 A722 P735 L751	L692-L696 WeakPolarHBondContact O-CB 3.36Å; L692-L696 PolarHBondContact O-N 2.93Å; C694-L696 VanDerWaalsContact C-N 3.32Å; C694-L696 PolarHBondContact O-N 3.23Å; L696-K698 VanDerWaalsContact C-N 3.34Å; L696-S699 PolarHBondContact O-N 3.26Å; L696-A700 WeakPolarHBondContact O-CB 3.25Å; L696-A700 PolarHBondContact O-N 3.36Å; L696-I714 HydrophobicContact CD1-CB 4.4Å; L696-I714 HydrophobicContact CD1-CG1 4.36Å; L696-I714 HydrophobicContact CD1-CG2 3.95Å; L696-L717 HydrophobicContact CB-CD1 4.43Å; L696-L717 HydrophobicContact CD1-CB 4.37Å; L696-I718 HydrophobicContact CD1-CD1 4.1Å; L696-I718 HydrophobicContact CD1-CG1 3.94Å; L696-I718 HydrophobicContact CD2-CD1 4.4Å; L696-I718 HydrophobicContact CD2-CG1 3.9Å; L696-A722 HydrophobicContact CB-CB 4.1Å; L696-A722 HydrophobicContact CD2-CB 3.85Å; L696-P735 HydrophobicContact CD2-CB 4.44Å; L696-P735 HydrophobicContact CD2-CG 3.8Å; L696-P735 HydrophobicContact CG-CB 4.19Å; L696-P735 HydrophobicContact CG-CG 3.86Å; L696-L751 HydrophobicContact CD1-CD2 4.39Å
697	I	84.2	Confident	77.5	Confident	23 Å²	23	57.6 Å²	57.6	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-36	177.8	-70.1	171.1	0	0	0	111.3	N693 C694 A700 N701 H728 P735	N693-I697 PolarHBondContact O-N 3.41Å; C694-I697 PolarHBondContact O-N 3.34Å; I697-A700 PolarHBondContact O-N 3.26Å; I697-N701 WeakPolarHBondContact O-CB 3.33Å; I697-N701 PolarHBondContact O-N 3.17Å; I697-N701 VanDerWaalsContact O-N 3.14Å; I697-H728 HydrophobicContact CD1-CB 3.43Å; I697-H728 VanDerWaalsContact CD1-CB 3.43Å; I697-P735 HydrophobicContact CG1-CB 4.47Å; I697-P735 HydrophobicContact CG1-CG 3.73Å
698	K	81.4	Confident	78.2	Confident	98 Å²	98	62.8 Å²	62.8	43%	0.426	34%	0.341	S	S	.	.	H	α-helix	trans	-66.8	-44.6	173.4	-176	175.4	175.7	-177.7	0	112.2	C694 F695 L696 A700 N701 D702	C694-K698 WeakPolarHBondContact O-CB 3.26Å; C694-K698 PolarHBondContact O-N 3.43Å; F695-K698 PolarHBondContact O-N 3.27Å; L696-K698 VanDerWaalsContact C-N 3.34Å; K698-A700 PolarHBondContact O-N 3.05Å; K698-N701 WeakPolarHBondContact O-CA 3.49Å; K698-N701 WeakPolarHBondContact O-CB 3.38Å; K698-N701 PolarHBondContact O-N 3.03Å; K698-D702 WeakPolarHBondContact CE-OD2 3.5Å; K698-D702 VanDerWaalsContact CG-OD2 3.31Å; K698-D702 WeakPolarHBondContact CG-OD2 3.43Å; K698-D702 PolarHBondContact O-N 2.79Å
699	S	84.8	Confident	78.2	Confident	13 Å²	13	60.6 Å²	60.6	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-28.1	178	-55.5	0	0	0	0	112.5	F695 L696 F704 Q710	F695-S699 WeakPolarHBondContact O-CB 3.49Å; F695-S699 PolarHBondContact O-N 3.35Å; F695-S699 PolarHBondContact O-OG 3.37Å; L696-S699 PolarHBondContact O-N 3.26Å; S699-F704 WeakPolarHBondContact O-CE2 3.37Å; S699-Q710 PolarHBondContact O-NE2 3.48Å
700	A	86.7	Confident	78.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.9	170.8	0	0	0	0	0	114.1	L696 I697 K698 P735 A739 L751	L696-A700 WeakPolarHBondContact O-CB 3.25Å; L696-A700 PolarHBondContact O-N 3.36Å; I697-A700 PolarHBondContact O-N 3.26Å; K698-A700 PolarHBondContact O-N 3.05Å; A700-P735 HydrophobicContact CB-CB 4.16Å; A700-P735 WeakPolarHBondContact CB-O 3.25Å; A700-A739 HydrophobicContact CB-CB 4.34Å; A700-A739 WeakPolarHBondContact O-CA 3.18Å; A700-A739 PolarHBondContact O-N 2.97Å; A700-L751 HydrophobicContact CB-CD1 4.29Å
701	N	84.2	Confident	79.3	Confident	70 Å²	70	49.2 Å²	49.2	37%	0.374	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-52.4	177.2	-179.8	79.4	0	0	0	112.2	I697 K698 T738 N742	I697-N701 WeakPolarHBondContact O-CB 3.33Å; I697-N701 PolarHBondContact O-N 3.17Å; I697-N701 VanDerWaalsContact O-N 3.14Å; K698-N701 WeakPolarHBondContact O-CA 3.49Å; K698-N701 WeakPolarHBondContact O-CB 3.38Å; K698-N701 PolarHBondContact O-N 3.03Å; N701-T738 HydrophobicContact CB-CG2 3.58Å; N701-N742 PolarHBondContact O-ND2 2.82Å; N701-N742 PolarHBondContact OD1-ND2 3.44Å
702	D	76.8	Confident	79.8	Confident	58 Å²	58	53.1 Å²	53.1	31%	0.31	29%	0.288	S	S	.	.	S	Bend	trans	-69.3	150.3	-167	-65.2	-0.9	0	0	0	111	K698 F704 Q710 Q744	K698-D702 WeakPolarHBondContact CE-OD2 3.5Å; K698-D702 VanDerWaalsContact CG-OD2 3.31Å; K698-D702 WeakPolarHBondContact CG-OD2 3.43Å; K698-D702 PolarHBondContact O-N 2.79Å; D702-F704 HydrophobicContact CB-CE2 4.06Å; D702-F704 VanDerWaalsContact O-CD2 3.27Å; D702-F704 WeakPolarHBondContact O-CD2 3.34Å; D702-F704 WeakPolarHBondContact O-CE2 3.44Å; D702-Q710 PolarHBondContact O-NE2 3.25Å; D702-Q710 VanDerWaalsContact O-NE2 3.16Å; D702-Q744 PolarHBondContact O-NE2 3.11Å
703	S	72.4	Confident	79.8	Confident	109 Å²	109	53.1 Å²	53.1	76%	0.762	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-93.2	122.5	178.2	-165.2	0	0	0	0	110.4
704	F	72.3	Confident	79.9	Confident	37 Å²	37	52.5 Å²	52.5	16%	0.162	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-101	141	-178.3	-67.9	-115.3	0	0	0	109.7	W656 S699 D702 N706 T709 Q710 I713	W656-F704 HydrophobicContact CH2-CE1 4.04Å; W656-F704 HydrophobicContact CZ2-CD1 4.5Å; W656-F704 AromaticContact CZ2-CE1 3.78Å; W656-F704 HydrophobicContact CZ2-CE1 3.78Å; S699-F704 WeakPolarHBondContact O-CE2 3.37Å; D702-F704 HydrophobicContact CB-CE2 4.06Å; D702-F704 VanDerWaalsContact O-CD2 3.27Å; D702-F704 WeakPolarHBondContact O-CD2 3.34Å; D702-F704 WeakPolarHBondContact O-CE2 3.44Å; F704-N706 PolarHBondContact O-N 2.79Å; F704-T709 HydrophobicContact CD1-CG2 4.49Å; F704-Q710 HydrophobicContact CB-CB 3.95Å; F704-Q710 HydrophobicContact CD1-CB 3.93Å; F704-Q710 HydrophobicContact CD2-CB 3.66Å; F704-Q710 VanDerWaalsContact CD2-CD 3.49Å; F704-Q710 HydrophobicContact CD2-CG 3.52Å; F704-Q710 HydrophobicContact CE1-CB 4.33Å; F704-Q710 HydrophobicContact CE2-CB 4.13Å; F704-Q710 HydrophobicContact CE2-CG 3.64Å; F704-Q710 HydrophobicContact CG-CB 3.59Å; F704-Q710 HydrophobicContact CG-CG 4.01Å; F704-Q710 HydrophobicContact CZ-CB 4.43Å; F704-Q710 HydrophobicContact CZ-CG 4.19Å; F704-I713 HydrophobicContact CE1-CD1 3.75Å
705	S	70.5	Confident	80.5	Confident	117 Å²	117	53 Å²	53	82%	0.818	29%	0.285	S	S	*	.	S	Bend	trans	-65	-26.2	173	48.5	0	0	0	0	112.8
706	N	74.9	Confident	80.6	Confident	64 Å²	64	51.6 Å²	51.6	34%	0.342	28%	0.279	S	S	.	.			trans	-122.3	113.9	169.7	-177.5	10.7	0	0	0	110.8	F704 E708 T709 Q710	F704-N706 PolarHBondContact O-N 2.79Å; N706-E708 PolarHBondContact O-N 3.22Å; N706-E708 WeakPolarHBondContact OD1-CB 3.16Å; N706-E708 PolarHBondContact OD1-N 3.28Å; N706-T709 PolarHBondContact ND2-OG1 3.03Å; N706-T709 VanDerWaalsContact ND2-OG1 3.15Å; N706-T709 WeakPolarHBondContact O-CB 3.32Å; N706-T709 PolarHBondContact O-N 2.87Å; N706-Q710 PolarHBondContact O-N 3.48Å
707	P	77.3	Confident	80.5	Confident	68 Å²	68	51.9 Å²	51.9	44%	0.442	28%	0.28	S	S	.	.	H	α-helix	trans	-59.9	-29	173.3	-25.2	35.4	0	0	0	114.1	Q710 C711 A746	P707-Q710 WeakPolarHBondContact O-CB 3.49Å; P707-Q710 PolarHBondContact O-N 3.27Å; P707-C711 WeakPolarHBondContact O-CB 3.35Å; P707-C711 PolarHBondContact O-N 2.83Å; P707-C711 PolarHBondContact O-SG 3.34Å; P707-C711 VanDerWaalsContact O-SG 3.4Å; P707-A746 HydrophobicContact CB-CB 4.14Å
708	E	77.8	Confident	80.8	Confident	139 Å²	139	51.9 Å²	51.9	65%	0.65	28%	0.28	S	S	*	.	H	α-helix	trans	-68.7	-37	177.8	-172.6	172.5	-146.8	0	0	111.6	N706 C711 R712	N706-E708 PolarHBondContact O-N 3.22Å; N706-E708 WeakPolarHBondContact OD1-CB 3.16Å; N706-E708 PolarHBondContact OD1-N 3.28Å; E708-C711 PolarHBondContact O-N 3.41Å; E708-R712 PolarHBondContact O-N 2.92Å
709	T	74.4	Confident	81.1	Confident	26 Å²	26	50.3 Å²	50.3	16%	0.16	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-44.2	170.7	-59.4	0	0	0	0	111.2	N660 F704 N706 C711 R712 I713	N660-T709 VanDerWaalsContact OD1-CG2 3.31Å; N660-T709 WeakPolarHBondContact OD1-CG2 3.45Å; F704-T709 HydrophobicContact CD1-CG2 4.49Å; N706-T709 PolarHBondContact ND2-OG1 3.03Å; N706-T709 VanDerWaalsContact ND2-OG1 3.15Å; N706-T709 WeakPolarHBondContact O-CB 3.32Å; N706-T709 PolarHBondContact O-N 2.87Å; T709-C711 VanDerWaalsContact C-N 3.33Å; T709-C711 PolarHBondContact O-N 3.29Å; T709-R712 PolarHBondContact O-N 3.05Å; T709-I713 HydrophobicContact CG2-CD1 3.87Å; T709-I713 WeakPolarHBondContact O-CD1 3.42Å; T709-I713 WeakPolarHBondContact O-CG1 3.29Å; T709-I713 PolarHBondContact O-N 3.24Å; T709-I713 VanDerWaalsContact O-N 3.17Å
710	Q	84.4	Confident	80.9	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-46.2	174.2	-174.6	175.9	34.5	0	0	111.3	S699 D702 F704 N706 P707 I713 I714	S699-Q710 PolarHBondContact O-NE2 3.48Å; D702-Q710 PolarHBondContact O-NE2 3.25Å; D702-Q710 VanDerWaalsContact O-NE2 3.16Å; F704-Q710 HydrophobicContact CB-CB 3.95Å; F704-Q710 HydrophobicContact CD1-CB 3.93Å; F704-Q710 HydrophobicContact CD2-CB 3.66Å; F704-Q710 VanDerWaalsContact CD2-CD 3.49Å; F704-Q710 HydrophobicContact CD2-CG 3.52Å; F704-Q710 HydrophobicContact CE1-CB 4.33Å; F704-Q710 HydrophobicContact CE2-CB 4.13Å; F704-Q710 HydrophobicContact CE2-CG 3.64Å; F704-Q710 HydrophobicContact CG-CB 3.59Å; F704-Q710 HydrophobicContact CG-CG 4.01Å; F704-Q710 HydrophobicContact CZ-CB 4.43Å; F704-Q710 HydrophobicContact CZ-CG 4.19Å; N706-Q710 PolarHBondContact O-N 3.48Å; P707-Q710 WeakPolarHBondContact O-CB 3.49Å; P707-Q710 PolarHBondContact O-N 3.27Å; Q710-I713 PolarHBondContact O-N 2.75Å; Q710-I714 HydrophobicContact CG-CD1 3.88Å; Q710-I714 WeakPolarHBondContact O-CG1 3.32Å; Q710-I714 PolarHBondContact O-N 3.32Å
711	C	86.6	Confident	80.8	Confident	29 Å²	29	53.1 Å²	53.1	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-50.8	177	-76.6	0	0	0	0	111.8	P707 E708 T709 I713 I714 D715 L750	P707-C711 WeakPolarHBondContact O-CB 3.35Å; P707-C711 PolarHBondContact O-N 2.83Å; P707-C711 PolarHBondContact O-SG 3.34Å; P707-C711 VanDerWaalsContact O-SG 3.4Å; E708-C711 PolarHBondContact O-N 3.41Å; T709-C711 VanDerWaalsContact C-N 3.33Å; T709-C711 PolarHBondContact O-N 3.29Å; C711-I713 VanDerWaalsContact C-N 3.27Å; C711-I713 PolarHBondContact O-N 2.93Å; C711-I714 PolarHBondContact O-N 2.97Å; C711-D715 VanDerWaalsContact O-CB 3.29Å; C711-D715 WeakPolarHBondContact O-CB 3.43Å; C711-D715 PolarHBondContact O-N 3.45Å; C711-L750 HydrophobicContact CB-CD2 3.8Å; C711-L750 WeakPolarHBondContact O-CD2 3.5Å
712	R	82.1	Confident	80.8	Confident	137 Å²	137	50.1 Å²	50.1	52%	0.517	29%	0.292	S	S	.	.	H	α-helix	trans	-53.1	-43.9	177.2	-77.7	175.2	67.9	172.3	-0.6	112.5	E677 E708 T709 D715 E716	E677-R712 IonicContact OE2-CZ 2.62Å; E677-R712 IonicContact OE2-NH2 3.5Å; E677-R712 PolarHBondContact OE2-NH2 3.17Å; E708-R712 PolarHBondContact O-N 2.92Å; T709-R712 PolarHBondContact O-N 3.05Å; R712-D715 PolarHBondContact O-N 2.98Å; R712-E716 WeakPolarHBondContact O-CB 3.17Å; R712-E716 PolarHBondContact O-N 2.86Å
713	I	79.3	Confident	81.4	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-69.7	-42.1	-178.6	-65.4	158.1	0	0	0	111.8	W656 F704 T709 Q710 C711 D715 L717	W656-I713 HydrophobicContact CZ2-CD1 3.45Å; W656-I713 VanDerWaalsContact CZ2-CD1 3.45Å; F704-I713 HydrophobicContact CE1-CD1 3.75Å; T709-I713 HydrophobicContact CG2-CD1 3.87Å; T709-I713 WeakPolarHBondContact O-CD1 3.42Å; T709-I713 WeakPolarHBondContact O-CG1 3.29Å; T709-I713 PolarHBondContact O-N 3.24Å; T709-I713 VanDerWaalsContact O-N 3.17Å; Q710-I713 PolarHBondContact O-N 2.75Å; C711-I713 VanDerWaalsContact C-N 3.27Å; C711-I713 PolarHBondContact O-N 2.93Å; I713-D715 VanDerWaalsContact C-N 3.35Å; I713-L717 HydrophobicContact CG2-CD1 3.85Å; I713-L717 HydrophobicContact CG2-CG 4.43Å; I713-L717 WeakPolarHBondContact O-CB 3.42Å; I713-L717 WeakPolarHBondContact O-CD1 3.3Å; I713-L717 VanDerWaalsContact O-CG 3.23Å; I713-L717 WeakPolarHBondContact O-CG 3.47Å; I713-L717 PolarHBondContact O-N 2.87Å
714	I	87	Confident	82.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-41.7	175	-72	174.5	0	0	0	110.8	L696 Q710 C711 I718 A747 L750 L751	L696-I714 HydrophobicContact CD1-CB 4.4Å; L696-I714 HydrophobicContact CD1-CG1 4.36Å; L696-I714 HydrophobicContact CD1-CG2 3.95Å; Q710-I714 HydrophobicContact CG-CD1 3.88Å; Q710-I714 WeakPolarHBondContact O-CG1 3.32Å; Q710-I714 PolarHBondContact O-N 3.32Å; C711-I714 PolarHBondContact O-N 2.97Å; I714-I718 HydrophobicContact CG2-CD1 3.96Å; I714-I718 WeakPolarHBondContact O-CD1 3.49Å; I714-I718 VanDerWaalsContact O-CG1 3.26Å; I714-I718 WeakPolarHBondContact O-CG1 3.48Å; I714-I718 PolarHBondContact O-N 3.36Å; I714-A747 HydrophobicContact CD1-CB 3.64Å; I714-L750 HydrophobicContact CB-CD2 3.95Å; I714-L750 HydrophobicContact CG2-CD2 3.76Å; I714-L750 HydrophobicContact CG2-CG 4.3Å; I714-L751 HydrophobicContact CG2-CD2 3.89Å; I714-L751 HydrophobicContact CG2-CG 4.27Å
715	D	88.4	Confident	83.3	Confident	56 Å²	56	46.3 Å²	46.3	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-46.2	179.1	-150.5	56.9	0	0	0	110.6	C711 R712 I713 I718 S719 L750 R754	C711-D715 VanDerWaalsContact O-CB 3.29Å; C711-D715 WeakPolarHBondContact O-CB 3.43Å; C711-D715 PolarHBondContact O-N 3.45Å; R712-D715 PolarHBondContact O-N 2.98Å; I713-D715 VanDerWaalsContact C-N 3.35Å; D715-I718 PolarHBondContact O-N 3.35Å; D715-S719 PolarHBondContact O-N 3.1Å; D715-S719 PolarHBondContact O-OG 3.22Å; D715-L750 HydrophobicContact CB-CD2 4.08Å; D715-L750 WeakPolarHBondContact OD1-CD1 3.39Å; D715-R754 VanDerWaalsContact O-CZ 3.28Å; D715-R754 PolarHBondContact O-NH1 2.75Å; D715-R754 PolarHBondContact O-NH2 3.49Å; D715-R754 IonicContact OD1-CZ 2.96Å; D715-R754 IonicContact OD1-NE 3.93Å; D715-R754 PolarHBondContact OD1-NE 3.42Å; D715-R754 IonicContact OD1-NH2 2.58Å; D715-R754 PolarHBondContact OD1-NH2 2.04Å; D715-R754 IonicContact OD2-CZ 2.76Å; D715-R754 IonicContact OD2-NE 3.94Å; D715-R754 IonicContact OD2-NH2 2.69Å; D715-R754 PolarHBondContact OD2-NH2 3.35Å
716	E	81.1	Confident	84	Confident	30 Å²	30	42.3 Å²	42.3	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-71.1	-43.4	179.9	-171.9	47.3	-113.2	0	0	113.1	F680 Q681 R712 I718 S719 S720	F680-E716 HydrophobicContact CD1-CG 4.49Å; F680-E716 HydrophobicContact CE1-CB 4.12Å; F680-E716 HydrophobicContact CE1-CG 3.91Å; Q681-E716 VanDerWaalsContact NE2-CD 3.25Å; Q681-E716 PolarHBondContact NE2-OE2 3.23Å; Q681-E716 PolarHBondContact OE1-OE2 3.03Å; R712-E716 WeakPolarHBondContact O-CB 3.17Å; R712-E716 PolarHBondContact O-N 2.86Å; E716-I718 PolarHBondContact O-N 3.45Å; E716-I718 VanDerWaalsContact O-N 3.14Å; E716-S719 WeakPolarHBondContact O-CB 3.38Å; E716-S719 PolarHBondContact O-N 3.06Å; E716-S719 WeakPolarHBondContact OE1-CB 3.28Å; E716-S720 WeakPolarHBondContact O-CB 3.29Å; E716-S720 PolarHBondContact O-N 2.81Å; E716-S720 PolarHBondContact OE1-OG 2.79Å
717	L	84.2	Confident	84.4	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-54.6	-38.8	174.8	-75	166.8	0	0	0	111.3	V684 L692 F695 L696 I713 G721 A722	V684-L717 HydrophobicContact CG1-CD2 4.24Å; L692-L717 HydrophobicContact CD2-CD2 3.89Å; F695-L717 HydrophobicContact CB-CD1 4.06Å; F695-L717 HydrophobicContact CB-CD2 3.95Å; L696-L717 HydrophobicContact CB-CD1 4.43Å; L696-L717 HydrophobicContact CD1-CB 4.37Å; I713-L717 HydrophobicContact CG2-CD1 3.85Å; I713-L717 HydrophobicContact CG2-CG 4.43Å; I713-L717 WeakPolarHBondContact O-CB 3.42Å; I713-L717 WeakPolarHBondContact O-CD1 3.3Å; I713-L717 VanDerWaalsContact O-CG 3.23Å; I713-L717 WeakPolarHBondContact O-CG 3.47Å; I713-L717 PolarHBondContact O-N 2.87Å; L717-G721 PolarHBondContact O-N 3.32Å; L717-A722 HydrophobicContact CB-CB 4.23Å; L717-A722 WeakPolarHBondContact O-CA 3.42Å; L717-A722 WeakPolarHBondContact O-CB 3.2Å; L717-A722 PolarHBondContact O-N 3.16Å
718	I	89.9	Confident	84	Confident	23 Å²	23	45.3 Å²	45.3	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-74.2	-39.1	176	-61.8	166.6	0	0	0	111.7	L696 I714 D715 E716 S720 G721 V724 L751 R754	L696-I718 HydrophobicContact CD1-CD1 4.1Å; L696-I718 HydrophobicContact CD1-CG1 3.94Å; L696-I718 HydrophobicContact CD2-CD1 4.4Å; L696-I718 HydrophobicContact CD2-CG1 3.9Å; I714-I718 HydrophobicContact CG2-CD1 3.96Å; I714-I718 WeakPolarHBondContact O-CD1 3.49Å; I714-I718 VanDerWaalsContact O-CG1 3.26Å; I714-I718 WeakPolarHBondContact O-CG1 3.48Å; I714-I718 PolarHBondContact O-N 3.36Å; D715-I718 PolarHBondContact O-N 3.35Å; E716-I718 PolarHBondContact O-N 3.45Å; E716-I718 VanDerWaalsContact O-N 3.14Å; I718-S720 VanDerWaalsContact C-N 3.31Å; I718-S720 PolarHBondContact O-N 3.02Å; I718-G721 PolarHBondContact O-N 3.5Å; I718-G721 VanDerWaalsContact O-N 3.08Å; I718-V724 HydrophobicContact CD1-CB 4.26Å; I718-V724 HydrophobicContact CD1-CG2 3.83Å; I718-L751 HydrophobicContact CD1-CD2 4Å; I718-R754 HydrophobicContact CD1-CB 3.83Å; I718-R754 HydrophobicContact CD1-CG 3.98Å; I718-R754 HydrophobicContact CG2-CB 4.3Å; I718-R754 HydrophobicContact CG2-CG 4.37Å
719	S	88.1	Confident	83.2	Confident	64 Å²	64	41 Å²	41	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-44.5	173.6	-64.2	0	0	0	0	111.8	D715 E716 G721 R754	D715-S719 PolarHBondContact O-N 3.1Å; D715-S719 PolarHBondContact O-OG 3.22Å; E716-S719 WeakPolarHBondContact O-CB 3.38Å; E716-S719 PolarHBondContact O-N 3.06Å; E716-S719 WeakPolarHBondContact OE1-CB 3.28Å; S719-G721 PolarHBondContact O-N 3.14Å; S719-R754 VanDerWaalsContact N-NH1 3.18Å; S719-R754 PolarHBondContact OG-NH1 3.02Å; S719-R754 VanDerWaalsContact OG-NH1 3.14Å; S719-R754 PolarHBondContact OG-NH2 3.04Å
720	S	80.8	Confident	82.4	Confident	36 Å²	36	47.1 Å²	47.1	25%	0.252	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	4.5	175.8	-72.4	0	0	0	0	114.3	V684 E716 I718	V684-S720 VanDerWaalsContact CG1-CB 3.45Å; V684-S720 WeakPolarHBondContact CG1-OG 3.43Å; E716-S720 WeakPolarHBondContact O-CB 3.29Å; E716-S720 PolarHBondContact O-N 2.81Å; E716-S720 PolarHBondContact OE1-OG 2.79Å; I718-S720 VanDerWaalsContact C-N 3.31Å; I718-S720 PolarHBondContact O-N 3.02Å
721	G	83.6	Confident	81.3	Confident	37 Å²	37	52.2 Å²	52.2	38%	0.381	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	12.5	167.1	0	0	0	0	0	116.7	K689 L717 I718 S719	K689-G721 VanDerWaalsContact CE-O 3.24Å; K689-G721 WeakPolarHBondContact CE-O 3.47Å; L717-G721 PolarHBondContact O-N 3.32Å; I718-G721 PolarHBondContact O-N 3.5Å; I718-G721 VanDerWaalsContact O-N 3.08Å; S719-G721 PolarHBondContact O-N 3.14Å
722	A	84.7	Confident	80.9	Confident	6 Å²	6	54.8 Å²	54.8	5%	0.05	29%	0.294	C	S	.	.			trans	-59.3	137.6	165.4	0	0	0	0	0	110.4	L692 L696 L717 V724	L692-A722 HydrophobicContact CB-CB 4.01Å; L696-A722 HydrophobicContact CB-CB 4.1Å; L696-A722 HydrophobicContact CD2-CB 3.85Å; L717-A722 HydrophobicContact CB-CB 4.23Å; L717-A722 WeakPolarHBondContact O-CA 3.42Å; L717-A722 WeakPolarHBondContact O-CB 3.2Å; L717-A722 PolarHBondContact O-N 3.16Å; A722-V724 PolarHBondContact O-N 3.25Å
723	D	89.3	Confident	80.9	Confident	59 Å²	59	48.8 Å²	48.8	32%	0.316	27%	0.273	S	S	.	.			trans	-84.2	105.9	-179	-168.9	-34	0	0	0	110.3	K689 N693 N725 N726	K689-D723 IonicContact NZ-OD2 3.22Å; K689-D723 PolarHBondContact NZ-OD2 3.15Å; N693-D723 PolarHBondContact OD1-N 3.34Å; D723-N725 PolarHBondContact O-N 2.95Å; D723-N725 PolarHBondContact OD1-N 3.18Å; D723-N726 HydrophobicContact CB-CB 4.05Å; D723-N726 WeakPolarHBondContact O-CB 3.4Å; D723-N726 PolarHBondContact O-N 2.95Å; D723-N726 PolarHBondContact OD1-N 3.1Å
724	V	91.9	Very high	81.5	Confident	14 Å²	14	48.6 Å²	48.6	9%	0.085	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.5	179.9	74.1	0	0	0	0	113.7	I718 A722 L751 R754 A756	I718-V724 HydrophobicContact CD1-CB 4.26Å; I718-V724 HydrophobicContact CD1-CG2 3.83Å; A722-V724 PolarHBondContact O-N 3.25Å; V724-L751 HydrophobicContact CG2-CD2 3.8Å; V724-R754 HydrophobicContact CG2-CB 4.44Å; V724-A756 HydrophobicContact CG2-CB 3.93Å
725	N	92.1	Very high	81.7	Confident	51 Å²	51	48.6 Å²	48.6	27%	0.273	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	6	-178.5	-72.1	-46.1	0	0	0	113.6	D723 G755 A756 D757 L760	D723-N725 PolarHBondContact O-N 2.95Å; D723-N725 PolarHBondContact OD1-N 3.18Å; N725-G755 PolarHBondContact ND2-O 3.05Å; N725-A756 WeakPolarHBondContact OD1-CA 3.01Å; N725-D757 PolarHBondContact OD1-N 3.12Å; N725-L760 HydrophobicContact CB-CD1 3.67Å; N725-L760 WeakPolarHBondContact OD1-CD1 3.42Å
726	N	85.9	Confident	82	Confident	34 Å²	34	46 Å²	46	18%	0.182	26%	0.258	C	S	.	.			trans	-57.5	141	177.4	-177.5	67.6	0	0	0	112.3	N693 D723 T734 P735	N693-N726 HydrophobicContact CB-CB 4.27Å; N693-N726 PolarHBondContact ND2-OD1 2.96Å; N693-N726 VanDerWaalsContact ND2-OD1 3.12Å; D723-N726 HydrophobicContact CB-CB 4.05Å; D723-N726 WeakPolarHBondContact O-CB 3.4Å; D723-N726 PolarHBondContact O-N 2.95Å; D723-N726 PolarHBondContact OD1-N 3.1Å; N726-T734 WeakPolarHBondContact O-CA 3.44Å; N726-P735 WeakPolarHBondContact O-CD 3.17Å
727	R	83.1	Confident	82.5	Confident	95 Å²	95	44.6 Å²	44.6	36%	0.358	25%	0.252	S	S	.	.			trans	-111	119.5	174.1	-61.6	-171.9	-163.8	178.9	10.1	109.5	M732 S733 T734 K761	R727-M732 HydrophobicContact CB-CB 4.2Å; R727-M732 HydrophobicContact CB-CE 4.29Å; R727-S733 WeakPolarHBondContact CA-O 3.35Å; R727-T734 HydrophobicContact CG-CG2 3.81Å; R727-K761 PolarHBondContact NH1-O 3.24Å
728	H	69	Low	82.9	Confident	99 Å²	99	44.8 Å²	44.8	46%	0.458	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-136	171.3	-178.5	-157.3	77.1	0	0	0	112.8	I697 S733	I697-H728 HydrophobicContact CD1-CB 3.43Å; I697-H728 VanDerWaalsContact CD1-CB 3.43Å; H728-S733 PolarHBondContact N-O 3.37Å; H728-S733 VanDerWaalsContact N-O 3.13Å; H728-S733 PolarHBondContact O-N 3.14Å; H728-S733 VanDerWaalsContact O-N 3.15Å
729	G	61.3	Low	83	Confident	49 Å²	49	43.7 Å²	43.7	51%	0.505	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	178.6	177.1	0	0	0	0	0	114.1	H731 M732	G729-H731 PolarHBondContact O-N 3.03Å; G729-M732 PolarHBondContact O-N 3.31Å; G729-M732 VanDerWaalsContact O-N 3.09Å
730	L	57.4	Low	83.3	Confident	154 Å²	154	40.7 Å²	40.7	81%	0.806	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.9	-173.9	-79.1	160.8	0	0	0	115.2	L763	L730-L763 WeakPolarHBondContact O-CD1 3.12Å
731	H	62.1	Low	83.8	Confident	110 Å²	110	42.3 Å²	42.3	51%	0.509	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	0.5	-178	-54.4	-67.8	0	0	0	114	G729 S733 D762 L763	G729-H731 PolarHBondContact O-N 3.03Å; H731-S733 PolarHBondContact O-N 3.16Å; H731-D762 WeakPolarHBondContact O-CB 3.37Å; H731-L763 PolarHBondContact O-N 3.37Å
732	M	77	Confident	84.1	Confident	83 Å²	83	43.8 Å²	43.8	41%	0.409	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	40.9	-168.9	-61.7	-169.6	66.8	0	0	113.1	R727 G729 L763	R727-M732 HydrophobicContact CB-CB 4.2Å; R727-M732 HydrophobicContact CB-CE 4.29Å; G729-M732 PolarHBondContact O-N 3.31Å; G729-M732 VanDerWaalsContact O-N 3.09Å; M732-L763 HydrophobicContact CB-CD2 4.37Å; M732-L763 HydrophobicContact CB-CG 4.09Å; M732-L763 HydrophobicContact CG-CD1 4.43Å; M732-L763 HydrophobicContact CG-CD2 3.87Å; M732-L763 HydrophobicContact CG-CG 3.88Å; M732-L763 HydrophobicContact SD-CD2 3.61Å; M732-L763 HydrophobicContact SD-CG 4.3Å
733	S	82.1	Confident	84.4	Confident	11 Å²	11	48.9 Å²	48.9	8%	0.077	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-74.1	143.2	-178.8	-160.2	0	0	0	0	110.9	R727 H728 H731 I737 T738	R727-S733 WeakPolarHBondContact CA-O 3.35Å; H728-S733 PolarHBondContact N-O 3.37Å; H728-S733 VanDerWaalsContact N-O 3.13Å; H728-S733 PolarHBondContact O-N 3.14Å; H728-S733 VanDerWaalsContact O-N 3.15Å; H731-S733 PolarHBondContact O-N 3.16Å; S733-I737 WeakPolarHBondContact OG-CG2 3.36Å; S733-T738 WeakPolarHBondContact CB-OG1 3.44Å; S733-T738 PolarHBondContact OG-OG1 3.16Å
734	T	91.7	Very high	84.4	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	24%	0.241	C	C	.	.			trans	-87.1	160.3	167.8	59.8	0	0	0	0	110.7	N726 R727 L736 I737 T738 L760	N726-T734 WeakPolarHBondContact O-CA 3.44Å; R727-T734 HydrophobicContact CG-CG2 3.81Å; T734-L736 PolarHBondContact O-N 2.77Å; T734-I737 PolarHBondContact O-N 3.24Å; T734-I737 WeakPolarHBondContact OG1-CG1 3.21Å; T734-I737 PolarHBondContact OG1-N 3.24Å; T734-I737 VanDerWaalsContact OG1-N 3.11Å; T734-T738 WeakPolarHBondContact O-CB 3.04Å; T734-T738 PolarHBondContact O-N 2.84Å; T734-T738 PolarHBondContact O-OG1 3.14Å; T734-L760 HydrophobicContact CG2-CB 3.81Å; T734-L760 HydrophobicContact CG2-CD1 3.71Å; T734-L760 HydrophobicContact CG2-CG 4.42Å
735	P	91.2	Very high	84.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-49.1	-43	169.8	-26.5	32.3	0	0	0	112.4	L696 I697 A700 N726 T738 A739 L751	L696-P735 HydrophobicContact CD2-CB 4.44Å; L696-P735 HydrophobicContact CD2-CG 3.8Å; L696-P735 HydrophobicContact CG-CB 4.19Å; L696-P735 HydrophobicContact CG-CG 3.86Å; I697-P735 HydrophobicContact CG1-CB 4.47Å; I697-P735 HydrophobicContact CG1-CG 3.73Å; A700-P735 HydrophobicContact CB-CB 4.16Å; A700-P735 WeakPolarHBondContact CB-O 3.25Å; N726-P735 WeakPolarHBondContact O-CD 3.17Å; P735-T738 PolarHBondContact O-N 3.41Å; P735-A739 WeakPolarHBondContact O-CB 3.39Å; P735-A739 PolarHBondContact O-N 3.3Å; P735-L751 HydrophobicContact CB-CD1 3.95Å; P735-L751 HydrophobicContact CB-CD2 3.86Å
736	L	94.7	Very high	84.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-45.6	-179.6	180	61.8	0	0	0	112.8	T734 T738 A739 V740 I748 L751 L752 A756 P758 A768	T734-L736 PolarHBondContact O-N 2.77Å; L736-T738 VanDerWaalsContact C-N 3.28Å; L736-T738 PolarHBondContact O-N 2.85Å; L736-A739 PolarHBondContact O-N 3.46Å; L736-V740 HydrophobicContact CD1-CG2 4.41Å; L736-V740 WeakPolarHBondContact O-CB 3.41Å; L736-V740 VanDerWaalsContact O-CG2 3.28Å; L736-V740 WeakPolarHBondContact O-CG2 3.05Å; L736-V740 PolarHBondContact O-N 3.34Å; L736-I748 HydrophobicContact CD1-CG2 3.97Å; L736-L751 HydrophobicContact CD1-CB 4.34Å; L736-L752 HydrophobicContact CD1-CD1 4.48Å; L736-L752 HydrophobicContact CD1-CD2 4.37Å; L736-L752 HydrophobicContact CD1-CG 4.06Å; L736-L752 HydrophobicContact CD2-CD2 3.76Å; L736-L752 HydrophobicContact CD2-CG 4.35Å; L736-A756 HydrophobicContact CB-CB 4.02Å; L736-A756 HydrophobicContact CD2-CB 3.82Å; L736-A756 HydrophobicContact CG-CB 4.41Å; L736-P758 HydrophobicContact CD2-CB 4.07Å; L736-A768 HydrophobicContact CD2-CB 4.15Å; L736-A768 HydrophobicContact CG-CB 4.19Å
737	I	93.4	Very high	84.5	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-38.8	175.8	-74.9	166.7	0	0	0	110.7	S733 T734 V740 K741 L760 D762 A768 H771	S733-I737 WeakPolarHBondContact OG-CG2 3.36Å; T734-I737 PolarHBondContact O-N 3.24Å; T734-I737 WeakPolarHBondContact OG1-CG1 3.21Å; T734-I737 PolarHBondContact OG1-N 3.24Å; T734-I737 VanDerWaalsContact OG1-N 3.11Å; I737-V740 PolarHBondContact O-N 3.33Å; I737-K741 HydrophobicContact CG2-CD 3.81Å; I737-K741 HydrophobicContact CG2-CG 4.36Å; I737-K741 VanDerWaalsContact CG2-NZ 3.33Å; I737-K741 WeakPolarHBondContact O-CB 3.42Å; I737-K741 VanDerWaalsContact O-CG 3.29Å; I737-K741 WeakPolarHBondContact O-CG 3.24Å; I737-K741 PolarHBondContact O-N 3.41Å; I737-L760 WeakPolarHBondContact CD1-O 3.27Å; I737-D762 HydrophobicContact CD1-CB 4.3Å; I737-A768 HydrophobicContact CG1-CB 4.27Å; I737-H771 VanDerWaalsContact CG2-CD2 3.49Å; I737-H771 WeakPolarHBondContact CG2-CD2 3.38Å
738	T	91.4	Very high	85	Confident	12 Å²	12	44 Å²	44	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-41.7	178.1	-56.9	0	0	0	0	111.8	N701 S733 T734 P735 L736 K741 N742	N701-T738 HydrophobicContact CB-CG2 3.58Å; S733-T738 WeakPolarHBondContact CB-OG1 3.44Å; S733-T738 PolarHBondContact OG-OG1 3.16Å; T734-T738 WeakPolarHBondContact O-CB 3.04Å; T734-T738 PolarHBondContact O-N 2.84Å; T734-T738 PolarHBondContact O-OG1 3.14Å; P735-T738 PolarHBondContact O-N 3.41Å; L736-T738 VanDerWaalsContact C-N 3.28Å; L736-T738 PolarHBondContact O-N 2.85Å; T738-K741 PolarHBondContact O-N 2.93Å; T738-N742 PolarHBondContact O-N 3.49Å; T738-N742 VanDerWaalsContact O-N 3.15Å; T738-N742 PolarHBondContact O-ND2 3.28Å
739	A	93	Very high	86.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-41.2	174	0	0	0	0	0	112.2	A700 P735 L736 N742 K743 Q744 A747 I748 L751	A700-A739 HydrophobicContact CB-CB 4.34Å; A700-A739 WeakPolarHBondContact O-CA 3.18Å; A700-A739 PolarHBondContact O-N 2.97Å; P735-A739 WeakPolarHBondContact O-CB 3.39Å; P735-A739 PolarHBondContact O-N 3.3Å; L736-A739 PolarHBondContact O-N 3.46Å; A739-N742 CarbonylContact O-C 3.51Å; A739-N742 PolarHBondContact O-N 3.29Å; A739-K743 PolarHBondContact O-N 3.43Å; A739-K743 VanDerWaalsContact O-N 3.11Å; A739-Q744 HydrophobicContact CB-CB 4.29Å; A739-Q744 PolarHBondContact O-N 2.74Å; A739-A747 HydrophobicContact CB-CB 4.26Å; A739-I748 HydrophobicContact CB-CG1 3.68Å; A739-L751 HydrophobicContact CB-CD1 3.97Å
740	V	94	Very high	87.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-47.5	174.6	168.5	0	0	0	0	111.7	L736 I737 N742 K743 I748 A768 H771 A772 I780 L784	L736-V740 HydrophobicContact CD1-CG2 4.41Å; L736-V740 WeakPolarHBondContact O-CB 3.41Å; L736-V740 VanDerWaalsContact O-CG2 3.28Å; L736-V740 WeakPolarHBondContact O-CG2 3.05Å; L736-V740 PolarHBondContact O-N 3.34Å; I737-V740 PolarHBondContact O-N 3.33Å; V740-N742 PolarHBondContact O-N 3.11Å; V740-K743 PolarHBondContact O-N 3.08Å; V740-K743 VanDerWaalsContact O-N 3.12Å; V740-I748 HydrophobicContact CB-CD1 4.42Å; V740-I748 HydrophobicContact CG2-CD1 3.91Å; V740-I748 HydrophobicContact CG2-CG1 4.02Å; V740-I748 HydrophobicContact CG2-CG2 4.35Å; V740-A768 HydrophobicContact CG2-CB 4.5Å; V740-H771 HydrophobicContact CG1-CB 3.79Å; V740-A772 HydrophobicContact CG1-CB 4Å; V740-I780 HydrophobicContact CG1-CG2 4.21Å; V740-I780 HydrophobicContact CG2-CG2 4.05Å; V740-L784 HydrophobicContact CG2-CD1 4.28Å
741	K	91	Very high	89.4	Confident	70 Å²	70	34.2 Å²	34.2	30%	0.304	17%	0.171	S	C	.	.	H	α-helix	trans	-57.1	-37.9	177.3	-77.3	169.3	179.6	168.6	0	112.1	I737 T738 D762 H771	I737-K741 HydrophobicContact CG2-CD 3.81Å; I737-K741 HydrophobicContact CG2-CG 4.36Å; I737-K741 VanDerWaalsContact CG2-NZ 3.33Å; I737-K741 WeakPolarHBondContact O-CB 3.42Å; I737-K741 VanDerWaalsContact O-CG 3.29Å; I737-K741 WeakPolarHBondContact O-CG 3.24Å; I737-K741 PolarHBondContact O-N 3.41Å; T738-K741 PolarHBondContact O-N 2.93Å; K741-D762 IonicContact NZ-OD2 3.26Å; K741-D762 PolarHBondContact NZ-OD2 3.21Å; K741-H771 WeakPolarHBondContact CE-CE1 3.49Å; K741-H771 WeakPolarHBondContact CE-ND1 3.06Å; K741-H771 WeakPolarHBondContact CE-NE2 3.43Å; K741-H771 HydrophobicContact CG-CB 4.36Å
742	N	89.5	Confident	90.9	Very high	68 Å²	68	29.5 Å²	29.5	36%	0.364	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	11.9	179.8	-66.1	-58.7	0	0	0	114.5	N701 T738 A739 V740 Q744	N701-N742 PolarHBondContact O-ND2 2.82Å; N701-N742 PolarHBondContact OD1-ND2 3.44Å; T738-N742 PolarHBondContact O-N 3.49Å; T738-N742 VanDerWaalsContact O-N 3.15Å; T738-N742 PolarHBondContact O-ND2 3.28Å; A739-N742 CarbonylContact O-C 3.51Å; A739-N742 PolarHBondContact O-N 3.29Å; V740-N742 PolarHBondContact O-N 3.11Å; N742-Q744 HydrophobicContact CB-CG 3.95Å; N742-Q744 PolarHBondContact O-N 2.69Å
743	K	91.5	Very high	91.7	Very high	114 Å²	114	30.7 Å²	30.7	50%	0.496	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	25.1	180	-61.5	-174.3	175.3	-168.2	0	115.3	A739 V740 I745 V775 I780	A739-K743 PolarHBondContact O-N 3.43Å; A739-K743 VanDerWaalsContact O-N 3.11Å; V740-K743 PolarHBondContact O-N 3.08Å; V740-K743 VanDerWaalsContact O-N 3.12Å; K743-I745 PolarHBondContact O-N 3.32Å; K743-V775 HydrophobicContact CD-CG1 4.02Å; K743-V775 WeakPolarHBondContact CE-O 3.47Å; K743-V775 HydrophobicContact CG-CG1 3.5Å; K743-V775 PolarHBondContact NZ-O 3.17Å; K743-V775 VanDerWaalsContact NZ-O 3.11Å; K743-I780 HydrophobicContact CB-CD1 4.28Å; K743-I780 HydrophobicContact CG-CD1 4.39Å
744	Q	89.7	Confident	92.2	Very high	29 Å²	29	33.7 Å²	33.7	14%	0.136	16%	0.159	C	C	.	.			trans	-78.5	71.7	-173.6	-60.8	-64.9	7.4	0	0	113.1	D702 A739 N742 A746 A747 I748	D702-Q744 PolarHBondContact O-NE2 3.11Å; A739-Q744 HydrophobicContact CB-CB 4.29Å; A739-Q744 PolarHBondContact O-N 2.74Å; N742-Q744 HydrophobicContact CB-CG 3.95Å; N742-Q744 PolarHBondContact O-N 2.69Å; Q744-A746 PolarHBondContact O-N 3.18Å; Q744-A747 HydrophobicContact CB-CB 3.94Å; Q744-A747 WeakPolarHBondContact O-CB 3.19Å; Q744-A747 PolarHBondContact O-N 3.04Å; Q744-I748 VanDerWaalsContact O-CG1 3.3Å; Q744-I748 WeakPolarHBondContact O-CG1 3.24Å; Q744-I748 PolarHBondContact O-N 2.81Å
745	I	90.4	Very high	92.2	Very high	85 Å²	85	35.3 Å²	35.3	44%	0.436	18%	0.176	S	C	.	.	H	α-helix	trans	-49.3	-48.4	-170.9	-59.2	179.7	0	0	0	113.4	K743 A747 I748 E749 I780 L783	K743-I745 PolarHBondContact O-N 3.32Å; I745-A747 PolarHBondContact O-N 2.93Å; I745-I748 WeakPolarHBondContact O-CB 3.39Å; I745-I748 PolarHBondContact O-N 2.04Å; I745-E749 PolarHBondContact O-N 3.27Å; I745-I780 HydrophobicContact CG1-CD1 4.41Å; I745-I780 HydrophobicContact CG1-CG1 4.18Å; I745-L783 HydrophobicContact CG2-CD1 3.98Å
746	A	89.6	Confident	92.3	Very high	36 Å²	36	35.3 Å²	35.3	30%	0.298	18%	0.176	S	C	.	.	H	α-helix	trans	-64.1	-37.9	-179	0	0	0	0	0	112.9	P707 Q744 L750	P707-A746 HydrophobicContact CB-CB 4.14Å; Q744-A746 PolarHBondContact O-N 3.18Å; A746-L750 WeakPolarHBondContact O-CB 3.34Å; A746-L750 PolarHBondContact O-N 2.74Å
747	A	90.8	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.2	-38.3	173.4	0	0	0	0	0	112.1	I714 A739 Q744 I745 L750 L751	I714-A747 HydrophobicContact CD1-CB 3.64Å; A739-A747 HydrophobicContact CB-CB 4.26Å; Q744-A747 HydrophobicContact CB-CB 3.94Å; Q744-A747 WeakPolarHBondContact O-CB 3.19Å; Q744-A747 PolarHBondContact O-N 3.04Å; I745-A747 PolarHBondContact O-N 2.93Å; A747-L750 PolarHBondContact O-N 3.47Å; A747-L751 VanDerWaalsContact O-CB 3.32Å; A747-L751 WeakPolarHBondContact O-CB 3.2Å; A747-L751 WeakPolarHBondContact O-CD1 2.88Å; A747-L751 WeakPolarHBondContact O-CG 3.47Å; A747-L751 PolarHBondContact O-N 2.76Å
748	I	94	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-47.6	176.2	-64.6	163.8	0	0	0	110.3	L736 A739 V740 Q744 I745 L752 I780 L783	L736-I748 HydrophobicContact CD1-CG2 3.97Å; A739-I748 HydrophobicContact CB-CG1 3.68Å; V740-I748 HydrophobicContact CB-CD1 4.42Å; V740-I748 HydrophobicContact CG2-CD1 3.91Å; V740-I748 HydrophobicContact CG2-CG1 4.02Å; V740-I748 HydrophobicContact CG2-CG2 4.35Å; Q744-I748 VanDerWaalsContact O-CG1 3.3Å; Q744-I748 WeakPolarHBondContact O-CG1 3.24Å; Q744-I748 PolarHBondContact O-N 2.81Å; I745-I748 WeakPolarHBondContact O-CB 3.39Å; I745-I748 PolarHBondContact O-N 2.04Å; I748-L752 HydrophobicContact CG2-CD1 4.08Å; I748-L752 WeakPolarHBondContact O-CD1 3.41Å; I748-L752 WeakPolarHBondContact O-CG 3.03Å; I748-L752 PolarHBondContact O-N 2.77Å; I748-L752 VanDerWaalsContact O-N 3.15Å; I748-I780 HydrophobicContact CD1-CD1 3.74Å; I748-I780 HydrophobicContact CD1-CG1 3.96Å; I748-I780 HydrophobicContact CD1-CG2 3.97Å; I748-L783 HydrophobicContact CB-CD1 4.46Å; I748-L783 HydrophobicContact CG2-CD1 4.02Å; I748-L783 HydrophobicContact CG2-CD2 3.89Å
749	E	93	Very high	92.4	Very high	74 Å²	74	38.5 Å²	38.5	35%	0.346	19%	0.193	S	C	.	.	H	α-helix	trans	-55.6	-55.8	172.1	-77.1	-160.5	-140.2	0	0	110.9	I745 L751 L752 R753 L783	I745-E749 PolarHBondContact O-N 3.27Å; E749-L751 VanDerWaalsContact C-N 3.33Å; E749-L751 PolarHBondContact O-N 3.3Å; E749-L752 PolarHBondContact O-N 2.99Å; E749-L752 VanDerWaalsContact O-N 3.1Å; E749-R753 VanDerWaalsContact O-CG 3.25Å; E749-R753 WeakPolarHBondContact O-CG 3.33Å; E749-R753 PolarHBondContact O-N 2.95Å; E749-R753 IonicContact OE2-CZ 2.72Å; E749-R753 IonicContact OE2-NE 3.9Å; E749-R753 PolarHBondContact OE2-NE 3.36Å; E749-R753 IonicContact OE2-NH2 2.7Å; E749-R753 PolarHBondContact OE2-NH2 2.68Å; E749-L783 HydrophobicContact CG-CD1 3.74Å; E749-L783 HydrophobicContact CG-CD2 4.31Å; E749-L783 HydrophobicContact CG-CG 4.14Å
750	L	92.6	Very high	92.4	Very high	23 Å²	23	39.8 Å²	39.8	12%	0.12	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-42.3	-174.1	-173.7	63	0	0	0	112.8	C711 I714 D715 A746 A747 L752 R753 R754	C711-L750 HydrophobicContact CB-CD2 3.8Å; C711-L750 WeakPolarHBondContact O-CD2 3.5Å; I714-L750 HydrophobicContact CB-CD2 3.95Å; I714-L750 HydrophobicContact CG2-CD2 3.76Å; I714-L750 HydrophobicContact CG2-CG 4.3Å; D715-L750 HydrophobicContact CB-CD2 4.08Å; D715-L750 WeakPolarHBondContact OD1-CD1 3.39Å; A746-L750 WeakPolarHBondContact O-CB 3.34Å; A746-L750 PolarHBondContact O-N 2.74Å; A747-L750 PolarHBondContact O-N 3.47Å; L750-L752 VanDerWaalsContact C-N 3.35Å; L750-L752 PolarHBondContact O-N 3.18Å; L750-R753 WeakPolarHBondContact O-CB 3.14Å; L750-R753 PolarHBondContact O-N 3.37Å; L750-R754 HydrophobicContact CD1-CG 4.49Å; L750-R754 WeakPolarHBondContact O-CB 3.43Å; L750-R754 WeakPolarHBondContact O-CG 3.43Å; L750-R754 PolarHBondContact O-N 3.13Å
751	L	94.6	Very high	92.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-41.3	176.6	-71.4	167.7	0	0	0	111.3	L696 A700 I714 I718 V724 P735 L736 A739 A747 E749 R754 G755 A756	L696-L751 HydrophobicContact CD1-CD2 4.39Å; A700-L751 HydrophobicContact CB-CD1 4.29Å; I714-L751 HydrophobicContact CG2-CD2 3.89Å; I714-L751 HydrophobicContact CG2-CG 4.27Å; I718-L751 HydrophobicContact CD1-CD2 4Å; V724-L751 HydrophobicContact CG2-CD2 3.8Å; P735-L751 HydrophobicContact CB-CD1 3.95Å; P735-L751 HydrophobicContact CB-CD2 3.86Å; L736-L751 HydrophobicContact CD1-CB 4.34Å; A739-L751 HydrophobicContact CB-CD1 3.97Å; A747-L751 VanDerWaalsContact O-CB 3.32Å; A747-L751 WeakPolarHBondContact O-CB 3.2Å; A747-L751 WeakPolarHBondContact O-CD1 2.88Å; A747-L751 WeakPolarHBondContact O-CG 3.47Å; A747-L751 PolarHBondContact O-N 2.76Å; E749-L751 VanDerWaalsContact C-N 3.33Å; E749-L751 PolarHBondContact O-N 3.3Å; L751-R754 CarbonylContact O-C 3.59Å; L751-R754 PolarHBondContact O-N 3.37Å; L751-G755 PolarHBondContact O-N 3.26Å; L751-G755 VanDerWaalsContact O-N 3.15Å; L751-A756 HydrophobicContact CB-CB 4.03Å; L751-A756 WeakPolarHBondContact O-CB 3.17Å; L751-A756 PolarHBondContact O-N 3.27Å
752	L	94.5	Very high	92.2	Very high	11 Å²	11	40 Å²	40	6%	0.058	20%	0.201	C	C	.	.	H	α-helix	trans	-67.6	-38.5	175	-70.4	165.2	0	0	0	112.3	L736 I748 E749 L750 R754 G755 L783 L784 R789	L736-L752 HydrophobicContact CD1-CD1 4.48Å; L736-L752 HydrophobicContact CD1-CD2 4.37Å; L736-L752 HydrophobicContact CD1-CG 4.06Å; L736-L752 HydrophobicContact CD2-CD2 3.76Å; L736-L752 HydrophobicContact CD2-CG 4.35Å; I748-L752 HydrophobicContact CG2-CD1 4.08Å; I748-L752 WeakPolarHBondContact O-CD1 3.41Å; I748-L752 WeakPolarHBondContact O-CG 3.03Å; I748-L752 PolarHBondContact O-N 2.77Å; I748-L752 VanDerWaalsContact O-N 3.15Å; E749-L752 PolarHBondContact O-N 2.99Å; E749-L752 VanDerWaalsContact O-N 3.1Å; L750-L752 VanDerWaalsContact C-N 3.35Å; L750-L752 PolarHBondContact O-N 3.18Å; L752-R754 VanDerWaalsContact C-N 3.32Å; L752-G755 PolarHBondContact O-N 3.26Å; L752-L783 HydrophobicContact CD1-CD2 3.33Å; L752-L784 HydrophobicContact CD1-CD2 4.08Å; L752-L784 HydrophobicContact CD2-CD2 4.45Å; L752-R789 PolarHBondContact O-NH1 3.07Å; L752-R789 PolarHBondContact O-NH2 3.22Å
753	R	92.8	Very high	92	Very high	107 Å²	107	41.5 Å²	41.5	40%	0.404	21%	0.209	S	C	.	.	H	α-helix	trans	-60.3	-40.7	171.9	-65.8	176.6	-174.9	-137.7	4.9	111.4	F159 E749 L750 G755	F159-R753 HydrophobicContact CE1-CB 4.33Å; F159-R753 HydrophobicContact CE2-CB 3.84Å; F159-R753 HydrophobicContact CE2-CG 3.62Å; F159-R753 HydrophobicContact CZ-CB 3.46Å; F159-R753 VanDerWaalsContact CZ-CB 3.46Å; F159-R753 HydrophobicContact CZ-CG 3.55Å; E749-R753 VanDerWaalsContact O-CG 3.25Å; E749-R753 WeakPolarHBondContact O-CG 3.33Å; E749-R753 PolarHBondContact O-N 2.95Å; E749-R753 IonicContact OE2-CZ 2.72Å; E749-R753 IonicContact OE2-NE 3.9Å; E749-R753 PolarHBondContact OE2-NE 3.36Å; E749-R753 IonicContact OE2-NH2 2.7Å; E749-R753 PolarHBondContact OE2-NH2 2.68Å; L750-R753 WeakPolarHBondContact O-CB 3.14Å; L750-R753 PolarHBondContact O-N 3.37Å; R753-G755 VanDerWaalsContact C-N 3.31Å; R753-G755 PolarHBondContact O-N 3.25Å
754	R	93.7	Very high	91.6	Very high	74 Å²	74	37.6 Å²	37.6	28%	0.279	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	7.1	177.1	-74.7	-70	-167.9	134.9	-12	114.9	D715 I718 S719 V724 L750 L751 L752	D715-R754 VanDerWaalsContact O-CZ 3.28Å; D715-R754 PolarHBondContact O-NH1 2.75Å; D715-R754 PolarHBondContact O-NH2 3.49Å; D715-R754 IonicContact OD1-CZ 2.96Å; D715-R754 IonicContact OD1-NE 3.93Å; D715-R754 PolarHBondContact OD1-NE 3.42Å; D715-R754 IonicContact OD1-NH2 2.58Å; D715-R754 PolarHBondContact OD1-NH2 2.04Å; D715-R754 IonicContact OD2-CZ 2.76Å; D715-R754 IonicContact OD2-NE 3.94Å; D715-R754 IonicContact OD2-NH2 2.69Å; D715-R754 PolarHBondContact OD2-NH2 3.35Å; I718-R754 HydrophobicContact CD1-CB 3.83Å; I718-R754 HydrophobicContact CD1-CG 3.98Å; I718-R754 HydrophobicContact CG2-CB 4.3Å; I718-R754 HydrophobicContact CG2-CG 4.37Å; S719-R754 VanDerWaalsContact N-NH1 3.18Å; S719-R754 PolarHBondContact OG-NH1 3.02Å; S719-R754 VanDerWaalsContact OG-NH1 3.14Å; S719-R754 PolarHBondContact OG-NH2 3.04Å; V724-R754 HydrophobicContact CG2-CB 4.44Å; L750-R754 HydrophobicContact CD1-CG 4.49Å; L750-R754 WeakPolarHBondContact O-CB 3.43Å; L750-R754 WeakPolarHBondContact O-CG 3.43Å; L750-R754 PolarHBondContact O-N 3.13Å; L751-R754 CarbonylContact O-C 3.59Å; L751-R754 PolarHBondContact O-N 3.37Å; L752-R754 VanDerWaalsContact C-N 3.32Å
755	G	90.4	Very high	91.6	Very high	36 Å²	36	36.7 Å²	36.7	37%	0.371	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	21.2	170.7	0	0	0	0	0	116.6	N725 L751 L752 R753 D757	N725-G755 PolarHBondContact ND2-O 3.05Å; L751-G755 PolarHBondContact O-N 3.26Å; L751-G755 VanDerWaalsContact O-N 3.15Å; L752-G755 PolarHBondContact O-N 3.26Å; R753-G755 VanDerWaalsContact C-N 3.31Å; R753-G755 PolarHBondContact O-N 3.25Å; G755-D757 PolarHBondContact O-N 3.23Å
756	A	93.7	Very high	91.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.			trans	-60.6	131.5	170	0	0	0	0	0	111.9	V724 N725 L736 L751 P758 R789	V724-A756 HydrophobicContact CG2-CB 3.93Å; N725-A756 WeakPolarHBondContact OD1-CA 3.01Å; L736-A756 HydrophobicContact CB-CB 4.02Å; L736-A756 HydrophobicContact CD2-CB 3.82Å; L736-A756 HydrophobicContact CG-CB 4.41Å; L751-A756 HydrophobicContact CB-CB 4.03Å; L751-A756 WeakPolarHBondContact O-CB 3.17Å; L751-A756 PolarHBondContact O-N 3.27Å; A756-P758 WeakPolarHBondContact O-CD 3.48Å; A756-R789 PolarHBondContact O-NH2 2.93Å
757	D	93.3	Very high	91.9	Very high	53 Å²	53	34.1 Å²	34.1	28%	0.283	18%	0.176	S	C	.	.			trans	-85.7	115	173.8	172.2	20.5	0	0	0	110.1	N725 G755 N759 L760	N725-D757 PolarHBondContact OD1-N 3.12Å; G755-D757 PolarHBondContact O-N 3.23Å; D757-N759 PolarHBondContact O-N 3.01Å; D757-N759 WeakPolarHBondContact OD1-CB 3.18Å; D757-N759 PolarHBondContact OD1-N 3.12Å; D757-N759 PolarHBondContact OD1-ND2 3.22Å; D757-L760 HydrophobicContact CB-CD1 3.95Å; D757-L760 HydrophobicContact CB-CD2 4.39Å; D757-L760 HydrophobicContact CB-CG 3.81Å; D757-L760 VanDerWaalsContact OD2-CD2 3.29Å; D757-L760 WeakPolarHBondContact OD2-CD2 3.33Å; D757-L760 WeakPolarHBondContact OD2-CG 3.19Å
758	P	93.7	Very high	92	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-14.6	179.8	30.5	-35.8	0	0	0	113.7	L736 A756 T767 A768 L784 R789 C790	L736-P758 HydrophobicContact CD2-CB 4.07Å; A756-P758 WeakPolarHBondContact O-CD 3.48Å; P758-T767 WeakPolarHBondContact O-CB 3.29Å; P758-A768 HydrophobicContact CB-CB 4.08Å; P758-A768 WeakPolarHBondContact O-CB 3.41Å; P758-A768 PolarHBondContact O-N 3.22Å; P758-L784 HydrophobicContact CB-CD2 4.03Å; P758-R789 HydrophobicContact CG-CB 4.08Å; P758-C790 VanDerWaalsContact CG-SG 3.59Å
759	N	94.2	Very high	92.1	Very high	28 Å²	28	34.2 Å²	34.2	15%	0.15	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.3	-173.2	-49.3	-65.9	0	0	0	113.3	D757 K761 T767 R789 L791	D757-N759 PolarHBondContact O-N 3.01Å; D757-N759 WeakPolarHBondContact OD1-CB 3.18Å; D757-N759 PolarHBondContact OD1-N 3.12Å; D757-N759 PolarHBondContact OD1-ND2 3.22Å; N759-K761 PolarHBondContact O-N 2.99Å; N759-T767 WeakPolarHBondContact O-CG2 3.4Å; N759-R789 PolarHBondContact ND2-O 3.48Å; N759-L791 HydrophobicContact CB-CD1 4.31Å; N759-L791 WeakPolarHBondContact OD1-CB 3.5Å; N759-L791 WeakPolarHBondContact OD1-CG 3.28Å; N759-L791 PolarHBondContact OD1-N 2.82Å
760	L	93	Very high	92.2	Very high	27 Å²	27	30.7 Å²	30.7	14%	0.141	16%	0.161	C	C	.	.			trans	-60.7	121.4	175.4	-60.6	173.8	0	0	0	110	N725 T734 I737 D757	N725-L760 HydrophobicContact CB-CD1 3.67Å; N725-L760 WeakPolarHBondContact OD1-CD1 3.42Å; T734-L760 HydrophobicContact CG2-CB 3.81Å; T734-L760 HydrophobicContact CG2-CD1 3.71Å; T734-L760 HydrophobicContact CG2-CG 4.42Å; I737-L760 WeakPolarHBondContact CD1-O 3.27Å; D757-L760 HydrophobicContact CB-CD1 3.95Å; D757-L760 HydrophobicContact CB-CD2 4.39Å; D757-L760 HydrophobicContact CB-CG 3.81Å; D757-L760 VanDerWaalsContact OD2-CD2 3.29Å; D757-L760 WeakPolarHBondContact OD2-CD2 3.33Å; D757-L760 WeakPolarHBondContact OD2-CG 3.19Å
761	K	90.9	Very high	92.2	Very high	57 Å²	57	30.5 Å²	30.5	25%	0.248	16%	0.159	C	C	.	.			trans	-85.8	137.2	-178.4	-65.6	-177.6	173.6	-172.1	0	112.7	R727 N759 G765 R766 T767 E794 K795	R727-K761 PolarHBondContact NH1-O 3.24Å; N759-K761 PolarHBondContact O-N 2.99Å; K761-G765 WeakPolarHBondContact CD-O 2.98Å; K761-G765 VanDerWaalsContact CG-O 3.28Å; K761-G765 WeakPolarHBondContact CG-O 3.34Å; K761-R766 WeakPolarHBondContact CA-O 3.4Å; K761-T767 HydrophobicContact CG-CG2 3.91Å; K761-E794 WeakPolarHBondContact CE-OE2 3.17Å; K761-E794 IonicContact NZ-OE2 2.8Å; K761-E794 PolarHBondContact NZ-OE2 2.96Å; K761-K795 PolarHBondContact NZ-O 2.86Å
762	D	89.8	Confident	92.2	Very high	16 Å²	16	30.5 Å²	30.5	9%	0.086	16%	0.159	C	C	.	.			trans	-77.7	-177.4	165.5	75.9	5.3	0	0	0	111.9	H731 I737 K741 G764 G765 R766 H771	H731-D762 WeakPolarHBondContact O-CB 3.37Å; I737-D762 HydrophobicContact CD1-CB 4.3Å; K741-D762 IonicContact NZ-OD2 3.26Å; K741-D762 PolarHBondContact NZ-OD2 3.21Å; D762-G764 PolarHBondContact O-N 3.13Å; D762-G764 VanDerWaalsContact O-N 3.16Å; D762-G764 WeakPolarHBondContact OD1-CA 3.03Å; D762-G764 PolarHBondContact OD1-N 2.8Å; D762-G765 PolarHBondContact O-N 3.4Å; D762-R766 PolarHBondContact N-O 2.04Å; D762-R766 PolarHBondContact OD1-N 3.42Å; D762-H771 IonicContact OD1-NE2 2.66Å; D762-H771 IonicContact OD2-CD2 3.73Å; D762-H771 IonicContact OD2-CE1 3.11Å; D762-H771 PolarHBondContact OD2-CE1 2.88Å; D762-H771 VanDerWaalsContact OD2-CE1 3.27Å; D762-H771 IonicContact OD2-NE2 2.67Å; D762-H771 PolarHBondContact OD2-NE2 3.1Å
763	L	85.1	Confident	92.2	Very high	101 Å²	101	30 Å²	30	53%	0.529	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21	178.4	-76.1	-174.8	0	0	0	114.2	L730 H731 M732 G765 L797	L730-L763 WeakPolarHBondContact O-CD1 3.12Å; H731-L763 PolarHBondContact O-N 3.37Å; M732-L763 HydrophobicContact CB-CD2 4.37Å; M732-L763 HydrophobicContact CB-CG 4.09Å; M732-L763 HydrophobicContact CG-CD1 4.43Å; M732-L763 HydrophobicContact CG-CD2 3.87Å; M732-L763 HydrophobicContact CG-CG 3.88Å; M732-L763 HydrophobicContact SD-CD2 3.61Å; M732-L763 HydrophobicContact SD-CG 4.3Å; L763-G765 PolarHBondContact O-N 3.02Å; L763-L797 VanDerWaalsContact O-CD1 3.22Å; L763-L797 WeakPolarHBondContact O-CD1 3.31Å
764	G	84	Confident	92	Very high	32 Å²	32	26.4 Å²	26.4	33%	0.33	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.7	172.5	0	0	0	0	0	113.5	D762 R766 L797	D762-G764 PolarHBondContact O-N 3.13Å; D762-G764 VanDerWaalsContact O-N 3.16Å; D762-G764 WeakPolarHBondContact OD1-CA 3.03Å; D762-G764 PolarHBondContact OD1-N 2.8Å; G764-R766 PolarHBondContact O-N 3.16Å; G764-L797 VanDerWaalsContact O-CB 3.32Å; G764-L797 WeakPolarHBondContact O-CB 3.21Å; G764-L797 WeakPolarHBondContact O-CG 3.44Å; G764-L797 PolarHBondContact O-N 2.84Å
765	G	89	Confident	91.8	Very high	10 Å²	10	24.2 Å²	24.2	10%	0.103	14%	0.142	C	C	.	.	S	Bend	trans	73.1	6.1	-170.5	0	0	0	0	0	113.3	K761 D762 L763	K761-G765 WeakPolarHBondContact CD-O 2.98Å; K761-G765 VanDerWaalsContact CG-O 3.28Å; K761-G765 WeakPolarHBondContact CG-O 3.34Å; D762-G765 PolarHBondContact O-N 3.4Å; L763-G765 PolarHBondContact O-N 3.02Å
766	R	92	Very high	91.5	Very high	65 Å²	65	25.3 Å²	25.3	25%	0.245	14%	0.14	C	C	.	.			trans	-88.2	129	-171	-73.9	-175.3	177.3	151.8	14.8	111.3	K761 D762 G764 H770 H771 D796 D798	K761-R766 WeakPolarHBondContact CA-O 3.4Å; D762-R766 PolarHBondContact N-O 2.04Å; D762-R766 PolarHBondContact OD1-N 3.42Å; G764-R766 PolarHBondContact O-N 3.16Å; R766-H770 HydrophobicContact CB-CB 3.78Å; R766-H770 HydrophobicContact CG-CB 3.84Å; R766-H771 VanDerWaalsContact CB-NE2 3.26Å; R766-H771 WeakPolarHBondContact CB-NE2 3.17Å; R766-D796 HydrophobicContact CG-CB 3.57Å; R766-D796 IonicContact CZ-OD2 3.2Å; R766-D796 VanDerWaalsContact CZ-OD2 3.25Å; R766-D796 IonicContact NE-OD2 2.78Å; R766-D796 PolarHBondContact NE-OD2 3.41Å; R766-D796 IonicContact NH2-OD2 2.7Å; R766-D796 PolarHBondContact NH2-OD2 3.42Å; R766-D798 IonicContact NH2-OD2 3.8Å; R766-D798 PolarHBondContact NH2-OD2 3.47Å
767	T	94.3	Very high	90.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	15%	0.149	C	C	.	.			trans	-79.8	173.2	171.5	69.6	0	0	0	0	110.9	P758 N759 K761 L769 H770 H771 E794	P758-T767 WeakPolarHBondContact O-CB 3.29Å; N759-T767 WeakPolarHBondContact O-CG2 3.4Å; K761-T767 HydrophobicContact CG-CG2 3.91Å; T767-L769 PolarHBondContact O-N 2.69Å; T767-L769 PolarHBondContact OG1-N 2.8Å; T767-H770 PolarHBondContact O-N 3.13Å; T767-H770 PolarHBondContact OG1-ND1 3.42Å; T767-H771 PolarHBondContact O-CD2 3.01Å; T767-H771 VanDerWaalsContact O-CD2 3.3Å; T767-H771 PolarHBondContact O-N 2.89Å; T767-E794 HydrophobicContact CG2-CB 3.98Å; T767-E794 HydrophobicContact CG2-CG 4.33Å
768	A	94.5	Very high	90.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.3	-36.5	174.9	0	0	0	0	0	112.4	L736 I737 V740 P758 H771 A772 L784	L736-A768 HydrophobicContact CD2-CB 4.15Å; L736-A768 HydrophobicContact CG-CB 4.19Å; I737-A768 HydrophobicContact CG1-CB 4.27Å; V740-A768 HydrophobicContact CG2-CB 4.5Å; P758-A768 HydrophobicContact CB-CB 4.08Å; P758-A768 WeakPolarHBondContact O-CB 3.41Å; P758-A768 PolarHBondContact O-N 3.22Å; A768-H771 PolarHBondContact O-N 3.39Å; A768-A772 PolarHBondContact O-N 3.49Å; A768-L784 HydrophobicContact CB-CD1 4.24Å; A768-L784 HydrophobicContact CB-CD2 3.99Å
769	L	95.2	Very high	90	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-64.7	-41	178.4	-171.8	62.4	0	0	0	112.4	T767 H771 A772 V773 V781 L785 L792 A802 L820	T767-L769 PolarHBondContact O-N 2.69Å; T767-L769 PolarHBondContact OG1-N 2.8Å; L769-H771 VanDerWaalsContact C-N 3.3Å; L769-H771 PolarHBondContact O-N 2.99Å; L769-A772 PolarHBondContact O-N 3.29Å; L769-V773 WeakPolarHBondContact O-CG2 3.06Å; L769-V773 PolarHBondContact O-N 3.05Å; L769-V781 HydrophobicContact CD1-CG1 4.17Å; L769-L785 HydrophobicContact CD1-CD2 4.22Å; L769-L785 HydrophobicContact CD1-CG 4.41Å; L769-L785 HydrophobicContact CD2-CD2 4.31Å; L769-L792 HydrophobicContact CD2-CD2 4.06Å; L769-A802 HydrophobicContact CD2-CB 3.65Å; L769-A802 HydrophobicContact CG-CB 3.8Å; L769-L820 HydrophobicContact CD1-CD2 4.4Å; L769-L820 HydrophobicContact CD2-CD2 4.08Å
770	H	94.5	Very high	89.9	Confident	1 Å²	1	27 Å²	27	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-38.5	176.1	-70.3	80.1	0	0	0	112.2	R766 T767 S774 E794 C800 L805	R766-H770 HydrophobicContact CB-CB 3.78Å; R766-H770 HydrophobicContact CG-CB 3.84Å; T767-H770 PolarHBondContact O-N 3.13Å; T767-H770 PolarHBondContact OG1-ND1 3.42Å; H770-S774 WeakPolarHBondContact O-CB 3.22Å; H770-S774 PolarHBondContact O-N 3.24Å; H770-S774 PolarHBondContact O-OG 3.25Å; H770-E794 PolarHBondContact CE1-O 2.98Å; H770-E794 PolarHBondContact NE2-O 2.88Å; H770-C800 PolarHBondContact NE2-O 3.32Å; H770-C800 VanDerWaalsContact NE2-O 3.1Å; H770-L805 HydrophobicContact CB-CD2 4.32Å
771	H	93.8	Very high	89.8	Confident	18 Å²	18	25.7 Å²	25.7	8%	0.083	16%	0.156	C	C	.	.	H	α-helix	trans	-69.8	-40.4	175.1	-70.6	-62.6	0	0	0	111.3	I737 V740 K741 D762 R766 T767 A768 L769 V773 S774 V775	I737-H771 VanDerWaalsContact CG2-CD2 3.49Å; I737-H771 WeakPolarHBondContact CG2-CD2 3.38Å; V740-H771 HydrophobicContact CG1-CB 3.79Å; K741-H771 WeakPolarHBondContact CE-CE1 3.49Å; K741-H771 WeakPolarHBondContact CE-ND1 3.06Å; K741-H771 WeakPolarHBondContact CE-NE2 3.43Å; K741-H771 HydrophobicContact CG-CB 4.36Å; D762-H771 IonicContact OD1-NE2 2.66Å; D762-H771 IonicContact OD2-CD2 3.73Å; D762-H771 IonicContact OD2-CE1 3.11Å; D762-H771 PolarHBondContact OD2-CE1 2.88Å; D762-H771 VanDerWaalsContact OD2-CE1 3.27Å; D762-H771 IonicContact OD2-NE2 2.67Å; D762-H771 PolarHBondContact OD2-NE2 3.1Å; R766-H771 VanDerWaalsContact CB-NE2 3.26Å; R766-H771 WeakPolarHBondContact CB-NE2 3.17Å; T767-H771 PolarHBondContact O-CD2 3.01Å; T767-H771 VanDerWaalsContact O-CD2 3.3Å; T767-H771 PolarHBondContact O-N 2.89Å; A768-H771 PolarHBondContact O-N 3.39Å; L769-H771 VanDerWaalsContact C-N 3.3Å; L769-H771 PolarHBondContact O-N 2.99Å; H771-V773 PolarHBondContact O-N 2.88Å; H771-S774 CarbonylContact O-C 3.48Å; H771-S774 WeakPolarHBondContact O-CB 3.19Å; H771-S774 PolarHBondContact O-N 3.35Å; H771-V775 WeakPolarHBondContact O-CB 3.47Å; H771-V775 WeakPolarHBondContact O-CG2 3.36Å; H771-V775 PolarHBondContact O-N 3.1Å
772	A	94	Very high	89.7	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-40.3	175.6	0	0	0	0	0	113.3	V740 A768 L769 D776 I780 V781 L784	V740-A772 HydrophobicContact CG1-CB 4Å; A768-A772 PolarHBondContact O-N 3.49Å; L769-A772 PolarHBondContact O-N 3.29Å; A772-D776 PolarHBondContact O-N 3.21Å; A772-I780 HydrophobicContact CB-CB 4.46Å; A772-I780 HydrophobicContact CB-CG2 3.78Å; A772-V781 HydrophobicContact CB-CG2 3.73Å; A772-L784 HydrophobicContact CB-CD1 3.61Å
773	V	93.4	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-42	170.5	177.7	0	0	0	0	111.1	L769 H771 V775 D776 A802 L805 A806 I816 L820	L769-V773 WeakPolarHBondContact O-CG2 3.06Å; L769-V773 PolarHBondContact O-N 3.05Å; H771-V773 PolarHBondContact O-N 2.88Å; V773-V775 VanDerWaalsContact C-N 3.3Å; V773-V775 PolarHBondContact O-N 3.47Å; V773-D776 PolarHBondContact O-N 2.89Å; V773-A802 HydrophobicContact CG2-CB 4.25Å; V773-L805 HydrophobicContact CB-CD2 4.25Å; V773-L805 HydrophobicContact CG1-CB 4.26Å; V773-L805 HydrophobicContact CG1-CD2 4.11Å; V773-L805 HydrophobicContact CG1-CG 3.92Å; V773-A806 HydrophobicContact CG1-CB 3.95Å; V773-I816 HydrophobicContact CB-CG2 4.39Å; V773-I816 HydrophobicContact CG1-CG2 4.28Å; V773-I816 HydrophobicContact CG2-CG2 3.78Å; V773-L820 HydrophobicContact CG2-CD1 4.26Å
774	S	90.4	Very high	90.2	Very high	32 Å²	32	22 Å²	22	22%	0.224	14%	0.137	C	C	.	.	H	α-helix	trans	-68.6	-27.8	-180	-59	0	0	0	0	114	H770 H771 D776 R809	H770-S774 WeakPolarHBondContact O-CB 3.22Å; H770-S774 PolarHBondContact O-N 3.24Å; H770-S774 PolarHBondContact O-OG 3.25Å; H771-S774 CarbonylContact O-C 3.48Å; H771-S774 WeakPolarHBondContact O-CB 3.19Å; H771-S774 PolarHBondContact O-N 3.35Å; S774-D776 VanDerWaalsContact C-N 3.34Å; S774-R809 PolarHBondContact O-NH1 3.4Å
775	V	88.6	Confident	90.6	Very high	28 Å²	28	21.4 Å²	21.4	17%	0.17	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.5	-178.4	165.4	0	0	0	0	112.1	K743 H771 V773 C777	K743-V775 HydrophobicContact CD-CG1 4.02Å; K743-V775 WeakPolarHBondContact CE-O 3.47Å; K743-V775 HydrophobicContact CG-CG1 3.5Å; K743-V775 PolarHBondContact NZ-O 3.17Å; K743-V775 VanDerWaalsContact NZ-O 3.11Å; H771-V775 WeakPolarHBondContact O-CB 3.47Å; H771-V775 WeakPolarHBondContact O-CG2 3.36Å; H771-V775 PolarHBondContact O-N 3.1Å; V773-V775 VanDerWaalsContact C-N 3.3Å; V773-V775 PolarHBondContact O-N 3.47Å; V775-C777 HydrophobicContact CG1-CB 4.29Å
776	D	83.4	Confident	90.5	Very high	59 Å²	59	27 Å²	27	32%	0.316	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	60.3	-179.6	-160	42.9	0	0	0	112.9	A772 V773 S774 C813 I816	A772-D776 PolarHBondContact O-N 3.21Å; V773-D776 PolarHBondContact O-N 2.89Å; S774-D776 VanDerWaalsContact C-N 3.34Å; D776-C813 PolarHBondContact OD1-SG 3.28Å; D776-I816 WeakPolarHBondContact OD1-CD1 3.34Å
777	C	81.3	Confident	90.2	Very high	29 Å²	29	25.5 Å²	25.5	20%	0.196	15%	0.154	C	C	.	.			trans	-131.5	93.8	178.9	-168.8	0	0	0	0	110.4	V775 G779 I780 V781	V775-C777 HydrophobicContact CG1-CB 4.29Å; C777-G779 PolarHBondContact O-N 2.03Å; C777-I780 HydrophobicContact CB-CB 4.19Å; C777-I780 HydrophobicContact CB-CD1 3.9Å; C777-I780 HydrophobicContact CB-CG1 4.14Å; C777-I780 PolarHBondContact O-N 2.95Å; C777-V781 PolarHBondContact O-N 3.06Å; C777-V781 VanDerWaalsContact O-N 3.13Å
778	S	83	Confident	89.5	Confident	57 Å²	57	27 Å²	27	40%	0.399	17%	0.169	S	C	.	.	H	α-helix	trans	-53.6	-38.7	179.5	52.9	0	0	0	0	113	I780 V781 E782	S778-I780 VanDerWaalsContact C-N 3.34Å; S778-I780 PolarHBondContact O-N 3.33Å; S778-V781 WeakPolarHBondContact O-CB 3.19Å; S778-V781 PolarHBondContact O-N 2.96Å; S778-V781 VanDerWaalsContact O-N 3.16Å; S778-E782 WeakPolarHBondContact O-CB 3.33Å; S778-E782 PolarHBondContact O-N 2.95Å
779	G	85.3	Confident	89.2	Confident	32 Å²	32	31.5 Å²	31.5	33%	0.33	19%	0.186	S	C	.	.	H	α-helix	trans	-63.1	-33.8	176.2	0	0	0	0	0	114	C777 L783	C777-G779 PolarHBondContact O-N 2.03Å; G779-L783 WeakPolarHBondContact O-CB 3.46Å; G779-L783 PolarHBondContact O-N 3.06Å
780	I	92.1	Very high	88.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-75.3	-33.7	174.8	-65.1	171.7	0	0	0	110.6	V740 K743 I745 I748 A772 C777 S778 L784	V740-I780 HydrophobicContact CG1-CG2 4.21Å; V740-I780 HydrophobicContact CG2-CG2 4.05Å; K743-I780 HydrophobicContact CB-CD1 4.28Å; K743-I780 HydrophobicContact CG-CD1 4.39Å; I745-I780 HydrophobicContact CG1-CD1 4.41Å; I745-I780 HydrophobicContact CG1-CG1 4.18Å; I748-I780 HydrophobicContact CD1-CD1 3.74Å; I748-I780 HydrophobicContact CD1-CG1 3.96Å; I748-I780 HydrophobicContact CD1-CG2 3.97Å; A772-I780 HydrophobicContact CB-CB 4.46Å; A772-I780 HydrophobicContact CB-CG2 3.78Å; C777-I780 HydrophobicContact CB-CB 4.19Å; C777-I780 HydrophobicContact CB-CD1 3.9Å; C777-I780 HydrophobicContact CB-CG1 4.14Å; C777-I780 PolarHBondContact O-N 2.95Å; S778-I780 VanDerWaalsContact C-N 3.34Å; S778-I780 PolarHBondContact O-N 3.33Å; I780-L784 HydrophobicContact CG2-CD1 3.99Å; I780-L784 HydrophobicContact CG2-CG 4.47Å; I780-L784 WeakPolarHBondContact O-CB 3.45Å; I780-L784 VanDerWaalsContact O-CG 3.31Å; I780-L784 WeakPolarHBondContact O-CG 3.48Å; I780-L784 PolarHBondContact O-N 3.11Å
781	V	91.9	Very high	88.7	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-48.9	172.5	175.4	0	0	0	0	110.8	L769 A772 C777 S778 L783 L784 L785 I816 L819	L769-V781 HydrophobicContact CD1-CG1 4.17Å; A772-V781 HydrophobicContact CB-CG2 3.73Å; C777-V781 PolarHBondContact O-N 3.06Å; C777-V781 VanDerWaalsContact O-N 3.13Å; S778-V781 WeakPolarHBondContact O-CB 3.19Å; S778-V781 PolarHBondContact O-N 2.96Å; S778-V781 VanDerWaalsContact O-N 3.16Å; V781-L783 VanDerWaalsContact C-N 3.34Å; V781-L783 PolarHBondContact O-N 2.88Å; V781-L784 PolarHBondContact O-N 2.84Å; V781-L785 HydrophobicContact CG1-CD1 3.67Å; V781-L785 HydrophobicContact CG1-CG 4.21Å; V781-L785 WeakPolarHBondContact O-CB 3.27Å; V781-L785 VanDerWaalsContact O-CG 3.27Å; V781-L785 WeakPolarHBondContact O-CG 3.38Å; V781-L785 PolarHBondContact O-N 3Å; V781-I816 HydrophobicContact CG1-CG2 4.37Å; V781-I816 HydrophobicContact CG2-CD1 4.14Å; V781-I816 HydrophobicContact CG2-CG1 4.2Å; V781-I816 HydrophobicContact CG2-CG2 4.07Å; V781-L819 HydrophobicContact CB-CD1 4.42Å; V781-L819 HydrophobicContact CG1-CB 4.38Å; V781-L819 HydrophobicContact CG1-CD1 4.17Å
782	E	89.2	Confident	88.6	Confident	62 Å²	62	36.6 Å²	36.6	29%	0.29	21%	0.214	S	C	.	.	H	α-helix	trans	-54.5	-48.2	174.8	-176.1	176.7	172.2	0	0	110.7	S778 L785 N786 L819 K964	S778-E782 WeakPolarHBondContact O-CB 3.33Å; S778-E782 PolarHBondContact O-N 2.95Å; E782-L785 PolarHBondContact O-N 3.31Å; E782-N786 WeakPolarHBondContact O-CB 3.45Å; E782-N786 PolarHBondContact O-N 3.02Å; E782-N786 PolarHBondContact O-ND2 2.87Å; E782-L819 HydrophobicContact CB-CD1 4.41Å; E782-K964 IonicContact OE1-NZ 2.65Å; E782-K964 PolarHBondContact OE1-NZ 2.92Å
783	L	90.9	Very high	88.5	Confident	33 Å²	33	40.3 Å²	40.3	17%	0.173	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-46.3	176.7	-167.5	-180	0	0	0	112.5	I745 I748 E749 L752 G779 V781 S787	I745-L783 HydrophobicContact CG2-CD1 3.98Å; I748-L783 HydrophobicContact CB-CD1 4.46Å; I748-L783 HydrophobicContact CG2-CD1 4.02Å; I748-L783 HydrophobicContact CG2-CD2 3.89Å; E749-L783 HydrophobicContact CG-CD1 3.74Å; E749-L783 HydrophobicContact CG-CD2 4.31Å; E749-L783 HydrophobicContact CG-CG 4.14Å; L752-L783 HydrophobicContact CD1-CD2 3.33Å; G779-L783 WeakPolarHBondContact O-CB 3.46Å; G779-L783 PolarHBondContact O-N 3.06Å; V781-L783 VanDerWaalsContact C-N 3.34Å; V781-L783 PolarHBondContact O-N 2.88Å; L783-S787 PolarHBondContact O-N 3.16Å
784	L	93.4	Very high	88.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-43.3	178	-79.4	167.8	0	0	0	112.4	V740 L752 P758 A768 A772 I780 V781 S787 C790	V740-L784 HydrophobicContact CG2-CD1 4.28Å; L752-L784 HydrophobicContact CD1-CD2 4.08Å; L752-L784 HydrophobicContact CD2-CD2 4.45Å; P758-L784 HydrophobicContact CB-CD2 4.03Å; A768-L784 HydrophobicContact CB-CD1 4.24Å; A768-L784 HydrophobicContact CB-CD2 3.99Å; A772-L784 HydrophobicContact CB-CD1 3.61Å; I780-L784 HydrophobicContact CG2-CD1 3.99Å; I780-L784 HydrophobicContact CG2-CG 4.47Å; I780-L784 WeakPolarHBondContact O-CB 3.45Å; I780-L784 VanDerWaalsContact O-CG 3.31Å; I780-L784 WeakPolarHBondContact O-CG 3.48Å; I780-L784 PolarHBondContact O-N 3.11Å; V781-L784 PolarHBondContact O-N 2.84Å; L784-S787 WeakPolarHBondContact O-CB 3.47Å; L784-S787 PolarHBondContact O-N 3.35Å; L784-S787 PolarHBondContact O-OG 2.87Å; L784-C790 PolarHBondContact O-SG 3.32Å
785	L	91.5	Very high	88.4	Confident	20 Å²	20	44 Å²	44	11%	0.105	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-45.4	178	-67.6	174.2	0	0	0	111.1	L769 V781 E782 S787 G788 L792 L819 L820	L769-L785 HydrophobicContact CD1-CD2 4.22Å; L769-L785 HydrophobicContact CD1-CG 4.41Å; L769-L785 HydrophobicContact CD2-CD2 4.31Å; V781-L785 HydrophobicContact CG1-CD1 3.67Å; V781-L785 HydrophobicContact CG1-CG 4.21Å; V781-L785 WeakPolarHBondContact O-CB 3.27Å; V781-L785 VanDerWaalsContact O-CG 3.27Å; V781-L785 WeakPolarHBondContact O-CG 3.38Å; V781-L785 PolarHBondContact O-N 3Å; E782-L785 PolarHBondContact O-N 3.31Å; L785-S787 PolarHBondContact O-N 3.33Å; L785-S787 VanDerWaalsContact O-N 3.1Å; L785-G788 PolarHBondContact O-N 3.28Å; L785-L792 HydrophobicContact CD2-CD2 3.52Å; L785-L819 HydrophobicContact CD1-CB 4.16Å; L785-L820 HydrophobicContact CD1-CD2 4.29Å; L785-L820 HydrophobicContact CD2-CD2 4.31Å
786	N	87.6	Confident	88.4	Confident	127 Å²	127	43.1 Å²	43.1	68%	0.679	24%	0.239	S	C	*	.	H	α-helix	trans	-64	-14.2	177.5	-71.9	-19.9	0	0	0	113.9	E782 G788	E782-N786 WeakPolarHBondContact O-CB 3.45Å; E782-N786 PolarHBondContact O-N 3.02Å; E782-N786 PolarHBondContact O-ND2 2.87Å; N786-G788 PolarHBondContact O-N 3.07Å
787	S	85.1	Confident	88.5	Confident	35 Å²	35	44.6 Å²	44.6	25%	0.245	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.1	169.2	79.1	0	0	0	0	113.6	L783 L784 L785 R789	L783-S787 PolarHBondContact O-N 3.16Å; L784-S787 WeakPolarHBondContact O-CB 3.47Å; L784-S787 PolarHBondContact O-N 3.35Å; L784-S787 PolarHBondContact O-OG 2.87Å; L785-S787 PolarHBondContact O-N 3.33Å; L785-S787 VanDerWaalsContact O-N 3.1Å; S787-R789 PolarHBondContact O-N 3.44Å; S787-R789 PolarHBondContact OG-N 2.96Å
788	G	81.4	Confident	88.5	Confident	32 Å²	32	45.7 Å²	45.7	33%	0.33	25%	0.25	S	S	.	.	S	Bend	trans	70.6	-9.1	-178.5	0	0	0	0	0	115.3	R130 L785 N786	R130-G788 PolarHBondContact NH1-O 3.39Å; L785-G788 PolarHBondContact O-N 3.28Å; N786-G788 PolarHBondContact O-N 3.07Å
789	R	87.4	Confident	88.7	Confident	94 Å²	94	43.4 Å²	43.4	36%	0.355	24%	0.236	S	C	.	.			trans	-95.5	-8.3	-174.7	-59.9	-163.3	-61.5	-109.5	7.2	114.9	L752 A756 P758 N759 S787	L752-R789 PolarHBondContact O-NH1 3.07Å; L752-R789 PolarHBondContact O-NH2 3.22Å; A756-R789 PolarHBondContact O-NH2 2.93Å; P758-R789 HydrophobicContact CG-CB 4.08Å; N759-R789 PolarHBondContact ND2-O 3.48Å; S787-R789 PolarHBondContact O-N 3.44Å; S787-R789 PolarHBondContact OG-N 2.96Å
790	C	88.1	Confident	88.9	Confident	11 Å²	11	42 Å²	42	7%	0.074	22%	0.22	C	C	.	.			trans	-74.7	137.3	-178.9	-71.8	0	0	0	0	112.7	P758 L784	P758-C790 VanDerWaalsContact CG-SG 3.59Å; L784-C790 PolarHBondContact O-SG 3.32Å
791	L	91.5	Very high	88.9	Confident	87 Å²	87	42 Å²	42	46%	0.455	22%	0.221	S	C	.	.			trans	-95.1	118.4	167.4	-59.9	176.1	0	0	0	109.4	N759 E794	N759-L791 HydrophobicContact CB-CD1 4.31Å; N759-L791 WeakPolarHBondContact OD1-CB 3.5Å; N759-L791 WeakPolarHBondContact OD1-CG 3.28Å; N759-L791 PolarHBondContact OD1-N 2.82Å; L791-E794 HydrophobicContact CB-CG 3.7Å; L791-E794 HydrophobicContact CD1-CG 4.12Å
792	L	90.9	Very high	89	Confident	31 Å²	31	42 Å²	42	16%	0.162	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-37.9	-175.6	-58.9	172	0	0	0	112.7	L769 L785 E794 L820 C823 A825	L769-L792 HydrophobicContact CD2-CD2 4.06Å; L785-L792 HydrophobicContact CD2-CD2 3.52Å; L792-E794 VanDerWaalsContact C-N 3.31Å; L792-E794 PolarHBondContact O-N 2.86Å; L792-L820 HydrophobicContact CD2-CD2 3.97Å; L792-C823 HydrophobicContact CD1-CB 3.86Å; L792-C823 WeakPolarHBondContact CD1-O 3.3Å; L792-C823 HydrophobicContact CD2-CB 4.4Å; L792-A825 HydrophobicContact CB-CB 4.26Å; L792-A825 HydrophobicContact CD1-CB 4.09Å
793	E	91.4	Very high	89.2	Confident	78 Å²	78	39.1 Å²	39.1	36%	0.364	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	7.1	-171.3	-54.7	-48	133.3	0	0	114.1	K795 A825 N826	E793-K795 PolarHBondContact O-N 2.96Å; E793-A825 WeakPolarHBondContact OE1-CA 3.37Å; E793-N826 PolarHBondContact OE1-N 3.42Å; E793-N826 WeakPolarHBondContact OE2-CB 3.1Å
794	E	92.6	Very high	89.3	Confident	60 Å²	60	37.6 Å²	37.6	28%	0.28	20%	0.199	S	C	.	.			trans	-63	126.8	170.9	-79.7	-68.7	-174	0	0	109.9	K761 T767 H770 L791 L792	K761-E794 WeakPolarHBondContact CE-OE2 3.17Å; K761-E794 IonicContact NZ-OE2 2.8Å; K761-E794 PolarHBondContact NZ-OE2 2.96Å; T767-E794 HydrophobicContact CG2-CB 3.98Å; T767-E794 HydrophobicContact CG2-CG 4.33Å; H770-E794 PolarHBondContact CE1-O 2.98Å; H770-E794 PolarHBondContact NE2-O 2.88Å; L791-E794 HydrophobicContact CB-CG 3.7Å; L791-E794 HydrophobicContact CD1-CG 4.12Å; L792-E794 VanDerWaalsContact C-N 3.31Å; L792-E794 PolarHBondContact O-N 2.86Å
795	K	89.3	Confident	89.2	Confident	50 Å²	50	38.3 Å²	38.3	22%	0.217	20%	0.203	C	C	.	.			trans	-93.3	136.9	175.9	-67.1	-171.9	173.5	-159.6	0	111.4	K761 E793 G799 C800 T801 E830 E833	K761-K795 PolarHBondContact NZ-O 2.86Å; E793-K795 PolarHBondContact O-N 2.96Å; K795-G799 WeakPolarHBondContact CD-O 3.4Å; K795-C800 WeakPolarHBondContact CA-O 3.3Å; K795-T801 HydrophobicContact CG-CG2 3.91Å; K795-E830 PolarHBondContact NZ-O 3.11Å; K795-E833 VanDerWaalsContact NZ-CD 3.29Å; K795-E833 IonicContact NZ-OE1 3.09Å; K795-E833 IonicContact NZ-OE2 3.57Å; K795-E833 PolarHBondContact NZ-OE2 3.28Å
796	D	89.2	Confident	89.3	Confident	9 Å²	9	37.3 Å²	37.3	5%	0.048	20%	0.198	C	C	.	.			trans	-74.4	-178.2	167	83.1	-11	0	0	0	112.3	R766 D798 G799 C800	R766-D796 HydrophobicContact CG-CB 3.57Å; R766-D796 IonicContact CZ-OD2 3.2Å; R766-D796 VanDerWaalsContact CZ-OD2 3.25Å; R766-D796 IonicContact NE-OD2 2.78Å; R766-D796 PolarHBondContact NE-OD2 3.41Å; R766-D796 IonicContact NH2-OD2 2.7Å; R766-D796 PolarHBondContact NH2-OD2 3.42Å; D796-D798 PolarHBondContact O-N 3.12Å; D796-D798 WeakPolarHBondContact OD1-CA 3.35Å; D796-D798 WeakPolarHBondContact OD1-CB 3.21Å; D796-D798 PolarHBondContact OD1-N 2.94Å; D796-G799 PolarHBondContact O-N 3.42Å; D796-G799 PolarHBondContact OD1-N 3.4Å; D796-C800 PolarHBondContact N-O 3.34Å; D796-C800 WeakPolarHBondContact OD1-CB 3.38Å; D796-C800 PolarHBondContact OD1-N 3.4Å
797	L	85.1	Confident	89.5	Confident	89 Å²	89	31.3 Å²	31.3	47%	0.466	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.1	178.4	-79.4	-176.9	0	0	0	113.5	L763 G764 G799 K835	L763-L797 VanDerWaalsContact O-CD1 3.22Å; L763-L797 WeakPolarHBondContact O-CD1 3.31Å; G764-L797 VanDerWaalsContact O-CB 3.32Å; G764-L797 WeakPolarHBondContact O-CB 3.21Å; G764-L797 WeakPolarHBondContact O-CG 3.44Å; G764-L797 PolarHBondContact O-N 2.84Å; L797-G799 PolarHBondContact O-N 3.15Å; L797-K835 WeakPolarHBondContact O-CD 3.24Å; L797-K835 WeakPolarHBondContact O-CE 3.2Å; L797-K835 PolarHBondContact O-NZ 3.44Å
798	D	82.1	Confident	89.9	Confident	53 Å²	53	31.8 Å²	31.8	28%	0.283	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	0.8	175.9	-61.8	-31.4	0	0	0	111.9	R766 D796 C800 G832	R766-D798 IonicContact NH2-OD2 3.8Å; R766-D798 PolarHBondContact NH2-OD2 3.47Å; D796-D798 PolarHBondContact O-N 3.12Å; D796-D798 WeakPolarHBondContact OD1-CA 3.35Å; D796-D798 WeakPolarHBondContact OD1-CB 3.21Å; D796-D798 PolarHBondContact OD1-N 2.94Å; D798-C800 VanDerWaalsContact C-N 3.27Å; D798-G832 PolarHBondContact O-N 3.33Å
799	G	86.1	Confident	90.3	Very high	9 Å²	9	34.9 Å²	34.9	9%	0.093	17%	0.165	C	C	.	.	S	Bend	trans	79.3	7.6	-174.9	0	0	0	0	0	113.3	K795 D796 L797	K795-G799 WeakPolarHBondContact CD-O 3.4Å; D796-G799 PolarHBondContact O-N 3.42Å; D796-G799 PolarHBondContact OD1-N 3.4Å; L797-G799 PolarHBondContact O-N 3.15Å
800	C	89.7	Confident	90.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	15%	0.149	C	C	.	.			trans	-80.4	132.4	-178.9	-62	0	0	0	0	110.2	H770 K795 D796 D798 L805 K808	H770-C800 PolarHBondContact NE2-O 3.32Å; H770-C800 VanDerWaalsContact NE2-O 3.1Å; K795-C800 WeakPolarHBondContact CA-O 3.3Å; D796-C800 PolarHBondContact N-O 3.34Å; D796-C800 WeakPolarHBondContact OD1-CB 3.38Å; D796-C800 PolarHBondContact OD1-N 3.4Å; D798-C800 VanDerWaalsContact C-N 3.27Å; C800-L805 HydrophobicContact CB-CB 4.38Å; C800-K808 PolarHBondContact SG-NZ 3.19Å
801	T	93	Very high	89.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.165	C	C	.	.			trans	-81.2	170.9	160.1	60.4	0	0	0	0	110.1	K795 A803 L804 L805 T829	K795-T801 HydrophobicContact CG-CG2 3.91Å; T801-A803 VanDerWaalsContact C-N 3.33Å; T801-A803 PolarHBondContact O-N 2.82Å; T801-L804 PolarHBondContact O-N 2.99Å; T801-L804 WeakPolarHBondContact OG1-CB 3.34Å; T801-L804 PolarHBondContact OG1-N 3.06Å; T801-L805 VanDerWaalsContact O-CB 3.3Å; T801-L805 WeakPolarHBondContact O-CB 3.36Å; T801-L805 PolarHBondContact O-N 3.41Å; T801-T829 HydrophobicContact CG2-CG2 4.15Å; T801-T829 PolarHBondContact OG1-OG1 2.91Å
802	A	93.2	Very high	88.9	Confident	1 Å²	1	37 Å²	37	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-58.6	-41.6	175.9	0	0	0	0	0	112.9	L769 V773 L805 A806 L820	L769-A802 HydrophobicContact CD2-CB 3.65Å; L769-A802 HydrophobicContact CG-CB 3.8Å; V773-A802 HydrophobicContact CG2-CB 4.25Å; A802-L805 PolarHBondContact O-N 3.41Å; A802-A806 PolarHBondContact O-N 3Å; A802-L820 HydrophobicContact CB-CD1 4.07Å; A802-L820 HydrophobicContact CB-CD2 4.1Å
803	A	93.5	Very high	88.6	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-41.7	178.9	0	0	0	0	0	111.8	T801 L805 A806 A807 F817 L820 A825 L827	T801-A803 VanDerWaalsContact C-N 3.33Å; T801-A803 PolarHBondContact O-N 2.82Å; A803-L805 VanDerWaalsContact C-N 3.35Å; A803-A806 PolarHBondContact O-N 3.13Å; A803-A807 PolarHBondContact O-N 3Å; A803-F817 HydrophobicContact CB-CE2 4.44Å; A803-F817 WeakPolarHBondContact O-CD2 3.49Å; A803-L820 HydrophobicContact CB-CB 4.34Å; A803-L820 HydrophobicContact CB-CD1 4.42Å; A803-A825 HydrophobicContact CB-CB 4.06Å; A803-L827 HydrophobicContact CB-CD2 4.3Å
804	L	92.6	Very high	88.3	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-37.5	177.2	-171.4	56.6	0	0	0	111.9	T801 A807 K808 D831 S847 C848	T801-L804 PolarHBondContact O-N 2.99Å; T801-L804 WeakPolarHBondContact OG1-CB 3.34Å; T801-L804 PolarHBondContact OG1-N 3.06Å; L804-A807 PolarHBondContact O-N 2.67Å; L804-K808 WeakPolarHBondContact O-CB 3.49Å; L804-K808 PolarHBondContact O-N 3.47Å; L804-D831 HydrophobicContact CD2-CB 3.71Å; L804-D831 VanDerWaalsContact CD2-N 3.33Å; L804-S847 VanDerWaalsContact CD1-C 3.48Å; L804-C848 HydrophobicContact CD1-CB 4.39Å; L804-C848 VanDerWaalsContact CD1-N 3.3Å
805	L	92.4	Very high	87.8	Confident	15 Å²	15	31 Å²	31	8%	0.079	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-39.3	173.5	-177.4	60.5	0	0	0	112.2	H770 V773 C800 T801 A802 A803 K808 R809	H770-L805 HydrophobicContact CB-CD2 4.32Å; V773-L805 HydrophobicContact CB-CD2 4.25Å; V773-L805 HydrophobicContact CG1-CB 4.26Å; V773-L805 HydrophobicContact CG1-CD2 4.11Å; V773-L805 HydrophobicContact CG1-CG 3.92Å; C800-L805 HydrophobicContact CB-CB 4.38Å; T801-L805 VanDerWaalsContact O-CB 3.3Å; T801-L805 WeakPolarHBondContact O-CB 3.36Å; T801-L805 PolarHBondContact O-N 3.41Å; A802-L805 PolarHBondContact O-N 3.41Å; A803-L805 VanDerWaalsContact C-N 3.35Å; L805-K808 PolarHBondContact O-N 2.83Å; L805-R809 WeakPolarHBondContact O-CG 3.28Å; L805-R809 PolarHBondContact O-N 3.23Å; L805-R809 VanDerWaalsContact O-N 3.1Å
806	A	93.1	Very high	87.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-46	173.8	0	0	0	0	0	111.6	V773 A802 A803 K808 R809 G810 C813 I816 F817 L820	V773-A806 HydrophobicContact CG1-CB 3.95Å; A802-A806 PolarHBondContact O-N 3Å; A803-A806 PolarHBondContact O-N 3.13Å; A806-K808 VanDerWaalsContact C-N 3.3Å; A806-K808 PolarHBondContact O-N 2.95Å; A806-R809 PolarHBondContact O-N 3.19Å; A806-G810 PolarHBondContact O-N 3.25Å; A806-C813 HydrophobicContact CB-CB 4.16Å; A806-I816 HydrophobicContact CB-CG2 4.28Å; A806-F817 HydrophobicContact CB-CB 4.13Å; A806-F817 HydrophobicContact CB-CD2 4.15Å; A806-L820 HydrophobicContact CB-CD1 4.39Å
807	A	92.7	Very high	87.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-34.9	175.3	0	0	0	0	0	113.3	A803 L804 G810 F817 C848 W851 N855 I860	A803-A807 PolarHBondContact O-N 3Å; L804-A807 PolarHBondContact O-N 2.67Å; A807-G810 PolarHBondContact O-N 3.49Å; A807-F817 HydrophobicContact CB-CD2 4.18Å; A807-F817 HydrophobicContact CB-CE2 3.93Å; A807-C848 HydrophobicContact CB-CB 3.97Å; A807-W851 HydrophobicContact CB-CB 4.48Å; A807-N855 PolarHBondContact O-ND2 3.25Å; A807-I860 HydrophobicContact CB-CD1 4.29Å; A807-I860 HydrophobicContact CB-CG2 4.38Å
808	K	91.8	Very high	87.9	Confident	46 Å²	46	24.5 Å²	24.5	20%	0.2	12%	0.118	C	C	.	.	H	α-helix	trans	-65.1	-34.8	175.5	-174.8	163.4	-174.7	163.6	0	112.8	C800 L804 L805 A806 D831 W851 N855	C800-K808 PolarHBondContact SG-NZ 3.19Å; L804-K808 WeakPolarHBondContact O-CB 3.49Å; L804-K808 PolarHBondContact O-N 3.47Å; L805-K808 PolarHBondContact O-N 2.83Å; A806-K808 VanDerWaalsContact C-N 3.3Å; A806-K808 PolarHBondContact O-N 2.95Å; K808-D831 IonicContact NZ-OD2 3.62Å; K808-D831 PolarHBondContact NZ-OD2 2.8Å; K808-W851 HydrophobicContact CB-CD2 3.96Å; K808-W851 HydrophobicContact CB-CE3 4.3Å; K808-W851 HydrophobicContact CB-CG 4.04Å; K808-W851 HydrophobicContact CD-CD2 4.22Å; K808-W851 HydrophobicContact CD-CH2 4.24Å; K808-W851 HydrophobicContact CD-CZ2 3.82Å; K808-W851 VanDerWaalsContact CE-CZ2 3.46Å; K808-W851 HydrophobicContact CG-CD2 3.74Å; K808-W851 HydrophobicContact CG-CE3 3.81Å; K808-W851 HydrophobicContact CG-CG 4.35Å; K808-W851 HydrophobicContact CG-CH2 4.11Å; K808-W851 HydrophobicContact CG-CZ2 4.05Å; K808-W851 HydrophobicContact CG-CZ3 3.98Å; K808-N855 PolarHBondContact O-ND2 2.65Å
809	R	89.7	Confident	88.2	Confident	96 Å²	96	23.9 Å²	23.9	36%	0.362	11%	0.114	S	C	.	.	H	α-helix	trans	-76.6	-31	170.8	-68	179	64.4	109.9	-2	113	S774 L805 A806 C813	S774-R809 PolarHBondContact O-NH1 3.4Å; L805-R809 WeakPolarHBondContact O-CG 3.28Å; L805-R809 PolarHBondContact O-N 3.23Å; L805-R809 VanDerWaalsContact O-N 3.1Å; A806-R809 PolarHBondContact O-N 3.19Å; R809-C813 HydrophobicContact CB-CB 4.21Å; R809-C813 VanDerWaalsContact CD-SG 3.54Å; R809-C813 PolarHBondContact NE-SG 3.39Å
810	G	83.9	Confident	88.5	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.01	11%	0.11	C	C	.	.			trans	79.2	-148.6	177	0	0	0	0	0	113.3	A806 A807 E812 C813	A806-G810 PolarHBondContact O-N 3.25Å; A807-G810 PolarHBondContact O-N 3.49Å; G810-E812 VanDerWaalsContact C-N 3.3Å; G810-E812 PolarHBondContact O-N 3.48Å; G810-C813 PolarHBondContact O-N 2.63Å
811	K	76.7	Confident	88.4	Confident	97 Å²	97	23.5 Å²	23.5	42%	0.422	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	-49.6	-38.4	-161.4	-70.4	-167	167.3	-147.9	0	116.7	C813 F814 D857	K811-C813 VanDerWaalsContact C-N 3.26Å; K811-C813 PolarHBondContact O-N 2.84Å; K811-F814 WeakPolarHBondContact O-CB 3.03Å; K811-F814 PolarHBondContact O-N 2.95Å; K811-D857 WeakPolarHBondContact CA-OD2 3.37Å; K811-D857 HydrophobicContact CG-CB 4.36Å; K811-D857 WeakPolarHBondContact CG-OD2 3.46Å; K811-D857 PolarHBondContact N-OD2 3.13Å
812	E	78.6	Confident	88	Confident	139 Å²	139	26.7 Å²	26.7	65%	0.65	13%	0.127	S	C	*	.	G	3₁₀ helix	trans	-56.9	-43.6	178.6	-62.5	179.6	164.2	0	0	110.8	G810 F814 P815	G810-E812 VanDerWaalsContact C-N 3.3Å; G810-E812 PolarHBondContact O-N 3.48Å; E812-F814 VanDerWaalsContact C-N 3.28Å; E812-F814 PolarHBondContact O-N 3.01Å; E812-P815 VanDerWaalsContact O-CD 3.31Å; E812-P815 WeakPolarHBondContact O-CD 3.35Å
813	C	83.9	Confident	87.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-85.7	12.1	177.7	-60.9	0	0	0	0	113.9	D776 A806 R809 G810 K811 P815 I816 F817	D776-C813 PolarHBondContact OD1-SG 3.28Å; A806-C813 HydrophobicContact CB-CB 4.16Å; R809-C813 HydrophobicContact CB-CB 4.21Å; R809-C813 VanDerWaalsContact CD-SG 3.54Å; R809-C813 PolarHBondContact NE-SG 3.39Å; G810-C813 PolarHBondContact O-N 2.63Å; K811-C813 VanDerWaalsContact C-N 3.26Å; K811-C813 PolarHBondContact O-N 2.84Å; C813-P815 VanDerWaalsContact C-CD 3.41Å; C813-I816 HydrophobicContact CB-CB 4.47Å; C813-I816 WeakPolarHBondContact O-CB 3.42Å; C813-I816 PolarHBondContact O-N 3.1Å; C813-I816 VanDerWaalsContact O-N 3.1Å; C813-F817 PolarHBondContact O-N 3Å
814	F	84.2	Confident	87.2	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.022	18%	0.176	C	C	.	.	H	α-helix	trans	-56.5	-42.1	176.9	-175.1	-109.9	0	0	0	114.3	K811 E812 I816 F817 C818 L859 I860 L863 W956 L960	K811-F814 WeakPolarHBondContact O-CB 3.03Å; K811-F814 PolarHBondContact O-N 2.95Å; E812-F814 VanDerWaalsContact C-N 3.28Å; E812-F814 PolarHBondContact O-N 3.01Å; F814-I816 PolarHBondContact O-N 2.96Å; F814-F817 PolarHBondContact O-N 3.27Å; F814-C818 WeakPolarHBondContact CZ-SG 3.04Å; F814-C818 PolarHBondContact O-N 2.92Å; F814-C818 PolarHBondContact O-SG 3.38Å; F814-L859 HydrophobicContact CD1-CB 4.24Å; F814-L859 HydrophobicContact CD1-CD1 3.71Å; F814-L859 HydrophobicContact CD2-CB 3.79Å; F814-L859 HydrophobicContact CE1-CB 4.04Å; F814-L859 HydrophobicContact CE1-CD1 3.8Å; F814-L859 HydrophobicContact CE2-CB 3.56Å; F814-L859 HydrophobicContact CG-CB 4.14Å; F814-L859 HydrophobicContact CG-CD1 4.19Å; F814-L859 HydrophobicContact CZ-CB 3.72Å; F814-L859 HydrophobicContact CZ-CD1 4.34Å; F814-I860 HydrophobicContact CD2-CD1 4.43Å; F814-I860 HydrophobicContact CD2-CG1 3.59Å; F814-I860 HydrophobicContact CE2-CG1 4.04Å; F814-L863 HydrophobicContact CE2-CD2 4.28Å; F814-L863 HydrophobicContact CZ-CD2 4.41Å; F814-W956 AromaticContact CE1-CD1 3.74Å; F814-W956 HydrophobicContact CE1-CD2 4.21Å; F814-W956 AromaticContact CE1-CE2 3.94Å; F814-W956 HydrophobicContact CE1-CG 4.11Å; F814-W956 AromaticContact CE1-NE1 3.64Å; F814-W956 AromaticContact CZ-CD1 4Å; F814-W956 HydrophobicContact CZ-CD2 4.27Å; F814-W956 AromaticContact CZ-CE2 3.56Å; F814-W956 AromaticContact CZ-CZ2 3.83Å; F814-W956 HydrophobicContact CZ-CZ2 3.83Å; F814-W956 AromaticContact CZ-NE1 3.38Å; F814-L960 HydrophobicContact CD1-CD2 3.97Å; F814-L960 HydrophobicContact CE1-CD2 4.47Å
815	P	83.7	Confident	87.1	Confident	38 Å²	38	35.5 Å²	35.5	25%	0.247	18%	0.179	C	C	.	.	H	α-helix	trans	-60.8	-36.7	175	-12.8	23	0	0	0	112.2	E812 C813 C818 L819 L960	E812-P815 VanDerWaalsContact O-CD 3.31Å; E812-P815 WeakPolarHBondContact O-CD 3.35Å; C813-P815 VanDerWaalsContact C-CD 3.41Å; P815-C818 PolarHBondContact O-N 3.44Å; P815-L819 WeakPolarHBondContact O-CG 3.3Å; P815-L819 PolarHBondContact O-N 3.04Å; P815-L819 VanDerWaalsContact O-N 3.16Å; P815-L960 HydrophobicContact CB-CD2 3.86Å; P815-L960 HydrophobicContact CG-CD2 3.6Å
816	I	89.1	Confident	86.9	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-71.5	-39	179.1	-69.1	176.1	0	0	0	110.6	V773 D776 V781 A806 C813 F814 C818 L819 L820	V773-I816 HydrophobicContact CB-CG2 4.39Å; V773-I816 HydrophobicContact CG1-CG2 4.28Å; V773-I816 HydrophobicContact CG2-CG2 3.78Å; D776-I816 WeakPolarHBondContact OD1-CD1 3.34Å; V781-I816 HydrophobicContact CG1-CG2 4.37Å; V781-I816 HydrophobicContact CG2-CD1 4.14Å; V781-I816 HydrophobicContact CG2-CG1 4.2Å; V781-I816 HydrophobicContact CG2-CG2 4.07Å; A806-I816 HydrophobicContact CB-CG2 4.28Å; C813-I816 HydrophobicContact CB-CB 4.47Å; C813-I816 WeakPolarHBondContact O-CB 3.42Å; C813-I816 PolarHBondContact O-N 3.1Å; C813-I816 VanDerWaalsContact O-N 3.1Å; F814-I816 PolarHBondContact O-N 2.96Å; I816-C818 VanDerWaalsContact C-N 3.34Å; I816-C818 PolarHBondContact O-N 3.02Å; I816-L819 PolarHBondContact O-N 3.18Å; I816-L820 HydrophobicContact CG2-CD1 4.04Å; I816-L820 WeakPolarHBondContact O-CD1 3.45Å; I816-L820 VanDerWaalsContact O-CG 3.32Å; I816-L820 WeakPolarHBondContact O-CG 3.45Å; I816-L820 PolarHBondContact O-N 2.04Å; I816-L820 VanDerWaalsContact O-N 3.16Å
817	F	89.6	Confident	86.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-41.5	173.3	-170.9	-94.5	0	0	0	111.3	A803 A806 A807 C813 F814 L820 V821 L827 C848 I860 L863 L864	A803-F817 HydrophobicContact CB-CE2 4.44Å; A803-F817 WeakPolarHBondContact O-CD2 3.49Å; A806-F817 HydrophobicContact CB-CB 4.13Å; A806-F817 HydrophobicContact CB-CD2 4.15Å; A807-F817 HydrophobicContact CB-CD2 4.18Å; A807-F817 HydrophobicContact CB-CE2 3.93Å; C813-F817 PolarHBondContact O-N 3Å; F814-F817 PolarHBondContact O-N 3.27Å; F817-L820 PolarHBondContact O-N 3.03Å; F817-V821 HydrophobicContact CD1-CG2 3.83Å; F817-V821 HydrophobicContact CE1-CG2 3.53Å; F817-V821 HydrophobicContact CZ-CG2 4.05Å; F817-V821 VanDerWaalsContact O-CG2 3.23Å; F817-V821 WeakPolarHBondContact O-CG2 3.5Å; F817-V821 PolarHBondContact O-N 2.85Å; F817-L827 HydrophobicContact CE2-CD2 4.33Å; F817-L827 HydrophobicContact CZ-CD2 3.94Å; F817-C848 HydrophobicContact CE2-CB 4.42Å; F817-I860 HydrophobicContact CB-CD1 4.41Å; F817-I860 HydrophobicContact CD1-CD1 4.46Å; F817-I860 HydrophobicContact CD1-CG1 4.09Å; F817-I860 HydrophobicContact CD1-CG2 4.26Å; F817-I860 HydrophobicContact CD2-CD1 4.4Å; F817-I860 HydrophobicContact CE1-CG1 4.47Å; F817-I860 HydrophobicContact CE1-CG2 3.81Å; F817-I860 HydrophobicContact CE2-CG2 4.25Å; F817-I860 HydrophobicContact CG-CD1 4.17Å; F817-I860 HydrophobicContact CG-CG1 4.3Å; F817-I860 HydrophobicContact CZ-CG2 3.81Å; F817-L863 HydrophobicContact CD1-CD2 4.03Å; F817-L863 HydrophobicContact CE1-CD2 4.1Å; F817-L863 HydrophobicContact CE1-CG 4.44Å; F817-L864 HydrophobicContact CZ-CD2 4.25Å
818	C	86.9	Confident	86.4	Confident	11 Å²	11	41.7 Å²	41.7	7%	0.074	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-51.7	172.6	-67.6	0	0	0	0	112.5	F814 P815 I816 L820 V821 D822	F814-C818 WeakPolarHBondContact CZ-SG 3.04Å; F814-C818 PolarHBondContact O-N 2.92Å; F814-C818 PolarHBondContact O-SG 3.38Å; P815-C818 PolarHBondContact O-N 3.44Å; I816-C818 VanDerWaalsContact C-N 3.34Å; I816-C818 PolarHBondContact O-N 3.02Å; C818-L820 PolarHBondContact O-N 2.75Å; C818-L820 VanDerWaalsContact O-N 3.14Å; C818-V821 CarbonylContact O-C 3.34Å; C818-V821 WeakPolarHBondContact O-CB 3.5Å; C818-V821 PolarHBondContact O-N 3.1Å; C818-D822 PolarHBondContact O-N 2.65Å
819	L	87.9	Confident	86.1	Confident	40 Å²	40	40.2 Å²	40.2	21%	0.209	21%	0.21	C	C	.	.	H	α-helix	trans	-55.7	-33.8	178.6	-70.5	172.1	0	0	0	113	V781 E782 L785 P815 I816 C823	V781-L819 HydrophobicContact CB-CD1 4.42Å; V781-L819 HydrophobicContact CG1-CB 4.38Å; V781-L819 HydrophobicContact CG1-CD1 4.17Å; E782-L819 HydrophobicContact CB-CD1 4.41Å; L785-L819 HydrophobicContact CD1-CB 4.16Å; P815-L819 WeakPolarHBondContact O-CG 3.3Å; P815-L819 PolarHBondContact O-N 3.04Å; P815-L819 VanDerWaalsContact O-N 3.16Å; I816-L819 PolarHBondContact O-N 3.18Å; L819-C823 PolarHBondContact O-N 3.26Å
820	L	91.5	Very high	85.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-77.2	-37.8	177.1	-66	165.4	0	0	0	112.3	L769 V773 L785 L792 A802 A803 A806 I816 F817 C818 D822 C823 A825	L769-L820 HydrophobicContact CD1-CD2 4.4Å; L769-L820 HydrophobicContact CD2-CD2 4.08Å; V773-L820 HydrophobicContact CG2-CD1 4.26Å; L785-L820 HydrophobicContact CD1-CD2 4.29Å; L785-L820 HydrophobicContact CD2-CD2 4.31Å; L792-L820 HydrophobicContact CD2-CD2 3.97Å; A802-L820 HydrophobicContact CB-CD1 4.07Å; A802-L820 HydrophobicContact CB-CD2 4.1Å; A803-L820 HydrophobicContact CB-CB 4.34Å; A803-L820 HydrophobicContact CB-CD1 4.42Å; A806-L820 HydrophobicContact CB-CD1 4.39Å; I816-L820 HydrophobicContact CG2-CD1 4.04Å; I816-L820 WeakPolarHBondContact O-CD1 3.45Å; I816-L820 VanDerWaalsContact O-CG 3.32Å; I816-L820 WeakPolarHBondContact O-CG 3.45Å; I816-L820 PolarHBondContact O-N 2.04Å; I816-L820 VanDerWaalsContact O-N 3.16Å; F817-L820 PolarHBondContact O-N 3.03Å; C818-L820 PolarHBondContact O-N 2.75Å; C818-L820 VanDerWaalsContact O-N 3.14Å; L820-D822 VanDerWaalsContact C-N 3.28Å; L820-D822 PolarHBondContact O-N 3.31Å; L820-C823 PolarHBondContact O-N 2.99Å; L820-A825 HydrophobicContact CB-CB 4.26Å; L820-A825 WeakPolarHBondContact O-CB 3.47Å; L820-A825 PolarHBondContact O-N 2.81Å; L820-A825 VanDerWaalsContact O-N 3.08Å
821	V	88.1	Confident	85.9	Confident	2 Å²	2	38 Å²	38	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-33.2	172.1	169.8	0	0	0	0	111.7	F817 C818 C823 D824 L827 L863 R867	F817-V821 HydrophobicContact CD1-CG2 3.83Å; F817-V821 HydrophobicContact CE1-CG2 3.53Å; F817-V821 HydrophobicContact CZ-CG2 4.05Å; F817-V821 VanDerWaalsContact O-CG2 3.23Å; F817-V821 WeakPolarHBondContact O-CG2 3.5Å; F817-V821 PolarHBondContact O-N 2.85Å; C818-V821 CarbonylContact O-C 3.34Å; C818-V821 WeakPolarHBondContact O-CB 3.5Å; C818-V821 PolarHBondContact O-N 3.1Å; V821-C823 VanDerWaalsContact C-N 3.31Å; V821-D824 PolarHBondContact O-N 2.94Å; V821-L827 HydrophobicContact CG2-CD1 3.88Å; V821-L827 HydrophobicContact CG2-CD2 3.65Å; V821-L827 HydrophobicContact CG2-CG 4.4Å; V821-L863 HydrophobicContact CB-CD2 4.37Å; V821-L863 HydrophobicContact CG1-CD1 4.27Å; V821-L863 HydrophobicContact CG1-CD2 4.23Å; V821-L863 HydrophobicContact CG1-CG 4.33Å; V821-L863 HydrophobicContact CG2-CD2 4.05Å; V821-L863 HydrophobicContact CG2-CG 4.47Å; V821-R867 HydrophobicContact CG1-CG 4.12Å; V821-R867 PolarHBondContact O-NH2 3.16Å
822	D	84.2	Confident	85.6	Confident	67 Å²	67	33.6 Å²	33.6	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-78.8	-16.1	179.4	-62.6	-23.4	0	0	0	113.1	C818 L820 D824 R867 W968	C818-D822 PolarHBondContact O-N 2.65Å; L820-D822 VanDerWaalsContact C-N 3.28Å; L820-D822 PolarHBondContact O-N 3.31Å; D822-D824 VanDerWaalsContact C-N 3.35Å; D822-R867 IonicContact OD1-NH2 3.65Å; D822-R867 PolarHBondContact OD1-NH2 2.83Å; D822-W968 WeakPolarHBondContact OD1-CH2 3.31Å; D822-W968 WeakPolarHBondContact OD1-CZ2 3.47Å; D822-W968 WeakPolarHBondContact OD2-CZ2 3.31Å
823	C	85.5	Confident	84.4	Confident	59 Å²	59	33.1 Å²	33.1	40%	0.399	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	14.9	166.3	-68.4	0	0	0	0	113.1	L792 L819 L820 V821 A825	L792-C823 HydrophobicContact CD1-CB 3.86Å; L792-C823 WeakPolarHBondContact CD1-O 3.3Å; L792-C823 HydrophobicContact CD2-CB 4.4Å; L819-C823 PolarHBondContact O-N 3.26Å; L820-C823 PolarHBondContact O-N 2.99Å; V821-C823 VanDerWaalsContact C-N 3.31Å; C823-A825 PolarHBondContact O-N 2.79Å
824	D	85.8	Confident	82.7	Confident	120 Å²	120	37.4 Å²	37.4	64%	0.642	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	37.7	179.8	-65.5	-39	0	0	0	115	V821 D822 R867	V821-D824 PolarHBondContact O-N 2.94Å; D822-D824 VanDerWaalsContact C-N 3.35Å; D824-R867 IonicContact OD1-NH1 3.71Å; D824-R867 PolarHBondContact OD1-NH1 3.3Å
825	A	89.5	Confident	81.1	Confident	8 Å²	8	41.2 Å²	41.2	7%	0.066	24%	0.244	C	C	.	.			trans	-62.2	145.9	172.7	0	0	0	0	0	113	L792 E793 A803 L820 C823 L827	L792-A825 HydrophobicContact CB-CB 4.26Å; L792-A825 HydrophobicContact CD1-CB 4.09Å; E793-A825 WeakPolarHBondContact OE1-CA 3.37Å; A803-A825 HydrophobicContact CB-CB 4.06Å; L820-A825 HydrophobicContact CB-CB 4.26Å; L820-A825 WeakPolarHBondContact O-CB 3.47Å; L820-A825 PolarHBondContact O-N 2.81Å; L820-A825 VanDerWaalsContact O-N 3.08Å; C823-A825 PolarHBondContact O-N 2.79Å; A825-L827 VanDerWaalsContact O-CD2 3.29Å; A825-L827 WeakPolarHBondContact O-CD2 3.48Å; A825-L827 WeakPolarHBondContact O-CG 3.28Å; A825-L827 PolarHBondContact O-N 3.11Å; A825-L827 VanDerWaalsContact O-N 3.11Å
826	N	88.7	Confident	79.5	Confident	58 Å²	58	47.1 Å²	47.1	31%	0.31	27%	0.269	S	S	.	.			trans	-79.2	99.9	-175.6	-175	1.5	0	0	0	113.1	E793 T828 T829	E793-N826 PolarHBondContact OE1-N 3.42Å; E793-N826 WeakPolarHBondContact OE2-CB 3.1Å; N826-T828 VanDerWaalsContact C-N 3.25Å; N826-T828 PolarHBondContact O-N 3.08Å; N826-T828 PolarHBondContact OD1-N 3.17Å; N826-T828 PolarHBondContact OD1-OG1 2.93Å; N826-T829 HydrophobicContact CB-CG2 4.09Å; N826-T829 WeakPolarHBondContact O-CG2 3.18Å; N826-T829 PolarHBondContact O-N 3.18Å; N826-T829 PolarHBondContact O-OG1 2.56Å
827	L	90.2	Very high	77.4	Confident	12 Å²	12	51 Å²	51	6%	0.063	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.3	-177.3	-43	-179.1	0	0	0	114.2	A803 F817 V821 A825 T829 C848 L864 R867 A869	A803-L827 HydrophobicContact CB-CD2 4.3Å; F817-L827 HydrophobicContact CE2-CD2 4.33Å; F817-L827 HydrophobicContact CZ-CD2 3.94Å; V821-L827 HydrophobicContact CG2-CD1 3.88Å; V821-L827 HydrophobicContact CG2-CD2 3.65Å; V821-L827 HydrophobicContact CG2-CG 4.4Å; A825-L827 VanDerWaalsContact O-CD2 3.29Å; A825-L827 WeakPolarHBondContact O-CD2 3.48Å; A825-L827 WeakPolarHBondContact O-CG 3.28Å; A825-L827 PolarHBondContact O-N 3.11Å; A825-L827 VanDerWaalsContact O-N 3.11Å; L827-T829 VanDerWaalsContact C-N 3.34Å; L827-C848 PolarHBondContact O-SG 3.26Å; L827-L864 HydrophobicContact CB-CD2 3.67Å; L827-L864 HydrophobicContact CD1-CD2 3.96Å; L827-L864 HydrophobicContact CG-CD2 4.4Å; L827-R867 HydrophobicContact CD1-CB 4.33Å; L827-A869 HydrophobicContact CB-CB 4.02Å; L827-A869 HydrophobicContact CD1-CB 4.14Å
828	T	84.8	Confident	75.4	Confident	75 Å²	75	56.8 Å²	56.8	46%	0.46	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.4	-180	68.2	0	0	0	0	113.7	N826	N826-T828 VanDerWaalsContact C-N 3.25Å; N826-T828 PolarHBondContact O-N 3.08Å; N826-T828 PolarHBondContact OD1-N 3.17Å; N826-T828 PolarHBondContact OD1-OG1 2.93Å
829	T	85.6	Confident	73.3	Confident	16 Å²	16	61.3 Å²	61.3	10%	0.098	36%	0.358	C	S	.	.			trans	-60.8	140	179.7	47.7	0	0	0	0	112.7	T801 N826 L827 S847	T801-T829 HydrophobicContact CG2-CG2 4.15Å; T801-T829 PolarHBondContact OG1-OG1 2.91Å; N826-T829 HydrophobicContact CB-CG2 4.09Å; N826-T829 WeakPolarHBondContact O-CG2 3.18Å; N826-T829 PolarHBondContact O-N 3.18Å; N826-T829 PolarHBondContact O-OG1 2.56Å; L827-T829 VanDerWaalsContact C-N 3.34Å; T829-S847 VanDerWaalsContact O-CA 3.28Å; T829-S847 WeakPolarHBondContact O-CA 3.49Å
830	E	85.7	Confident	71.3	Confident	46 Å²	46	62 Å²	62	22%	0.215	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-108.2	146.6	174.1	-65.1	-176.3	169.4	0	0	111	K795 A845 R846 S873	K795-E830 PolarHBondContact NZ-O 3.11Å; E830-A845 HydrophobicContact CB-CB 4.42Å; E830-R846 WeakPolarHBondContact CA-O 3.35Å; E830-S873 PolarHBondContact OE1-OG 2.94Å
831	D	83.7	Confident	69.2	Low	3 Å²	3	66.4 Å²	66.4	2%	0.016	40%	0.399	C	S	.	.	S	Bend	trans	-82.5	172.4	173.8	65	0.4	0	0	0	111.7	L804 K808 E833 A845 R846 W851	L804-D831 HydrophobicContact CD2-CB 3.71Å; L804-D831 VanDerWaalsContact CD2-N 3.33Å; K808-D831 IonicContact NZ-OD2 3.62Å; K808-D831 PolarHBondContact NZ-OD2 2.8Å; D831-E833 PolarHBondContact O-N 2.89Å; D831-A845 VanDerWaalsContact O-CA 3.27Å; D831-A845 WeakPolarHBondContact O-CA 3.4Å; D831-A845 WeakPolarHBondContact O-CB 3.36Å; D831-R846 PolarHBondContact N-O 3.15Å; D831-R846 VanDerWaalsContact N-O 3.16Å; D831-R846 WeakPolarHBondContact OD1-CB 3.16Å; D831-R846 PolarHBondContact OD1-N 3.31Å; D831-W851 WeakPolarHBondContact OD2-CZ2 3.46Å; D831-W851 PolarHBondContact OD2-NE1 3.34Å; D831-W851 VanDerWaalsContact OD2-NE1 3.13Å
832	G	69.6	Low	67.4	Low	6 Å²	6	68.4 Å²	68.4	6%	0.062	42%	0.415	C	S	.	.	S	Bend	trans	68.4	-1.5	176.6	0	0	0	0	0	117.2	D798 G834 K835	D798-G832 PolarHBondContact O-N 3.33Å; G832-G834 PolarHBondContact O-N 3.12Å; G832-G834 VanDerWaalsContact O-N 3.1Å; G832-K835 PolarHBondContact O-N 3.2Å
833	E	54.5	Low	66.2	Low	129 Å²	129	67.6 Å²	67.6	60%	0.603	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	117.6	176.9	-85.8	-173.9	163.9	0	0	112	K795 D831 K835	K795-E833 VanDerWaalsContact NZ-CD 3.29Å; K795-E833 IonicContact NZ-OE1 3.09Å; K795-E833 IonicContact NZ-OE2 3.57Å; K795-E833 PolarHBondContact NZ-OE2 3.28Å; D831-E833 PolarHBondContact O-N 2.89Å; E833-K835 PolarHBondContact O-N 3.02Å
834	G	48.4	Very low	65.2	Low	90 Å²	90	65.8 Å²	65.8	93%	0.928	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	4.5	178.7	0	0	0	0	0	116.3	G832	G832-G834 PolarHBondContact O-N 3.12Å; G832-G834 VanDerWaalsContact O-N 3.1Å
835	K	51.1	Low	65	Low	84 Å²	84	60.8 Å²	60.8	37%	0.365	37%	0.374	S	S	.	.			trans	-109.6	126.3	179.1	-80.1	-167	163.9	-170	0	114.8	L797 G832 E833 I843	L797-K835 WeakPolarHBondContact O-CD 3.24Å; L797-K835 WeakPolarHBondContact O-CE 3.2Å; L797-K835 PolarHBondContact O-NZ 3.44Å; G832-K835 PolarHBondContact O-N 3.2Å; E833-K835 PolarHBondContact O-N 3.02Å; K835-I843 HydrophobicContact CB-CD1 3.76Å; K835-I843 HydrophobicContact CB-CG1 4.37Å; K835-I843 HydrophobicContact CD-CD1 4.25Å; K835-I843 PolarHBondContact O-N 2.84Å
836	Q	48.8	Very low	65	Low	162 Å²	162	61.4 Å²	61.4	76%	0.757	37%	0.374	S	S	*	.	B	Isolated β-bridge	trans	-98.3	141.8	162.4	-66	173.7	-13.5	0	0	109
837	E	46.3	Very low	65.2	Low	83 Å²	83	58.6 Å²	58.6	39%	0.388	36%	0.359	S	S	.	.			trans	-63.5	154.8	166	-70.6	-173.6	174	0	0	110.3	N839 G840 N841 I843	E837-N839 WeakPolarHBondContact CB-OD1 3.49Å; E837-N839 PolarHBondContact O-N 2.96Å; E837-N839 PolarHBondContact OE2-ND2 2.85Å; E837-N839 PolarHBondContact OE2-OD1 2.72Å; E837-G840 PolarHBondContact O-N 3.19Å; E837-N841 HydrophobicContact CB-CB 4.21Å; E837-N841 HydrophobicContact CG-CB 4.32Å; E837-N841 PolarHBondContact N-O 2.94Å; E837-N841 WeakPolarHBondContact OE2-CB 3.39Å; E837-N841 PolarHBondContact OE2-ND2 3.42Å; E837-N841 VanDerWaalsContact OE2-ND2 3.15Å; E837-I843 HydrophobicContact CG-CG1 4.04Å
838	A	46.3	Very low	65.3	Low	121 Å²	121	58 Å²	58	100%	1	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-6.2	179.5	0	0	0	0	0	114.6
839	N	43.6	Very low	65.8	Low	107 Å²	107	54.5 Å²	54.5	57%	0.572	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-4.9	174.1	59.2	27.3	0	0	0	113.3	E837 N841	E837-N839 WeakPolarHBondContact CB-OD1 3.49Å; E837-N839 PolarHBondContact O-N 2.96Å; E837-N839 PolarHBondContact OE2-ND2 2.85Å; E837-N839 PolarHBondContact OE2-OD1 2.72Å; N839-N841 PolarHBondContact ND2-ND2 3.06Å; N839-N841 VanDerWaalsContact OD1-CB 3.3Å; N839-N841 WeakPolarHBondContact OD1-CB 3.26Å; N839-N841 VanDerWaalsContact OD1-CG 3.22Å; N839-N841 PolarHBondContact OD1-N 3.21Å; N839-N841 PolarHBondContact OD1-ND2 3.31Å
840	G	44.8	Very low	66.2	Low	55 Å²	55	53.7 Å²	53.7	57%	0.567	33%	0.33	S	S	*	.	S	Bend	trans	95.4	-4.3	-177.8	0	0	0	0	0	116	E837	E837-G840 PolarHBondContact O-N 3.19Å
841	N	47.5	Very low	66.6	Low	92 Å²	92	53.1 Å²	53.1	49%	0.492	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-69.4	147.1	173.5	-61.9	-29.4	0	0	0	110.9	E837 N839	E837-N841 HydrophobicContact CB-CB 4.21Å; E837-N841 HydrophobicContact CG-CB 4.32Å; E837-N841 PolarHBondContact N-O 2.94Å; E837-N841 WeakPolarHBondContact OE2-CB 3.39Å; E837-N841 PolarHBondContact OE2-ND2 3.42Å; E837-N841 VanDerWaalsContact OE2-ND2 3.15Å; N839-N841 PolarHBondContact ND2-ND2 3.06Å; N839-N841 VanDerWaalsContact OD1-CB 3.3Å; N839-N841 WeakPolarHBondContact OD1-CB 3.26Å; N839-N841 VanDerWaalsContact OD1-CG 3.22Å; N839-N841 PolarHBondContact OD1-N 3.21Å; N839-N841 PolarHBondContact OD1-ND2 3.31Å
842	A	51.6	Low	67.1	Low	44 Å²	44	53 Å²	53	36%	0.364	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-73.9	135.3	167	0	0	0	0	0	109.8	S844	A842-S844 PolarHBondContact O-N 3.27Å
843	I	58.3	Low	68.3	Low	50 Å²	50	52.7 Å²	52.7	26%	0.256	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-62.6	133.3	162	-62	-174.5	0	0	0	106.8	K835 E837 A845 S876	K835-I843 HydrophobicContact CB-CD1 3.76Å; K835-I843 HydrophobicContact CB-CG1 4.37Å; K835-I843 HydrophobicContact CD-CD1 4.25Å; K835-I843 PolarHBondContact O-N 2.84Å; E837-I843 HydrophobicContact CG-CG1 4.04Å; I843-A845 PolarHBondContact O-N 2.75Å; I843-S876 PolarHBondContact O-OG 2.83Å
844	S	65.2	Low	70.2	Confident	20 Å²	20	48.3 Å²	48.3	14%	0.14	30%	0.302	C	S	.	.			trans	-67.9	93.8	-174.7	177.6	0	0	0	0	110.7	A842 R846 D875 S876 R879	A842-S844 PolarHBondContact O-N 3.27Å; S844-R846 WeakPolarHBondContact O-CD 3.42Å; S844-R846 WeakPolarHBondContact O-CG 3.47Å; S844-R846 PolarHBondContact O-N 3.32Å; S844-R846 WeakPolarHBondContact OG-CD 3.25Å; S844-R846 PolarHBondContact OG-NE 3.32Å; S844-D875 PolarHBondContact OG-OD2 2.88Å; S844-S876 VanDerWaalsContact CA-OG 3.28Å; S844-S876 WeakPolarHBondContact CA-OG 3.49Å; S844-R879 PolarHBondContact OG-NH2 3.22Å
845	A	81	Confident	72.3	Confident	15 Å²	15	46.7 Å²	46.7	12%	0.124	27%	0.271	C	S	.	.			trans	-63	108.8	-175.8	0	0	0	0	0	111	E830 D831 I843 D875 S876	E830-A845 HydrophobicContact CB-CB 4.42Å; D831-A845 VanDerWaalsContact O-CA 3.27Å; D831-A845 WeakPolarHBondContact O-CA 3.4Å; D831-A845 WeakPolarHBondContact O-CB 3.36Å; I843-A845 PolarHBondContact O-N 2.75Å; A845-D875 WeakPolarHBondContact O-CA 3.1Å; A845-D875 WeakPolarHBondContact O-CB 3.19Å; A845-S876 PolarHBondContact N-OG 3.3Å
846	R	89.2	Confident	74.3	Confident	21 Å²	21	44.3 Å²	44.3	8%	0.079	26%	0.263	C	S	.	.			trans	-129.3	129.5	-168.8	-77.1	159.2	166.1	-145	-7.8	111.4	E830 D831 S844 H850 W851 D875 L884	E830-R846 WeakPolarHBondContact CA-O 3.35Å; D831-R846 PolarHBondContact N-O 3.15Å; D831-R846 VanDerWaalsContact N-O 3.16Å; D831-R846 WeakPolarHBondContact OD1-CB 3.16Å; D831-R846 PolarHBondContact OD1-N 3.31Å; S844-R846 WeakPolarHBondContact O-CD 3.42Å; S844-R846 WeakPolarHBondContact O-CG 3.47Å; S844-R846 PolarHBondContact O-N 3.32Å; S844-R846 WeakPolarHBondContact OG-CD 3.25Å; S844-R846 PolarHBondContact OG-NE 3.32Å; R846-H850 HydrophobicContact CB-CB 3.81Å; R846-H850 HydrophobicContact CG-CB 3.88Å; R846-W851 VanDerWaalsContact NH1-CH2 3.32Å; R846-D875 HydrophobicContact CG-CB 4.1Å; R846-D875 IonicContact NE-OD2 3.71Å; R846-L884 HydrophobicContact CG-CD1 4.49Å
847	S	92.5	Very high	76.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-83.2	172.1	173	55.8	0	0	0	0	113.2	L804 T829 T849 H850 W851 C871	L804-S847 VanDerWaalsContact CD1-C 3.48Å; T829-S847 VanDerWaalsContact O-CA 3.28Å; T829-S847 WeakPolarHBondContact O-CA 3.49Å; S847-T849 PolarHBondContact O-N 2.86Å; S847-T849 VanDerWaalsContact O-N 3.1Å; S847-H850 WeakPolarHBondContact O-CB 3.3Å; S847-H850 PolarHBondContact O-N 3.48Å; S847-H850 PolarHBondContact OG-ND1 3.1Å; S847-W851 PolarHBondContact O-N 3.15Å; S847-C871 VanDerWaalsContact OG-CB 3.25Å; S847-C871 WeakPolarHBondContact OG-CB 3.4Å; S847-C871 PolarHBondContact OG-SG 2.84Å
848	C	93	Very high	78.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-52.8	-34.5	176.7	-61.1	0	0	0	0	112.3	L804 A807 F817 L827 A852 L864	L804-C848 HydrophobicContact CD1-CB 4.39Å; L804-C848 VanDerWaalsContact CD1-N 3.3Å; A807-C848 HydrophobicContact CB-CB 3.97Å; F817-C848 HydrophobicContact CE2-CB 4.42Å; L827-C848 PolarHBondContact O-SG 3.26Å; C848-A852 VanDerWaalsContact O-CB 3.26Å; C848-A852 WeakPolarHBondContact O-CB 3.4Å; C848-A852 PolarHBondContact O-N 3.2Å; C848-L864 HydrophobicContact CB-CD1 4.1Å; C848-L864 HydrophobicContact CB-CD2 3.97Å
849	T	94.8	Very high	80.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-40.7	177.2	-52.8	0	0	0	0	112	S847 A853 L861 L870 C871 A881 L897 F902	S847-T849 PolarHBondContact O-N 2.86Å; S847-T849 VanDerWaalsContact O-N 3.1Å; T849-A853 WeakPolarHBondContact O-CB 3.03Å; T849-A853 PolarHBondContact O-N 3.29Å; T849-L861 HydrophobicContact CG2-CD2 3.98Å; T849-L870 HydrophobicContact CG2-CD2 3.69Å; T849-C871 PolarHBondContact OG1-N 3.29Å; T849-A881 HydrophobicContact CG2-CB 3.79Å; T849-L897 HydrophobicContact CG2-CD2 4.46Å; T849-F902 HydrophobicContact CG2-CE1 4.45Å; T849-F902 HydrophobicContact CG2-CZ 4.16Å
850	H	94.1	Very high	82.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.6	-42.7	178	-74.9	91.4	0	0	0	112	R846 S847 Q854 S873 R879 N880 A881 L884	R846-H850 HydrophobicContact CB-CB 3.81Å; R846-H850 HydrophobicContact CG-CB 3.88Å; S847-H850 WeakPolarHBondContact O-CB 3.3Å; S847-H850 PolarHBondContact O-N 3.48Å; S847-H850 PolarHBondContact OG-ND1 3.1Å; H850-Q854 WeakPolarHBondContact O-CB 3.35Å; H850-Q854 PolarHBondContact O-N 3.19Å; H850-S873 PolarHBondContact CE1-O 2.91Å; H850-S873 PolarHBondContact CE1-OG 2.87Å; H850-S873 PolarHBondContact NE2-O 3.42Å; H850-R879 PolarHBondContact NE2-O 2.88Å; H850-R879 VanDerWaalsContact NE2-O 3.14Å; H850-N880 WeakPolarHBondContact NE2-CA 3.17Å; H850-A881 PolarHBondContact CD2-N 3.22Å; H850-A881 PolarHBondContact NE2-N 3.04Å; H850-L884 HydrophobicContact CB-CD1 3.72Å
851	W	94.2	Very high	84.6	Confident	33 Å²	33	21.7 Å²	21.7	13%	0.125	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-47.2	177.1	-74.2	109.3	0	0	0	112.5	A807 K808 D831 R846 S847 A853 Q854 N855	A807-W851 HydrophobicContact CB-CB 4.48Å; K808-W851 HydrophobicContact CB-CD2 3.96Å; K808-W851 HydrophobicContact CB-CE3 4.3Å; K808-W851 HydrophobicContact CB-CG 4.04Å; K808-W851 HydrophobicContact CD-CD2 4.22Å; K808-W851 HydrophobicContact CD-CH2 4.24Å; K808-W851 HydrophobicContact CD-CZ2 3.82Å; K808-W851 VanDerWaalsContact CE-CZ2 3.46Å; K808-W851 HydrophobicContact CG-CD2 3.74Å; K808-W851 HydrophobicContact CG-CE3 3.81Å; K808-W851 HydrophobicContact CG-CG 4.35Å; K808-W851 HydrophobicContact CG-CH2 4.11Å; K808-W851 HydrophobicContact CG-CZ2 4.05Å; K808-W851 HydrophobicContact CG-CZ3 3.98Å; D831-W851 WeakPolarHBondContact OD2-CZ2 3.46Å; D831-W851 PolarHBondContact OD2-NE1 3.34Å; D831-W851 VanDerWaalsContact OD2-NE1 3.13Å; R846-W851 VanDerWaalsContact NH1-CH2 3.32Å; S847-W851 PolarHBondContact O-N 3.15Å; W851-A853 VanDerWaalsContact C-N 3.31Å; W851-A853 PolarHBondContact O-N 3.15Å; W851-Q854 PolarHBondContact O-N 2.75Å; W851-N855 WeakPolarHBondContact O-CB 3.18Å; W851-N855 VanDerWaalsContact O-CG 3.23Å; W851-N855 PolarHBondContact O-N 3.43Å
852	A	94.3	Very high	86.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.1	-39.5	176.6	0	0	0	0	0	112.6	C848 N855 N856 D857 I860 L861	C848-A852 VanDerWaalsContact O-CB 3.26Å; C848-A852 WeakPolarHBondContact O-CB 3.4Å; C848-A852 PolarHBondContact O-N 3.2Å; A852-N855 PolarHBondContact O-N 3.29Å; A852-N856 PolarHBondContact O-N 3.01Å; A852-N856 VanDerWaalsContact O-N 3.17Å; A852-D857 HydrophobicContact CB-CB 4.26Å; A852-D857 PolarHBondContact O-N 3.28Å; A852-I860 HydrophobicContact CB-CB 3.84Å; A852-I860 HydrophobicContact CB-CG2 3.6Å; A852-L861 HydrophobicContact CB-CD2 3.86Å; A852-L861 HydrophobicContact CB-CG 3.84Å
853	A	95.2	Very high	87.9	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.1	-42.4	174.4	0	0	0	0	0	113.1	T849 W851 N855 N856 L861 A881 A885 L897	T849-A853 WeakPolarHBondContact O-CB 3.03Å; T849-A853 PolarHBondContact O-N 3.29Å; W851-A853 VanDerWaalsContact C-N 3.31Å; W851-A853 PolarHBondContact O-N 3.15Å; A853-N855 VanDerWaalsContact C-N 3.29Å; A853-N855 PolarHBondContact O-N 3.03Å; A853-N856 PolarHBondContact O-N 2.95Å; A853-L861 HydrophobicContact CB-CD2 4.45Å; A853-A881 HydrophobicContact CB-CB 3.8Å; A853-A881 WeakPolarHBondContact CB-O 3.14Å; A853-A885 HydrophobicContact CB-CB 4.26Å; A853-L897 HydrophobicContact CB-CD1 3.68Å
854	Q	93.9	Very high	89.4	Confident	38 Å²	38	14 Å²	14	18%	0.178	7%	0.073	C	C	.	.	H	α-helix	trans	-65.1	-33.8	175.5	-164.4	-165.4	-110.3	0	0	112	H850 W851 L884 K888 C890	H850-Q854 WeakPolarHBondContact O-CB 3.35Å; H850-Q854 PolarHBondContact O-N 3.19Å; W851-Q854 PolarHBondContact O-N 2.75Å; Q854-L884 HydrophobicContact CB-CB 4.37Å; Q854-K888 HydrophobicContact CG-CG 3.75Å; Q854-C890 PolarHBondContact O-SG 3.32Å
855	N	92.8	Very high	90.3	Very high	55 Å²	55	14.4 Å²	14.4	29%	0.294	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	3.3	-176.8	-64.6	-7.6	0	0	0	113.4	A807 K808 W851 A852 A853 D857	A807-N855 PolarHBondContact O-ND2 3.25Å; K808-N855 PolarHBondContact O-ND2 2.65Å; W851-N855 WeakPolarHBondContact O-CB 3.18Å; W851-N855 VanDerWaalsContact O-CG 3.23Å; W851-N855 PolarHBondContact O-N 3.43Å; A852-N855 PolarHBondContact O-N 3.29Å; A853-N855 VanDerWaalsContact C-N 3.29Å; A853-N855 PolarHBondContact O-N 3.03Å; N855-D857 PolarHBondContact O-N 2.87Å
856	N	93.5	Very high	90.2	Very high	35 Å²	35	14.1 Å²	14.1	19%	0.187	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	36.6	-172	-164.1	73.3	0	0	0	113.1	A852 A853 L858 C890 Q892 A893	A852-N856 PolarHBondContact O-N 3.01Å; A852-N856 VanDerWaalsContact O-N 3.17Å; A853-N856 PolarHBondContact O-N 2.95Å; N856-L858 PolarHBondContact O-N 3.46Å; N856-C890 HydrophobicContact CB-CB 3.75Å; N856-C890 VanDerWaalsContact OD1-C 3.28Å; N856-C890 WeakPolarHBondContact OD1-CA 3.38Å; N856-C890 WeakPolarHBondContact OD1-CB 3.28Å; N856-C890 PolarHBondContact OD1-O 2.91Å; N856-Q892 PolarHBondContact ND2-OE1 2.95Å; N856-Q892 PolarHBondContact OD1-N 2.67Å; N856-A893 PolarHBondContact OD1-N 3.43Å; N856-A893 VanDerWaalsContact OD1-N 3.12Å
857	D	91.2	Very high	89.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.081	C	C	.	.			trans	-89.1	88	-177.5	-162.8	-34.3	0	0	0	111.1	K811 A852 N855 L859 I860 L861	K811-D857 WeakPolarHBondContact CA-OD2 3.37Å; K811-D857 HydrophobicContact CG-CB 4.36Å; K811-D857 WeakPolarHBondContact CG-OD2 3.46Å; K811-D857 PolarHBondContact N-OD2 3.13Å; A852-D857 HydrophobicContact CB-CB 4.26Å; A852-D857 PolarHBondContact O-N 3.28Å; N855-D857 PolarHBondContact O-N 2.87Å; D857-L859 PolarHBondContact O-N 2.94Å; D857-L859 PolarHBondContact OD1-N 2.75Å; D857-I860 HydrophobicContact CB-CB 4.33Å; D857-I860 PolarHBondContact OD1-N 3.25Å; D857-I860 WeakPolarHBondContact OD2-CD1 3.41Å; D857-L861 WeakPolarHBondContact O-CB 3.47Å; D857-L861 VanDerWaalsContact O-CG 3.29Å; D857-L861 WeakPolarHBondContact O-CG 3.05Å; D857-L861 PolarHBondContact O-N 2.81Å
858	L	89.1	Confident	89.4	Confident	44 Å²	44	23.5 Å²	23.5	23%	0.23	11%	0.112	C	C	.	.	H	α-helix	trans	-62.2	-27.1	174.2	-75.9	-168.3	0	0	0	113.5	N856 N862 Q892 F896	N856-L858 PolarHBondContact O-N 3.46Å; L858-N862 VanDerWaalsContact O-CB 3.24Å; L858-N862 WeakPolarHBondContact O-CB 3.33Å; L858-N862 PolarHBondContact O-N 3.43Å; L858-N862 PolarHBondContact O-ND2 2.76Å; L858-Q892 HydrophobicContact CD1-CB 3.97Å; L858-Q892 HydrophobicContact CD1-CG 4.5Å; L858-Q892 HydrophobicContact CD2-CB 4.21Å; L858-Q892 HydrophobicContact CG-CB 4.08Å; L858-F896 HydrophobicContact CD2-CB 3.76Å; L858-F896 HydrophobicContact CD2-CD2 3.98Å; L858-F896 HydrophobicContact CD2-CG 4.03Å
859	L	85.9	Confident	89.1	Confident	8 Å²	8	24 Å²	24	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-74.8	-44.2	-176.8	-64.2	-170.9	0	0	0	110.5	F814 D857 N862 L863 L952 E959	F814-L859 HydrophobicContact CD1-CB 4.24Å; F814-L859 HydrophobicContact CD1-CD1 3.71Å; F814-L859 HydrophobicContact CD2-CB 3.79Å; F814-L859 HydrophobicContact CE1-CB 4.04Å; F814-L859 HydrophobicContact CE1-CD1 3.8Å; F814-L859 HydrophobicContact CE2-CB 3.56Å; F814-L859 HydrophobicContact CG-CB 4.14Å; F814-L859 HydrophobicContact CG-CD1 4.19Å; F814-L859 HydrophobicContact CZ-CB 3.72Å; F814-L859 HydrophobicContact CZ-CD1 4.34Å; D857-L859 PolarHBondContact O-N 2.94Å; D857-L859 PolarHBondContact OD1-N 2.75Å; L859-N862 PolarHBondContact O-N 2.82Å; L859-L863 WeakPolarHBondContact O-CB 3.5Å; L859-L863 PolarHBondContact O-N 2.82Å; L859-L952 HydrophobicContact CD2-CD2 3.96Å; L859-E959 WeakPolarHBondContact CD1-OE2 3.45Å
860	I	88.6	Confident	88.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.5	-44.8	173	-62	-177.3	0	0	0	110.7	A807 F814 F817 A852 D857 N862 L863 L864	A807-I860 HydrophobicContact CB-CD1 4.29Å; A807-I860 HydrophobicContact CB-CG2 4.38Å; F814-I860 HydrophobicContact CD2-CD1 4.43Å; F814-I860 HydrophobicContact CD2-CG1 3.59Å; F814-I860 HydrophobicContact CE2-CG1 4.04Å; F817-I860 HydrophobicContact CB-CD1 4.41Å; F817-I860 HydrophobicContact CD1-CD1 4.46Å; F817-I860 HydrophobicContact CD1-CG1 4.09Å; F817-I860 HydrophobicContact CD1-CG2 4.26Å; F817-I860 HydrophobicContact CD2-CD1 4.4Å; F817-I860 HydrophobicContact CE1-CG1 4.47Å; F817-I860 HydrophobicContact CE1-CG2 3.81Å; F817-I860 HydrophobicContact CE2-CG2 4.25Å; F817-I860 HydrophobicContact CG-CD1 4.17Å; F817-I860 HydrophobicContact CG-CG1 4.3Å; F817-I860 HydrophobicContact CZ-CG2 3.81Å; A852-I860 HydrophobicContact CB-CB 3.84Å; A852-I860 HydrophobicContact CB-CG2 3.6Å; D857-I860 HydrophobicContact CB-CB 4.33Å; D857-I860 PolarHBondContact OD1-N 3.25Å; D857-I860 WeakPolarHBondContact OD2-CD1 3.41Å; I860-N862 VanDerWaalsContact C-N 3.33Å; I860-N862 PolarHBondContact O-N 3.46Å; I860-L863 PolarHBondContact O-N 2.63Å; I860-L864 HydrophobicContact CG2-CD1 3.77Å; I860-L864 HydrophobicContact CG2-CG 4.19Å; I860-L864 WeakPolarHBondContact O-CB 3.45Å; I860-L864 VanDerWaalsContact O-CG 3.24Å; I860-L864 WeakPolarHBondContact O-CG 3.42Å; I860-L864 PolarHBondContact O-N 3.37Å
861	L	90.5	Very high	88.5	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-40.1	177	-75.6	178.8	0	0	0	113.1	T849 A852 A853 D857 W865 L870 A893 F896 L897	T849-L861 HydrophobicContact CG2-CD2 3.98Å; A852-L861 HydrophobicContact CB-CD2 3.86Å; A852-L861 HydrophobicContact CB-CG 3.84Å; A853-L861 HydrophobicContact CB-CD2 4.45Å; D857-L861 WeakPolarHBondContact O-CB 3.47Å; D857-L861 VanDerWaalsContact O-CG 3.29Å; D857-L861 WeakPolarHBondContact O-CG 3.05Å; D857-L861 PolarHBondContact O-N 2.81Å; L861-W865 PolarHBondContact O-N 3.31Å; L861-W865 VanDerWaalsContact O-N 3.15Å; L861-L870 HydrophobicContact CD2-CD2 4.15Å; L861-A893 HydrophobicContact CD1-CB 3.8Å; L861-F896 HydrophobicContact CB-CD1 3.99Å; L861-F896 HydrophobicContact CB-CE1 3.69Å; L861-F896 HydrophobicContact CB-CZ 3.99Å; L861-F896 HydrophobicContact CD1-CD1 4.08Å; L861-F896 WeakPolarHBondContact O-CZ 3.37Å; L861-L897 HydrophobicContact CD2-CD2 4.21Å
862	N	84.3	Confident	88.2	Confident	18 Å²	18	29.2 Å²	29.2	10%	0.096	14%	0.144	C	C	.	.	H	α-helix	trans	-66.6	-44.4	173.7	-88.6	-76.2	0	0	0	112.1	L858 L859 I860 L864 W865 L866 F896 L952	L858-N862 VanDerWaalsContact O-CB 3.24Å; L858-N862 WeakPolarHBondContact O-CB 3.33Å; L858-N862 PolarHBondContact O-N 3.43Å; L858-N862 PolarHBondContact O-ND2 2.76Å; L859-N862 PolarHBondContact O-N 2.82Å; I860-N862 VanDerWaalsContact C-N 3.33Å; I860-N862 PolarHBondContact O-N 3.46Å; N862-L864 VanDerWaalsContact C-N 3.35Å; N862-L864 PolarHBondContact O-N 3.5Å; N862-W865 WeakPolarHBondContact O-CB 3.5Å; N862-W865 PolarHBondContact O-N 2.97Å; N862-W865 VanDerWaalsContact O-N 3.15Å; N862-L866 WeakPolarHBondContact O-CB 3.29Å; N862-L866 VanDerWaalsContact O-CG 3.28Å; N862-L866 WeakPolarHBondContact O-CG 3.35Å; N862-L866 PolarHBondContact O-N 3.15Å; N862-F896 HydrophobicContact CB-CE2 4.38Å; N862-F896 WeakPolarHBondContact OD1-CE2 3.27Å; N862-L952 HydrophobicContact CB-CD1 3.49Å; N862-L952 VanDerWaalsContact CB-CD1 3.49Å; N862-L952 HydrophobicContact CB-CD2 3.75Å; N862-L952 HydrophobicContact CB-CG 4.27Å
863	L	84.5	Confident	87.8	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-65	-39.3	-179.5	-176.4	49.5	0	0	0	111.9	F814 F817 V821 L859 I860 W865 L866 R867 W956	F814-L863 HydrophobicContact CE2-CD2 4.28Å; F814-L863 HydrophobicContact CZ-CD2 4.41Å; F817-L863 HydrophobicContact CD1-CD2 4.03Å; F817-L863 HydrophobicContact CE1-CD2 4.1Å; F817-L863 HydrophobicContact CE1-CG 4.44Å; V821-L863 HydrophobicContact CB-CD2 4.37Å; V821-L863 HydrophobicContact CG1-CD1 4.27Å; V821-L863 HydrophobicContact CG1-CD2 4.23Å; V821-L863 HydrophobicContact CG1-CG 4.33Å; V821-L863 HydrophobicContact CG2-CD2 4.05Å; V821-L863 HydrophobicContact CG2-CG 4.47Å; L859-L863 WeakPolarHBondContact O-CB 3.5Å; L859-L863 PolarHBondContact O-N 2.82Å; I860-L863 PolarHBondContact O-N 2.63Å; L863-W865 VanDerWaalsContact C-N 3.33Å; L863-W865 PolarHBondContact O-N 3.15Å; L863-L866 PolarHBondContact O-N 3.3Å; L863-R867 HydrophobicContact CD1-CG 4.15Å; L863-R867 PolarHBondContact O-N 3.21Å; L863-W956 HydrophobicContact CB-CZ2 4.26Å; L863-W956 HydrophobicContact CD1-CH2 3.79Å; L863-W956 HydrophobicContact CD1-CZ2 3.96Å; L863-W956 HydrophobicContact CD2-CH2 4.04Å; L863-W956 HydrophobicContact CD2-CZ2 3.99Å; L863-W956 HydrophobicContact CG-CH2 4.44Å; L863-W956 HydrophobicContact CG-CZ2 4.3Å
864	L	89.5	Confident	87.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.1	-44.6	170.8	-71.9	165.8	0	0	0	111.2	F817 L827 C848 I860 N862 R867 D868 A869 L870	F817-L864 HydrophobicContact CZ-CD2 4.25Å; L827-L864 HydrophobicContact CB-CD2 3.67Å; L827-L864 HydrophobicContact CD1-CD2 3.96Å; L827-L864 HydrophobicContact CG-CD2 4.4Å; C848-L864 HydrophobicContact CB-CD1 4.1Å; C848-L864 HydrophobicContact CB-CD2 3.97Å; I860-L864 HydrophobicContact CG2-CD1 3.77Å; I860-L864 HydrophobicContact CG2-CG 4.19Å; I860-L864 WeakPolarHBondContact O-CB 3.45Å; I860-L864 VanDerWaalsContact O-CG 3.24Å; I860-L864 WeakPolarHBondContact O-CG 3.42Å; I860-L864 PolarHBondContact O-N 3.37Å; N862-L864 VanDerWaalsContact C-N 3.35Å; N862-L864 PolarHBondContact O-N 3.5Å; L864-R867 PolarHBondContact O-N 3.25Å; L864-D868 PolarHBondContact O-N 2.83Å; L864-A869 HydrophobicContact CD2-CB 4.14Å; L864-A869 CarbonylContact O-C 3.25Å; L864-A869 WeakPolarHBondContact O-CA 3.4Å; L864-A869 PolarHBondContact O-N 3.46Å; L864-L870 HydrophobicContact CB-CD2 3.96Å; L864-L870 HydrophobicContact CB-CG 4.35Å; L864-L870 PolarHBondContact O-N 3.24Å
865	W	84.6	Confident	87	Confident	29 Å²	29	32.7 Å²	32.7	11%	0.11	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-42.9	176.7	-168.2	37.4	0	0	0	112.5	L861 N862 L863 R867 D868 L870 F896 R900 I938 L940 V948	L861-W865 PolarHBondContact O-N 3.31Å; L861-W865 VanDerWaalsContact O-N 3.15Å; N862-W865 WeakPolarHBondContact O-CB 3.5Å; N862-W865 PolarHBondContact O-N 2.97Å; N862-W865 VanDerWaalsContact O-N 3.15Å; L863-W865 VanDerWaalsContact C-N 3.33Å; L863-W865 PolarHBondContact O-N 3.15Å; W865-R867 PolarHBondContact O-N 3.36Å; W865-D868 PolarHBondContact O-N 3.4Å; W865-D868 VanDerWaalsContact O-N 3.1Å; W865-L870 HydrophobicContact CB-CD1 3.69Å; W865-L870 HydrophobicContact CB-CG 3.92Å; W865-L870 HydrophobicContact CG-CD1 3.76Å; W865-L870 HydrophobicContact CG-CG 4.44Å; W865-F896 HydrophobicContact CB-CZ 4.2Å; W865-F896 HydrophobicContact CE3-CZ 4.44Å; W865-R900 VanDerWaalsContact CE3-NE 3.3Å; W865-R900 HydrophobicContact CZ2-CG 3.89Å; W865-R900 VanDerWaalsContact CZ2-NE 3.28Å; W865-I938 HydrophobicContact CH2-CG2 4.14Å; W865-I938 HydrophobicContact CZ2-CG2 4.2Å; W865-L940 HydrophobicContact CD2-CD1 3.79Å; W865-L940 HydrophobicContact CE3-CD1 3.85Å; W865-L940 HydrophobicContact CH2-CD1 3.7Å; W865-L940 HydrophobicContact CH2-CD2 3.41Å; W865-L940 VanDerWaalsContact CH2-CD2 3.41Å; W865-L940 HydrophobicContact CH2-CG 3.55Å; W865-L940 HydrophobicContact CZ2-CD1 3.62Å; W865-L940 HydrophobicContact CZ2-CD2 3.8Å; W865-L940 HydrophobicContact CZ2-CG 3.4Å; W865-L940 HydrophobicContact CZ3-CD1 3.76Å; W865-L940 HydrophobicContact CZ3-CD2 3.95Å; W865-L940 HydrophobicContact CZ3-CG 4.13Å; W865-V948 HydrophobicContact CE3-CG1 4.21Å; W865-V948 HydrophobicContact CZ3-CG1 4.02Å; W865-V948 HydrophobicContact CZ3-CG2 3.99Å
866	L	79.4	Confident	86.4	Confident	9 Å²	9	32.8 Å²	32.8	5%	0.047	17%	0.167	C	C	.	.	H	α-helix	trans	-71.2	-14.8	-179.7	-72.6	169.9	0	0	0	114.5	N862 L863 R945 V948 M949 L952	N862-L866 WeakPolarHBondContact O-CB 3.29Å; N862-L866 VanDerWaalsContact O-CG 3.28Å; N862-L866 WeakPolarHBondContact O-CG 3.35Å; N862-L866 PolarHBondContact O-N 3.15Å; L863-L866 PolarHBondContact O-N 3.3Å; L866-R945 HydrophobicContact CD2-CG 3.85Å; L866-R945 PolarHBondContact O-NE 3.08Å; L866-R945 PolarHBondContact O-NH2 3.24Å; L866-V948 HydrophobicContact CD1-CG1 4.26Å; L866-V948 HydrophobicContact CD2-CB 4.35Å; L866-V948 HydrophobicContact CD2-CG1 3.97Å; L866-V948 HydrophobicContact CG-CG1 4.29Å; L866-M949 HydrophobicContact CB-SD 4.06Å; L866-M949 HydrophobicContact CD1-CG 4.23Å; L866-M949 HydrophobicContact CD1-SD 3.49Å; L866-M949 WeakPolarHBondContact CD1-SD 3.41Å; L866-M949 HydrophobicContact CD2-CG 3.71Å; L866-M949 HydrophobicContact CD2-SD 3.82Å; L866-M949 HydrophobicContact CG-CG 4.5Å; L866-M949 HydrophobicContact CG-SD 3.99Å; L866-L952 HydrophobicContact CD1-CD1 3.38Å; L866-L952 HydrophobicContact CG-CD1 4.48Å
867	R	80.4	Confident	86	Confident	96 Å²	96	33.1 Å²	33.1	36%	0.362	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	15.1	171.5	-68.2	-74.2	-164.3	135.3	3.8	112.4	V821 D822 D824 L827 L863 L864 W865 A869	V821-R867 HydrophobicContact CG1-CG 4.12Å; V821-R867 PolarHBondContact O-NH2 3.16Å; D822-R867 IonicContact OD1-NH2 3.65Å; D822-R867 PolarHBondContact OD1-NH2 2.83Å; D824-R867 IonicContact OD1-NH1 3.71Å; D824-R867 PolarHBondContact OD1-NH1 3.3Å; L827-R867 HydrophobicContact CD1-CB 4.33Å; L863-R867 HydrophobicContact CD1-CG 4.15Å; L863-R867 PolarHBondContact O-N 3.21Å; L864-R867 PolarHBondContact O-N 3.25Å; W865-R867 PolarHBondContact O-N 3.36Å; R867-A869 PolarHBondContact O-N 3.33Å; R867-A869 VanDerWaalsContact O-N 3.15Å
868	D	83	Confident	85.7	Confident	122 Å²	122	33.8 Å²	33.8	65%	0.652	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	26.9	-176.6	-57	-53.9	0	0	0	114.6	L864 W865 R945	L864-D868 PolarHBondContact O-N 2.83Å; W865-D868 PolarHBondContact O-N 3.4Å; W865-D868 VanDerWaalsContact O-N 3.1Å; D868-R945 VanDerWaalsContact CG-NH1 3.33Å; D868-R945 VanDerWaalsContact CG-NH2 3.34Å; D868-R945 IonicContact OD1-CZ 2.84Å; D868-R945 IonicContact OD1-NH1 3.91Å; D868-R945 PolarHBondContact OD1-NH1 2.9Å; D868-R945 VanDerWaalsContact OD1-NH1 3.09Å; D868-R945 IonicContact OD1-NH2 2.75Å; D868-R945 IonicContact OD2-CZ 3.36Å; D868-R945 IonicContact OD2-NH1 2.82Å; D868-R945 PolarHBondContact OD2-NH1 3.45Å; D868-R945 IonicContact OD2-NH2 2.66Å; D868-R945 PolarHBondContact OD2-NH2 3.32Å
869	A	87.7	Confident	85.7	Confident	11 Å²	11	33.7 Å²	33.7	9%	0.091	17%	0.172	C	C	.	.			trans	-111.9	20	-172.8	0	0	0	0	0	113.8	L827 L864 R867 C871	L827-A869 HydrophobicContact CB-CB 4.02Å; L827-A869 HydrophobicContact CD1-CB 4.14Å; L864-A869 HydrophobicContact CD2-CB 4.14Å; L864-A869 CarbonylContact O-C 3.25Å; L864-A869 WeakPolarHBondContact O-CA 3.4Å; L864-A869 PolarHBondContact O-N 3.46Å; R867-A869 PolarHBondContact O-N 3.33Å; R867-A869 VanDerWaalsContact O-N 3.15Å; A869-C871 PolarHBondContact O-N 2.92Å; A869-C871 VanDerWaalsContact O-N 3.17Å
870	L	88.4	Confident	86.1	Confident	17 Å²	17	33.5 Å²	33.5	9%	0.089	17%	0.171	C	C	.	.			trans	-66.6	112.6	167.3	-84.5	-178.5	0	0	0	109.5	T849 L861 L864 W865 H872 F896 F902	T849-L870 HydrophobicContact CG2-CD2 3.69Å; L861-L870 HydrophobicContact CD2-CD2 4.15Å; L864-L870 HydrophobicContact CB-CD2 3.96Å; L864-L870 HydrophobicContact CB-CG 4.35Å; L864-L870 PolarHBondContact O-N 3.24Å; W865-L870 HydrophobicContact CB-CD1 3.69Å; W865-L870 HydrophobicContact CB-CG 3.92Å; W865-L870 HydrophobicContact CG-CD1 3.76Å; W865-L870 HydrophobicContact CG-CG 4.44Å; L870-H872 PolarHBondContact O-CD2 3.44Å; L870-H872 VanDerWaalsContact O-CD2 3.23Å; L870-H872 PolarHBondContact O-N 3.38Å; L870-F896 HydrophobicContact CD1-CE1 4.04Å; L870-F896 HydrophobicContact CD2-CE1 4.29Å; L870-F902 HydrophobicContact CB-CZ 4.43Å; L870-F902 HydrophobicContact CD1-CE2 4.27Å
871	C	88.7	Confident	86.3	Confident	18 Å²	18	33.5 Å²	33.5	12%	0.122	17%	0.171	C	C	.	.			trans	-83.2	112.5	-178.8	-168.3	0	0	0	0	110.3	S847 T849 A869 S873 F902	S847-C871 VanDerWaalsContact OG-CB 3.25Å; S847-C871 WeakPolarHBondContact OG-CB 3.4Å; S847-C871 PolarHBondContact OG-SG 2.84Å; T849-C871 PolarHBondContact OG1-N 3.29Å; A869-C871 PolarHBondContact O-N 2.92Å; A869-C871 VanDerWaalsContact O-N 3.17Å; C871-S873 VanDerWaalsContact C-N 3.29Å; C871-S873 PolarHBondContact SG-OG 3.42Å; C871-F902 WeakPolarHBondContact O-CE1 3.4Å
872	H	87.9	Confident	86.6	Confident	107 Å²	107	33.5 Å²	33.5	50%	0.495	17%	0.171	S	C	.	.			trans	-86.6	8.4	176.8	-68.2	-96.4	0	0	0	113.4	L870 F902	L870-H872 PolarHBondContact O-CD2 3.44Å; L870-H872 VanDerWaalsContact O-CD2 3.23Å; L870-H872 PolarHBondContact O-N 3.38Å; H872-F902 AromaticContact CE1-CD2 3.66Å; H872-F902 AromaticContact CE1-CE2 3.27Å; H872-F902 WeakPolarHBondContact CE1-CE2 3.47Å; H872-F902 AromaticContact CE1-CZ 3.77Å; H872-F902 AromaticContact CG-CZ 3.94Å; H872-F902 AromaticContact ND1-CD2 3.77Å; H872-F902 AromaticContact ND1-CE1 3.97Å; H872-F902 AromaticContact ND1-CE2 3.51Å; H872-F902 AromaticContact ND1-CZ 3.62Å; H872-F902 AromaticContact NE2-CE2 3.86Å
873	S	85.2	Confident	87.1	Confident	13 Å²	13	33 Å²	33	9%	0.091	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-63.3	167.6	177.3	71.4	0	0	0	0	112.2	E830 H850 C871 N880	E830-S873 PolarHBondContact OE1-OG 2.94Å; H850-S873 PolarHBondContact CE1-O 2.91Å; H850-S873 PolarHBondContact CE1-OG 2.87Å; H850-S873 PolarHBondContact NE2-O 3.42Å; C871-S873 VanDerWaalsContact C-N 3.29Å; C871-S873 PolarHBondContact SG-OG 3.42Å; S873-N880 WeakPolarHBondContact O-CB 3.32Å
874	Q	86.6	Confident	87.6	Confident	93 Å²	93	32.7 Å²	32.7	44%	0.435	17%	0.167	S	C	.	.	B	Isolated β-bridge	trans	-103.3	140.7	162.1	-72.6	174.4	-2	0	0	108.1	G878 R879 N880	Q874-G878 VanDerWaalsContact CD-O 3.23Å; Q874-G878 WeakPolarHBondContact CG-O 3.33Å; Q874-G878 PolarHBondContact OE1-O 3.27Å; Q874-R879 WeakPolarHBondContact CA-O 3.44Å; Q874-N880 HydrophobicContact CG-CB 4.24Å
875	D	85.6	Confident	87.9	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.032	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-62.2	169.6	170.2	69.3	20.2	0	0	0	112.2	S844 A845 R846 L877 G878 R879	S844-D875 PolarHBondContact OG-OD2 2.88Å; A845-D875 WeakPolarHBondContact O-CA 3.1Å; A845-D875 WeakPolarHBondContact O-CB 3.19Å; R846-D875 HydrophobicContact CG-CB 4.1Å; R846-D875 IonicContact NE-OD2 3.71Å; D875-L877 PolarHBondContact O-N 3.25Å; D875-L877 WeakPolarHBondContact OD1-CA 3.29Å; D875-L877 WeakPolarHBondContact OD1-CB 3.43Å; D875-L877 PolarHBondContact OD1-N 3.36Å; D875-G878 PolarHBondContact O-N 3.22Å; D875-G878 PolarHBondContact OD1-N 2.88Å; D875-R879 PolarHBondContact N-O 3.43Å; D875-R879 WeakPolarHBondContact OD1-CB 3.43Å; D875-R879 PolarHBondContact OD1-N 2.74Å; D875-R879 IonicContact OD1-NE 3.3Å; D875-R879 PolarHBondContact OD1-NE 3.34Å; D875-R879 IonicContact OD1-NH2 2.7Å; D875-R879 IonicContact OD2-CZ 3.71Å; D875-R879 IonicContact OD2-NE 3.59Å; D875-R879 PolarHBondContact OD2-NE 2.98Å; D875-R879 IonicContact OD2-NH2 3.11Å; D875-R879 PolarHBondContact OD2-NH2 3.11Å
876	S	80.4	Confident	88.4	Confident	57 Å²	57	31.3 Å²	31.3	40%	0.399	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-0.3	179	60.6	0	0	0	0	115	I843 S844 A845	I843-S876 PolarHBondContact O-OG 2.83Å; S844-S876 VanDerWaalsContact CA-OG 3.28Å; S844-S876 WeakPolarHBondContact CA-OG 3.49Å; A845-S876 PolarHBondContact N-OG 3.3Å
877	L	83.9	Confident	89.1	Confident	42 Å²	42	32 Å²	32	22%	0.22	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	9.3	171.1	-61.1	-179.5	0	0	0	112.9	D875 D908 F909	D875-L877 PolarHBondContact O-N 3.25Å; D875-L877 WeakPolarHBondContact OD1-CA 3.29Å; D875-L877 WeakPolarHBondContact OD1-CB 3.43Å; D875-L877 PolarHBondContact OD1-N 3.36Å; L877-D908 CarbonylContact O-C 3.57Å; L877-D908 WeakPolarHBondContact O-CA 3.38Å; L877-D908 WeakPolarHBondContact O-CB 3.49Å; L877-F909 HydrophobicContact CB-CD1 3.9Å; L877-F909 HydrophobicContact CB-CE1 4.28Å; L877-F909 HydrophobicContact CD1-CE1 4.38Å; L877-F909 HydrophobicContact CD2-CD1 4.02Å; L877-F909 HydrophobicContact CD2-CE1 4.14Å; L877-F909 HydrophobicContact CG-CD1 4.44Å; L877-F909 PolarHBondContact O-N 3.4Å
878	G	84.9	Confident	89.8	Confident	14 Å²	14	33 Å²	33	14%	0.144	17%	0.174	C	C	.	.	S	Bend	trans	85.5	7.8	177.3	0	0	0	0	0	115	Q874 D875 R907	Q874-G878 VanDerWaalsContact CD-O 3.23Å; Q874-G878 WeakPolarHBondContact CG-O 3.33Å; Q874-G878 PolarHBondContact OE1-O 3.27Å; D875-G878 PolarHBondContact O-N 3.22Å; D875-G878 PolarHBondContact OD1-N 2.88Å; G878-R907 CarbonylContact C-O 3.33Å; G878-R907 CarbonylContact O-C 3.5Å
879	R	90.6	Very high	90.3	Very high	41 Å²	41	30.4 Å²	30.4	16%	0.155	16%	0.16	C	C	.	.			trans	-101	123.5	-170.7	-53.7	170.7	-55.7	-168	8.6	110.3	S844 H850 Q874 D875 F883 L884 D908	S844-R879 PolarHBondContact OG-NH2 3.22Å; H850-R879 PolarHBondContact NE2-O 2.88Å; H850-R879 VanDerWaalsContact NE2-O 3.14Å; Q874-R879 WeakPolarHBondContact CA-O 3.44Å; D875-R879 PolarHBondContact N-O 3.43Å; D875-R879 WeakPolarHBondContact OD1-CB 3.43Å; D875-R879 PolarHBondContact OD1-N 2.74Å; D875-R879 IonicContact OD1-NE 3.3Å; D875-R879 PolarHBondContact OD1-NE 3.34Å; D875-R879 IonicContact OD1-NH2 2.7Å; D875-R879 IonicContact OD2-CZ 3.71Å; D875-R879 IonicContact OD2-NE 3.59Å; D875-R879 PolarHBondContact OD2-NE 2.98Å; D875-R879 IonicContact OD2-NH2 3.11Å; D875-R879 PolarHBondContact OD2-NH2 3.11Å; R879-F883 HydrophobicContact CB-CB 4.01Å; R879-F883 HydrophobicContact CB-CD1 3.76Å; R879-F883 HydrophobicContact CB-CE1 4.36Å; R879-F883 HydrophobicContact CB-CG 3.86Å; R879-F883 VanDerWaalsContact CD-CE1 3.48Å; R879-F883 HydrophobicContact CG-CD1 3.6Å; R879-F883 HydrophobicContact CG-CD2 4.33Å; R879-F883 HydrophobicContact CG-CE1 3.68Å; R879-F883 HydrophobicContact CG-CE2 4.39Å; R879-F883 HydrophobicContact CG-CG 3.96Å; R879-F883 HydrophobicContact CG-CZ 4.08Å; R879-L884 HydrophobicContact CB-CD2 4.08Å; R879-D908 HydrophobicContact CG-CB 3.63Å
880	N	92.6	Very high	90.7	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.027	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-79.6	172.1	168.6	69.5	9.6	0	0	0	111.4	H850 S873 Q874 L882 F883 L884 D903 A906	H850-N880 WeakPolarHBondContact NE2-CA 3.17Å; S873-N880 WeakPolarHBondContact O-CB 3.32Å; Q874-N880 HydrophobicContact CG-CB 4.24Å; N880-L882 PolarHBondContact O-N 3.21Å; N880-L882 PolarHBondContact OD1-N 2.88Å; N880-F883 VanDerWaalsContact O-CB 3.32Å; N880-F883 WeakPolarHBondContact O-CB 3.29Å; N880-F883 PolarHBondContact O-N 2.72Å; N880-F883 VanDerWaalsContact O-N 3.09Å; N880-F883 PolarHBondContact OD1-N 3.18Å; N880-L884 PolarHBondContact O-N 3.14Å; N880-L884 VanDerWaalsContact O-N 3.15Å; N880-D903 PolarHBondContact ND2-O 3.37Å; N880-A906 WeakPolarHBondContact ND2-CB 3.44Å
881	A	94.8	Very high	90.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56	-35.9	178.4	0	0	0	0	0	113.8	T849 H850 A853 L884 A885 L897 F902	T849-A881 HydrophobicContact CG2-CB 3.79Å; H850-A881 PolarHBondContact CD2-N 3.22Å; H850-A881 PolarHBondContact NE2-N 3.04Å; A853-A881 HydrophobicContact CB-CB 3.8Å; A853-A881 WeakPolarHBondContact CB-O 3.14Å; A881-L884 PolarHBondContact O-N 2.7Å; A881-A885 PolarHBondContact O-N 2.88Å; A881-L897 HydrophobicContact CB-CD1 3.96Å; A881-L897 HydrophobicContact CB-CD2 4.44Å; A881-F902 HydrophobicContact CB-CD1 4.27Å; A881-F902 HydrophobicContact CB-CE1 3.85Å
882	L	95.4	Very high	91	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-38.3	177.4	178.7	62.9	0	0	0	111.9	N880 A886 V894 L897 D898 F902 R904 L930	N880-L882 PolarHBondContact O-N 3.21Å; N880-L882 PolarHBondContact OD1-N 2.88Å; L882-A886 VanDerWaalsContact O-CB 3.24Å; L882-A886 WeakPolarHBondContact O-CB 3.15Å; L882-A886 PolarHBondContact O-N 2.96Å; L882-V894 HydrophobicContact CD1-CB 4.3Å; L882-V894 HydrophobicContact CD1-CG1 4.06Å; L882-V894 HydrophobicContact CD1-CG2 4.32Å; L882-L897 HydrophobicContact CB-CB 4.3Å; L882-L897 HydrophobicContact CD1-CB 4.09Å; L882-D898 HydrophobicContact CD1-CB 4.47Å; L882-F902 HydrophobicContact CB-CB 3.84Å; L882-F902 HydrophobicContact CB-CD1 4.49Å; L882-F902 HydrophobicContact CD2-CB 3.99Å; L882-F902 WeakPolarHBondContact CD2-O 3.42Å; L882-R904 HydrophobicContact CD2-CG 4.05Å; L882-L930 HydrophobicContact CD1-CD2 4.37Å; L882-L930 HydrophobicContact CD2-CD2 4.39Å
883	F	95.2	Very high	91.3	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-47.4	170.9	-171.1	-69.1	0	0	0	110.9	R879 N880 A886 S887 D908 C912 P914 V917	R879-F883 HydrophobicContact CB-CB 4.01Å; R879-F883 HydrophobicContact CB-CD1 3.76Å; R879-F883 HydrophobicContact CB-CE1 4.36Å; R879-F883 HydrophobicContact CB-CG 3.86Å; R879-F883 VanDerWaalsContact CD-CE1 3.48Å; R879-F883 HydrophobicContact CG-CD1 3.6Å; R879-F883 HydrophobicContact CG-CD2 4.33Å; R879-F883 HydrophobicContact CG-CE1 3.68Å; R879-F883 HydrophobicContact CG-CE2 4.39Å; R879-F883 HydrophobicContact CG-CG 3.96Å; R879-F883 HydrophobicContact CG-CZ 4.08Å; N880-F883 VanDerWaalsContact O-CB 3.32Å; N880-F883 WeakPolarHBondContact O-CB 3.29Å; N880-F883 PolarHBondContact O-N 2.72Å; N880-F883 VanDerWaalsContact O-N 3.09Å; N880-F883 PolarHBondContact OD1-N 3.18Å; F883-A886 PolarHBondContact O-N 3.35Å; F883-S887 WeakPolarHBondContact O-CB 3.22Å; F883-S887 PolarHBondContact O-N 3.43Å; F883-S887 PolarHBondContact O-OG 3.05Å; F883-D908 HydrophobicContact CE2-CB 3.9Å; F883-D908 HydrophobicContact CZ-CB 3.81Å; F883-D908 WeakPolarHBondContact CZ-OD2 3.47Å; F883-C912 HydrophobicContact CE2-CB 4.45Å; F883-C912 WeakPolarHBondContact CE2-O 3.35Å; F883-P914 HydrophobicContact CB-CG 3.95Å; F883-P914 HydrophobicContact CD2-CG 4.01Å; F883-P914 HydrophobicContact CG-CG 4.34Å; F883-V917 HydrophobicContact CE1-CG2 4.12Å; F883-V917 HydrophobicContact CE2-CG2 4.06Å; F883-V917 HydrophobicContact CZ-CG2 3.52Å
884	L	94.4	Very high	91.8	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-48.7	-179.8	-63.7	-171	0	0	0	111.6	R846 H850 Q854 R879 N880 A881 A886 S887 K888	R846-L884 HydrophobicContact CG-CD1 4.49Å; H850-L884 HydrophobicContact CB-CD1 3.72Å; Q854-L884 HydrophobicContact CB-CB 4.37Å; R879-L884 HydrophobicContact CB-CD2 4.08Å; N880-L884 PolarHBondContact O-N 3.14Å; N880-L884 VanDerWaalsContact O-N 3.15Å; A881-L884 PolarHBondContact O-N 2.7Å; L884-A886 VanDerWaalsContact C-N 3.34Å; L884-A886 PolarHBondContact O-N 3.2Å; L884-S887 WeakPolarHBondContact CA-OG 3.42Å; L884-S887 PolarHBondContact O-N 2.92Å; L884-S887 PolarHBondContact O-OG 2.74Å; L884-K888 PolarHBondContact O-N 3.26Å
885	A	95.9	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-45.8	174.1	0	0	0	0	0	112.3	A853 A881 S887 K888 N889 C890 A893 V894 L897	A853-A885 HydrophobicContact CB-CB 4.26Å; A881-A885 PolarHBondContact O-N 2.88Å; A885-S887 PolarHBondContact O-N 3.16Å; A885-K888 PolarHBondContact O-N 2.91Å; A885-N889 PolarHBondContact O-N 2.82Å; A885-C890 HydrophobicContact CB-CB 3.97Å; A885-C890 WeakPolarHBondContact O-CB 3.47Å; A885-C890 PolarHBondContact O-N 3.48Å; A885-A893 HydrophobicContact CB-CB 3.87Å; A885-V894 HydrophobicContact CB-CG2 3.76Å; A885-L897 HydrophobicContact CB-CD1 4.33Å
886	A	95.8	Very high	92.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-40.2	178.4	0	0	0	0	0	112.6	L882 F883 L884 K888 N889 V894 P914 Y923 V926 L930	L882-A886 VanDerWaalsContact O-CB 3.24Å; L882-A886 WeakPolarHBondContact O-CB 3.15Å; L882-A886 PolarHBondContact O-N 2.96Å; F883-A886 PolarHBondContact O-N 3.35Å; L884-A886 VanDerWaalsContact C-N 3.34Å; L884-A886 PolarHBondContact O-N 3.2Å; A886-K888 PolarHBondContact O-N 2.91Å; A886-N889 PolarHBondContact O-N 3Å; A886-V894 HydrophobicContact CB-CG2 4.2Å; A886-P914 HydrophobicContact CB-CB 3.88Å; A886-Y923 VanDerWaalsContact O-CD2 3.29Å; A886-Y923 WeakPolarHBondContact O-CD2 3.43Å; A886-V926 HydrophobicContact CB-CG1 3.82Å; A886-L930 HydrophobicContact CB-CD1 4.05Å
887	S	93.7	Very high	92.9	Very high	22 Å²	22	27.6 Å²	27.6	15%	0.154	14%	0.139	C	C	.	.	H	α-helix	trans	-69.1	-12.4	178.1	73.8	0	0	0	0	115.1	F883 L884 A885 Y923	F883-S887 WeakPolarHBondContact O-CB 3.22Å; F883-S887 PolarHBondContact O-N 3.43Å; F883-S887 PolarHBondContact O-OG 3.05Å; L884-S887 WeakPolarHBondContact CA-OG 3.42Å; L884-S887 PolarHBondContact O-N 2.92Å; L884-S887 PolarHBondContact O-OG 2.74Å; A885-S887 PolarHBondContact O-N 3.16Å; S887-Y923 WeakPolarHBondContact O-CE2 3.49Å
888	K	94.2	Very high	93.2	Very high	118 Å²	118	26.3 Å²	26.3	51%	0.513	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	8.2	179.7	-67.4	-64.1	-171.4	172.2	0	113.8	Q854 L884 A885 A886 C890	Q854-K888 HydrophobicContact CG-CG 3.75Å; L884-K888 PolarHBondContact O-N 3.26Å; A885-K888 PolarHBondContact O-N 2.91Å; A886-K888 PolarHBondContact O-N 2.91Å; K888-C890 VanDerWaalsContact CB-SG 3.52Å; K888-C890 PolarHBondContact O-N 2.96Å
889	N	95.1	Very high	93.3	Very high	68 Å²	68	26.5 Å²	26.5	36%	0.364	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	29.3	-176.2	-165.3	43.6	0	0	0	113.9	A885 A886 V891 Y923	A885-N889 PolarHBondContact O-N 2.82Å; A886-N889 PolarHBondContact O-N 3Å; N889-V891 PolarHBondContact O-N 3Å; N889-Y923 HydrophobicContact CB-CD1 3.73Å; N889-Y923 HydrophobicContact CB-CD2 3.81Å; N889-Y923 HydrophobicContact CB-CE1 3.9Å; N889-Y923 HydrophobicContact CB-CE2 3.97Å; N889-Y923 HydrophobicContact CB-CG 3.69Å; N889-Y923 WeakPolarHBondContact OD1-CB 3.32Å
890	C	95.1	Very high	93.1	Very high	12 Å²	12	26.4 Å²	26.4	8%	0.081	13%	0.132	C	C	.	.			trans	-77.2	71.1	-179.9	-58	0	0	0	0	110.8	Q854 N856 A885 K888 Q892 A893 V894	Q854-C890 PolarHBondContact O-SG 3.32Å; N856-C890 HydrophobicContact CB-CB 3.75Å; N856-C890 VanDerWaalsContact OD1-C 3.28Å; N856-C890 WeakPolarHBondContact OD1-CA 3.38Å; N856-C890 WeakPolarHBondContact OD1-CB 3.28Å; N856-C890 PolarHBondContact OD1-O 2.91Å; A885-C890 HydrophobicContact CB-CB 3.97Å; A885-C890 WeakPolarHBondContact O-CB 3.47Å; A885-C890 PolarHBondContact O-N 3.48Å; K888-C890 VanDerWaalsContact CB-SG 3.52Å; K888-C890 PolarHBondContact O-N 2.96Å; C890-Q892 VanDerWaalsContact C-N 3.29Å; C890-Q892 PolarHBondContact O-N 3.14Å; C890-A893 HydrophobicContact CB-CB 3.98Å; C890-A893 PolarHBondContact O-N 2.95Å; C890-A893 VanDerWaalsContact O-N 3.11Å; C890-V894 WeakPolarHBondContact O-CG2 3.43Å; C890-V894 PolarHBondContact O-N 2.94Å
891	V	92.8	Very high	92.8	Very high	42 Å²	42	28.2 Å²	28.2	26%	0.255	15%	0.152	S	C	.	.	H	α-helix	trans	-50.5	-46.5	-170	-174.4	0	0	0	0	112.4	N889 V894 E895 A925 V926 L929	N889-V891 PolarHBondContact O-N 3Å; V891-V894 WeakPolarHBondContact O-CB 3.19Å; V891-V894 PolarHBondContact O-N 3.36Å; V891-E895 WeakPolarHBondContact O-CG 3.46Å; V891-E895 PolarHBondContact O-N 3.17Å; V891-A925 HydrophobicContact CG1-CB 4.34Å; V891-A925 HydrophobicContact CG2-CB 3.91Å; V891-V926 HydrophobicContact CG2-CG2 4.2Å; V891-L929 HydrophobicContact CG1-CD1 3.75Å
892	Q	91.7	Very high	92.6	Very high	99 Å²	99	28.3 Å²	28.3	46%	0.463	15%	0.152	S	C	.	.	H	α-helix	trans	-68.8	-41.5	-178.2	-69.3	174.9	-42.6	0	0	112.4	N856 L858 C890 V894 E895 F896	N856-Q892 PolarHBondContact ND2-OE1 2.95Å; N856-Q892 PolarHBondContact OD1-N 2.67Å; L858-Q892 HydrophobicContact CD1-CB 3.97Å; L858-Q892 HydrophobicContact CD1-CG 4.5Å; L858-Q892 HydrophobicContact CD2-CB 4.21Å; L858-Q892 HydrophobicContact CG-CB 4.08Å; C890-Q892 VanDerWaalsContact C-N 3.29Å; C890-Q892 PolarHBondContact O-N 3.14Å; Q892-V894 VanDerWaalsContact C-N 3.31Å; Q892-V894 PolarHBondContact O-N 3.49Å; Q892-E895 PolarHBondContact O-N 3.01Å; Q892-F896 VanDerWaalsContact O-CB 3.31Å; Q892-F896 WeakPolarHBondContact O-CB 3.32Å; Q892-F896 PolarHBondContact O-N 3.39Å
893	A	93.9	Very high	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-34.3	174.2	0	0	0	0	0	112.1	N856 L861 A885 C890 F896 L897	N856-A893 PolarHBondContact OD1-N 3.43Å; N856-A893 VanDerWaalsContact OD1-N 3.12Å; L861-A893 HydrophobicContact CD1-CB 3.8Å; A885-A893 HydrophobicContact CB-CB 3.87Å; C890-A893 HydrophobicContact CB-CB 3.98Å; C890-A893 PolarHBondContact O-N 2.95Å; C890-A893 VanDerWaalsContact O-N 3.11Å; A893-F896 PolarHBondContact O-N 3.13Å; A893-L897 WeakPolarHBondContact O-CB 3.4Å; A893-L897 WeakPolarHBondContact O-CD1 3.47Å; A893-L897 VanDerWaalsContact O-CG 3.23Å; A893-L897 WeakPolarHBondContact O-CG 3.31Å; A893-L897 PolarHBondContact O-N 3.23Å
894	V	94.6	Very high	92.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-52	172	168.8	0	0	0	0	110.7	L882 A885 A886 C890 V891 Q892 F896 L897 D898 V926 L929 L930	L882-V894 HydrophobicContact CD1-CB 4.3Å; L882-V894 HydrophobicContact CD1-CG1 4.06Å; L882-V894 HydrophobicContact CD1-CG2 4.32Å; A885-V894 HydrophobicContact CB-CG2 3.76Å; A886-V894 HydrophobicContact CB-CG2 4.2Å; C890-V894 WeakPolarHBondContact O-CG2 3.43Å; C890-V894 PolarHBondContact O-N 2.94Å; V891-V894 WeakPolarHBondContact O-CB 3.19Å; V891-V894 PolarHBondContact O-N 3.36Å; Q892-V894 VanDerWaalsContact C-N 3.31Å; Q892-V894 PolarHBondContact O-N 3.49Å; V894-F896 VanDerWaalsContact C-N 3.29Å; V894-F896 PolarHBondContact O-N 2.84Å; V894-L897 PolarHBondContact O-N 3.15Å; V894-D898 WeakPolarHBondContact O-CB 3.32Å; V894-D898 PolarHBondContact O-N 3.37Å; V894-V926 HydrophobicContact CG1-CG1 4.29Å; V894-V926 HydrophobicContact CG2-CG1 4.07Å; V894-V926 HydrophobicContact CG2-CG2 4.14Å; V894-L929 HydrophobicContact CG1-CB 4.43Å; V894-L929 HydrophobicContact CG1-CD1 4.25Å; V894-L930 HydrophobicContact CG1-CD2 4.13Å; V894-L930 HydrophobicContact CG1-CG 4.29Å
895	E	91.7	Very high	91.9	Very high	96 Å²	96	37.8 Å²	37.8	45%	0.449	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-42	176.9	-69.7	173.8	171.9	0	0	111.9	V891 Q892 A899 L929	V891-E895 WeakPolarHBondContact O-CG 3.46Å; V891-E895 PolarHBondContact O-N 3.17Å; Q892-E895 PolarHBondContact O-N 3.01Å; E895-A899 VanDerWaalsContact O-CB 3.23Å; E895-A899 WeakPolarHBondContact O-CB 3.44Å; E895-A899 PolarHBondContact O-N 2.98Å; E895-A899 VanDerWaalsContact O-N 3.11Å; E895-L929 HydrophobicContact CG-CD1 3.55Å; E895-L929 HydrophobicContact CG-CD2 3.88Å; E895-L929 HydrophobicContact CG-CG 4.34Å
896	F	92	Very high	91.5	Very high	14 Å²	14	37.9 Å²	37.9	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-50	178.9	-179.3	-82.5	0	0	0	112.8	L858 L861 N862 W865 L870 Q892 A893 V894 R900	L858-F896 HydrophobicContact CD2-CB 3.76Å; L858-F896 HydrophobicContact CD2-CD2 3.98Å; L858-F896 HydrophobicContact CD2-CG 4.03Å; L861-F896 HydrophobicContact CB-CD1 3.99Å; L861-F896 HydrophobicContact CB-CE1 3.69Å; L861-F896 HydrophobicContact CB-CZ 3.99Å; L861-F896 HydrophobicContact CD1-CD1 4.08Å; L861-F896 WeakPolarHBondContact O-CZ 3.37Å; N862-F896 HydrophobicContact CB-CE2 4.38Å; N862-F896 WeakPolarHBondContact OD1-CE2 3.27Å; W865-F896 HydrophobicContact CB-CZ 4.2Å; W865-F896 HydrophobicContact CE3-CZ 4.44Å; L870-F896 HydrophobicContact CD1-CE1 4.04Å; L870-F896 HydrophobicContact CD2-CE1 4.29Å; Q892-F896 VanDerWaalsContact O-CB 3.31Å; Q892-F896 WeakPolarHBondContact O-CB 3.32Å; Q892-F896 PolarHBondContact O-N 3.39Å; A893-F896 PolarHBondContact O-N 3.13Å; V894-F896 VanDerWaalsContact C-N 3.29Å; V894-F896 PolarHBondContact O-N 2.84Å; F896-R900 VanDerWaalsContact CD2-CZ 3.43Å; F896-R900 VanDerWaalsContact CD2-NH1 3.35Å; F896-R900 VanDerWaalsContact CZ-CZ 3.49Å; F896-R900 VanDerWaalsContact CZ-NE 3.26Å; F896-R900 WeakPolarHBondContact O-CD 3.41Å; F896-R900 PolarHBondContact O-N 3.14Å; F896-R900 PolarHBondContact O-NH1 2.94Å
897	L	93.4	Very high	91.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-74.7	-38.5	-175.1	-66.1	165.2	0	0	0	111.5	T849 A853 L861 A881 L882 A885 A893 V894 R900 G901 F902	T849-L897 HydrophobicContact CG2-CD2 4.46Å; A853-L897 HydrophobicContact CB-CD1 3.68Å; L861-L897 HydrophobicContact CD2-CD2 4.21Å; A881-L897 HydrophobicContact CB-CD1 3.96Å; A881-L897 HydrophobicContact CB-CD2 4.44Å; L882-L897 HydrophobicContact CB-CB 4.3Å; L882-L897 HydrophobicContact CD1-CB 4.09Å; A885-L897 HydrophobicContact CB-CD1 4.33Å; A893-L897 WeakPolarHBondContact O-CB 3.4Å; A893-L897 WeakPolarHBondContact O-CD1 3.47Å; A893-L897 VanDerWaalsContact O-CG 3.23Å; A893-L897 WeakPolarHBondContact O-CG 3.31Å; A893-L897 PolarHBondContact O-N 3.23Å; V894-L897 PolarHBondContact O-N 3.15Å; L897-R900 CarbonylContact O-C 3.53Å; L897-R900 PolarHBondContact O-N 3Å; L897-R900 VanDerWaalsContact O-N 3.07Å; L897-G901 PolarHBondContact O-N 2.97Å; L897-F902 HydrophobicContact CB-CB 4.14Å; L897-F902 HydrophobicContact CB-CD2 3.96Å; L897-F902 HydrophobicContact CB-CG 3.97Å; L897-F902 HydrophobicContact CD2-CD1 4.28Å; L897-F902 HydrophobicContact CD2-CD2 3.78Å; L897-F902 HydrophobicContact CD2-CE1 4.07Å; L897-F902 HydrophobicContact CD2-CE2 3.55Å; L897-F902 HydrophobicContact CD2-CG 4.15Å; L897-F902 HydrophobicContact CD2-CZ 3.71Å; L897-F902 HydrophobicContact CG-CD2 4.5Å; L897-F902 WeakPolarHBondContact O-CB 3.41Å; L897-F902 WeakPolarHBondContact O-CD2 3.35Å; L897-F902 PolarHBondContact O-N 2.92Å
898	D	89.9	Confident	90.9	Very high	15 Å²	15	43.2 Å²	43.2	8%	0.08	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-44.1	175.6	-176.1	46.7	0	0	0	111.8	L882 V894 R900 G901 R904 P935	L882-D898 HydrophobicContact CD1-CB 4.47Å; V894-D898 WeakPolarHBondContact O-CB 3.32Å; V894-D898 PolarHBondContact O-N 3.37Å; D898-R900 PolarHBondContact O-N 3.01Å; D898-R900 VanDerWaalsContact O-N 3.11Å; D898-G901 PolarHBondContact O-N 3.41Å; D898-G901 VanDerWaalsContact O-N 3.1Å; D898-R904 VanDerWaalsContact CG-NH2 3.29Å; D898-R904 IonicContact OD1-CZ 2.81Å; D898-R904 VanDerWaalsContact OD1-CZ 3.3Å; D898-R904 IonicContact OD1-NE 2.62Å; D898-R904 PolarHBondContact OD1-NE 3.01Å; D898-R904 IonicContact OD1-NH2 3.15Å; D898-R904 PolarHBondContact OD1-NH2 3.3Å; D898-R904 VanDerWaalsContact OD1-NH2 3.11Å; D898-R904 IonicContact OD2-CZ 3.25Å; D898-R904 IonicContact OD2-NE 3.27Å; D898-R904 IonicContact OD2-NH2 2.67Å; D898-R904 PolarHBondContact OD2-NH2 2.82Å; D898-P935 WeakPolarHBondContact OD2-CD 3.47Å
899	A	86.2	Confident	90.4	Very high	18 Å²	18	44.1 Å²	44.1	15%	0.149	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.3	173.8	0	0	0	0	0	114.1	E895 P935 I938	E895-A899 VanDerWaalsContact O-CB 3.23Å; E895-A899 WeakPolarHBondContact O-CB 3.44Å; E895-A899 PolarHBondContact O-N 2.98Å; E895-A899 VanDerWaalsContact O-N 3.11Å; A899-P935 HydrophobicContact CB-CG 4.5Å; A899-I938 HydrophobicContact CB-CD1 4.11Å; A899-I938 WeakPolarHBondContact O-CG1 3.24Å; A899-I938 PolarHBondContact O-N 3.42Å
900	R	87.6	Confident	90	Very high	38 Å²	38	46.1 Å²	46.1	14%	0.143	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	16.8	178.8	-70.3	163.2	-173.4	73	-1.2	112.8	W865 F896 L897 D898 F902	W865-R900 VanDerWaalsContact CE3-NE 3.3Å; W865-R900 HydrophobicContact CZ2-CG 3.89Å; W865-R900 VanDerWaalsContact CZ2-NE 3.28Å; F896-R900 VanDerWaalsContact CD2-CZ 3.43Å; F896-R900 VanDerWaalsContact CD2-NH1 3.35Å; F896-R900 VanDerWaalsContact CZ-CZ 3.49Å; F896-R900 VanDerWaalsContact CZ-NE 3.26Å; F896-R900 WeakPolarHBondContact O-CD 3.41Å; F896-R900 PolarHBondContact O-N 3.14Å; F896-R900 PolarHBondContact O-NH1 2.94Å; L897-R900 CarbonylContact O-C 3.53Å; L897-R900 PolarHBondContact O-N 3Å; L897-R900 VanDerWaalsContact O-N 3.07Å; D898-R900 PolarHBondContact O-N 3.01Å; D898-R900 VanDerWaalsContact O-N 3.11Å; R900-F902 HydrophobicContact CB-CD2 4.5Å; R900-F902 PolarHBondContact O-N 3.45Å
901	G	85.2	Confident	89.6	Confident	43 Å²	43	50.7 Å²	50.7	44%	0.443	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	23	170.9	0	0	0	0	0	115	L897 D898	L897-G901 PolarHBondContact O-N 2.97Å; D898-G901 PolarHBondContact O-N 3.41Å; D898-G901 VanDerWaalsContact O-N 3.1Å
902	F	91.2	Very high	89.5	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	25%	0.251	C	S	.	.			trans	-62.5	136.7	169.2	-84.3	-108.4	0	0	0	110.6	T849 L870 C871 H872 A881 L882 L897 R900 R904	T849-F902 HydrophobicContact CG2-CE1 4.45Å; T849-F902 HydrophobicContact CG2-CZ 4.16Å; L870-F902 HydrophobicContact CB-CZ 4.43Å; L870-F902 HydrophobicContact CD1-CE2 4.27Å; C871-F902 WeakPolarHBondContact O-CE1 3.4Å; H872-F902 AromaticContact CE1-CD2 3.66Å; H872-F902 AromaticContact CE1-CE2 3.27Å; H872-F902 WeakPolarHBondContact CE1-CE2 3.47Å; H872-F902 AromaticContact CE1-CZ 3.77Å; H872-F902 AromaticContact CG-CZ 3.94Å; H872-F902 AromaticContact ND1-CD2 3.77Å; H872-F902 AromaticContact ND1-CE1 3.97Å; H872-F902 AromaticContact ND1-CE2 3.51Å; H872-F902 AromaticContact ND1-CZ 3.62Å; H872-F902 AromaticContact NE2-CE2 3.86Å; A881-F902 HydrophobicContact CB-CD1 4.27Å; A881-F902 HydrophobicContact CB-CE1 3.85Å; L882-F902 HydrophobicContact CB-CB 3.84Å; L882-F902 HydrophobicContact CB-CD1 4.49Å; L882-F902 HydrophobicContact CD2-CB 3.99Å; L882-F902 WeakPolarHBondContact CD2-O 3.42Å; L897-F902 HydrophobicContact CB-CB 4.14Å; L897-F902 HydrophobicContact CB-CD2 3.96Å; L897-F902 HydrophobicContact CB-CG 3.97Å; L897-F902 HydrophobicContact CD2-CD1 4.28Å; L897-F902 HydrophobicContact CD2-CD2 3.78Å; L897-F902 HydrophobicContact CD2-CE1 4.07Å; L897-F902 HydrophobicContact CD2-CE2 3.55Å; L897-F902 HydrophobicContact CD2-CG 4.15Å; L897-F902 HydrophobicContact CD2-CZ 3.71Å; L897-F902 HydrophobicContact CG-CD2 4.5Å; L897-F902 WeakPolarHBondContact O-CB 3.41Å; L897-F902 WeakPolarHBondContact O-CD2 3.35Å; L897-F902 PolarHBondContact O-N 2.92Å; R900-F902 HydrophobicContact CB-CD2 4.5Å; R900-F902 PolarHBondContact O-N 3.45Å; F902-R904 PolarHBondContact O-N 3.01Å
903	D	88.9	Confident	89.6	Confident	79 Å²	79	46 Å²	46	42%	0.422	23%	0.234	S	C	.	.			trans	-63.9	122	-175.2	179.4	19.6	0	0	0	112	N880 E905 A906	N880-D903 PolarHBondContact ND2-O 3.37Å; D903-E905 PolarHBondContact OD1-N 3.08Å; D903-A906 HydrophobicContact CB-CB 4.17Å; D903-A906 WeakPolarHBondContact OD2-CA 3.35Å; D903-A906 PolarHBondContact OD2-N 3.24Å
904	R	91.4	Very high	89.6	Confident	21 Å²	21	46 Å²	46	8%	0.079	23%	0.234	C	C	.	.	S	Bend	trans	-80.1	-19.6	176.4	-71.7	-170	179.4	-175.6	4.6	113.7	L882 D898 F902 P914 L929 L930 A932 Q934	L882-R904 HydrophobicContact CD2-CG 4.05Å; D898-R904 VanDerWaalsContact CG-NH2 3.29Å; D898-R904 IonicContact OD1-CZ 2.81Å; D898-R904 VanDerWaalsContact OD1-CZ 3.3Å; D898-R904 IonicContact OD1-NE 2.62Å; D898-R904 PolarHBondContact OD1-NE 3.01Å; D898-R904 IonicContact OD1-NH2 3.15Å; D898-R904 PolarHBondContact OD1-NH2 3.3Å; D898-R904 VanDerWaalsContact OD1-NH2 3.11Å; D898-R904 IonicContact OD2-CZ 3.25Å; D898-R904 IonicContact OD2-NE 3.27Å; D898-R904 IonicContact OD2-NH2 2.67Å; D898-R904 PolarHBondContact OD2-NH2 2.82Å; F902-R904 PolarHBondContact O-N 3.01Å; R904-P914 VanDerWaalsContact O-CD 3.32Å; R904-P914 WeakPolarHBondContact O-CD 3.26Å; R904-L929 PolarHBondContact NH2-O 2.78Å; R904-L930 HydrophobicContact CG-CD2 4.16Å; R904-L930 PolarHBondContact NH1-O 3.47Å; R904-A932 PolarHBondContact NH1-O 2.87Å; R904-Q934 HydrophobicContact CG-CG 4.48Å
905	E	89.5	Confident	89.6	Confident	106 Å²	106	48.1 Å²	48.1	50%	0.495	25%	0.245	S	C	.	.	S	Bend	trans	-102.5	1.5	-177.7	-66.4	-59.7	135.5	0	0	112.8	D903 R907	D903-E905 PolarHBondContact OD1-N 3.08Å; E905-R907 WeakPolarHBondContact O-CG 3.47Å; E905-R907 IonicContact OE2-NH2 3.16Å
906	A	88.2	Confident	89.7	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	25%	0.247	C	C	.	.			trans	-50.8	138.6	172.5	0	0	0	0	0	111.3	N880 D903 P914	N880-A906 WeakPolarHBondContact ND2-CB 3.44Å; D903-A906 HydrophobicContact CB-CB 4.17Å; D903-A906 WeakPolarHBondContact OD2-CA 3.35Å; D903-A906 PolarHBondContact OD2-N 3.24Å; A906-P914 WeakPolarHBondContact O-CD 3.38Å
907	R	87.5	Confident	89.8	Confident	116 Å²	116	49 Å²	49	44%	0.438	25%	0.249	S	C	.	.			trans	-126.6	129.7	-167.4	-54.1	-156.8	177.5	-169	-4.3	113.7	G878 E905 N911 C912 T913	G878-R907 CarbonylContact C-O 3.33Å; G878-R907 CarbonylContact O-C 3.5Å; E905-R907 WeakPolarHBondContact O-CG 3.47Å; E905-R907 IonicContact OE2-NH2 3.16Å; R907-N911 WeakPolarHBondContact CD-OD1 3.23Å; R907-N911 PolarHBondContact NH1-OD1 3.26Å; R907-C912 VanDerWaalsContact CA-O 3.29Å; R907-C912 WeakPolarHBondContact CA-O 3.4Å; R907-T913 HydrophobicContact CG-CG2 4.17Å
908	D	88.2	Confident	89.8	Confident	19 Å²	19	49 Å²	49	10%	0.102	25%	0.249	C	C	.	.			trans	-70.4	173.4	170.8	76.6	-3.6	0	0	0	112.3	L877 R879 F883 L910 N911 C912	L877-D908 CarbonylContact O-C 3.57Å; L877-D908 WeakPolarHBondContact O-CA 3.38Å; L877-D908 WeakPolarHBondContact O-CB 3.49Å; R879-D908 HydrophobicContact CG-CB 3.63Å; F883-D908 HydrophobicContact CE2-CB 3.9Å; F883-D908 HydrophobicContact CZ-CB 3.81Å; F883-D908 WeakPolarHBondContact CZ-OD2 3.47Å; D908-L910 PolarHBondContact O-N 3.06Å; D908-L910 VanDerWaalsContact OD1-C 3.22Å; D908-L910 VanDerWaalsContact OD1-CA 3.29Å; D908-L910 WeakPolarHBondContact OD1-CA 3.42Å; D908-L910 WeakPolarHBondContact OD1-CB 3.47Å; D908-L910 PolarHBondContact OD1-N 2.78Å; D908-N911 WeakPolarHBondContact O-CA 3.36Å; D908-N911 PolarHBondContact O-N 3.3Å; D908-N911 PolarHBondContact OD1-N 3.02Å; D908-C912 PolarHBondContact N-O 2.65Å; D908-C912 WeakPolarHBondContact OD1-CB 3.41Å; D908-C912 PolarHBondContact OD1-N 3.23Å
909	F	83.7	Confident	90	Very high	136 Å²	136	55.2 Å²	55.2	60%	0.596	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-14	175.1	75.6	-76.8	0	0	0	114.5	L877	L877-F909 HydrophobicContact CB-CD1 3.9Å; L877-F909 HydrophobicContact CB-CE1 4.28Å; L877-F909 HydrophobicContact CD1-CE1 4.38Å; L877-F909 HydrophobicContact CD2-CD1 4.02Å; L877-F909 HydrophobicContact CD2-CE1 4.14Å; L877-F909 HydrophobicContact CG-CD1 4.44Å; L877-F909 PolarHBondContact O-N 3.4Å
910	L	86.6	Confident	90.4	Very high	111 Å²	111	59.9 Å²	59.9	58%	0.581	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	9.4	172.6	-59.6	178.2	0	0	0	112.4	D908 C912	D908-L910 PolarHBondContact O-N 3.06Å; D908-L910 VanDerWaalsContact OD1-C 3.22Å; D908-L910 VanDerWaalsContact OD1-CA 3.29Å; D908-L910 WeakPolarHBondContact OD1-CA 3.42Å; D908-L910 WeakPolarHBondContact OD1-CB 3.47Å; D908-L910 PolarHBondContact OD1-N 2.78Å; L910-C912 PolarHBondContact O-N 3.32Å
911	N	86.7	Confident	90.6	Very high	107 Å²	107	61.5 Å²	61.5	57%	0.572	31%	0.309	S	S	*	.			trans	61.3	21.3	-179.6	-161.1	12.5	0	0	0	113.4	R907 D908	R907-N911 WeakPolarHBondContact CD-OD1 3.23Å; R907-N911 PolarHBondContact NH1-OD1 3.26Å; D908-N911 WeakPolarHBondContact O-CA 3.36Å; D908-N911 PolarHBondContact O-N 3.3Å; D908-N911 PolarHBondContact OD1-N 3.02Å
912	C	91.8	Very high	91	Very high	24 Å²	24	61.5 Å²	61.5	16%	0.162	31%	0.31	C	S	.	.			trans	-85	150.7	177.5	-65.6	0	0	0	0	110.8	F883 R907 D908 L910 F916 V917	F883-C912 HydrophobicContact CE2-CB 4.45Å; F883-C912 WeakPolarHBondContact CE2-O 3.35Å; R907-C912 VanDerWaalsContact CA-O 3.29Å; R907-C912 WeakPolarHBondContact CA-O 3.4Å; D908-C912 PolarHBondContact N-O 2.65Å; D908-C912 WeakPolarHBondContact OD1-CB 3.41Å; D908-C912 PolarHBondContact OD1-N 3.23Å; L910-C912 PolarHBondContact O-N 3.32Å; C912-F916 HydrophobicContact CB-CD1 3.82Å; C912-F916 HydrophobicContact CB-CE1 4.46Å; C912-F916 VanDerWaalsContact SG-CD1 3.55Å; C912-F916 VanDerWaalsContact SG-CE1 3.59Å; C912-V917 HydrophobicContact CB-CG2 4.02Å
913	T	93.6	Very high	91.2	Very high	18 Å²	18	64.4 Å²	64.4	11%	0.11	32%	0.321	C	S	.	.			trans	-107.1	162	173.4	62.1	0	0	0	0	111.4	R907 L915 F916 V917	R907-T913 HydrophobicContact CG-CG2 4.17Å; T913-L915 PolarHBondContact O-N 3.27Å; T913-F916 WeakPolarHBondContact O-CA 3.42Å; T913-F916 WeakPolarHBondContact O-CB 3.21Å; T913-F916 PolarHBondContact O-N 2.83Å; T913-F916 PolarHBondContact OG1-N 2.78Å; T913-V917 PolarHBondContact O-N 3.33Å
914	P	93.7	Very high	91.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-48.1	-42.4	172.3	-27.4	31.2	0	0	0	113.3	F883 A886 R904 A906 A918 L930	F883-P914 HydrophobicContact CB-CG 3.95Å; F883-P914 HydrophobicContact CD2-CG 4.01Å; F883-P914 HydrophobicContact CG-CG 4.34Å; A886-P914 HydrophobicContact CB-CB 3.88Å; R904-P914 VanDerWaalsContact O-CD 3.32Å; R904-P914 WeakPolarHBondContact O-CD 3.26Å; A906-P914 WeakPolarHBondContact O-CD 3.38Å; P914-A918 VanDerWaalsContact O-CB 3.28Å; P914-A918 WeakPolarHBondContact O-CB 3.46Å; P914-A918 PolarHBondContact O-N 3.23Å; P914-L930 HydrophobicContact CB-CD1 3.88Å
915	L	94.7	Very high	91.3	Very high	45 Å²	45	67.5 Å²	67.5	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-69.5	-36	177.7	176.3	59.4	0	0	0	112.6	T913 K919 T927 L930 K931	T913-L915 PolarHBondContact O-N 3.27Å; L915-K919 WeakPolarHBondContact O-CB 3.48Å; L915-K919 PolarHBondContact O-N 3.21Å; L915-T927 HydrophobicContact CD1-CG2 4.15Å; L915-L930 HydrophobicContact CB-CB 4.21Å; L915-L930 HydrophobicContact CB-CD1 4.3Å; L915-L930 HydrophobicContact CD1-CB 3.99Å; L915-K931 HydrophobicContact CD1-CG 3.87Å; L915-K931 HydrophobicContact CD2-CG 4.11Å
916	F	94.1	Very high	91.5	Very high	110 Å²	110	62.4 Å²	62.4	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-64.2	-49.1	175.5	-179.4	-91	0	0	0	111.1	C912 T913 K919 N920	C912-F916 HydrophobicContact CB-CD1 3.82Å; C912-F916 HydrophobicContact CB-CE1 4.46Å; C912-F916 VanDerWaalsContact SG-CD1 3.55Å; C912-F916 VanDerWaalsContact SG-CE1 3.59Å; T913-F916 WeakPolarHBondContact O-CA 3.42Å; T913-F916 WeakPolarHBondContact O-CB 3.21Å; T913-F916 PolarHBondContact O-N 2.83Å; T913-F916 PolarHBondContact OG1-N 2.78Å; F916-K919 PolarHBondContact O-N 3.18Å; F916-N920 VanDerWaalsContact O-CB 3.32Å; F916-N920 WeakPolarHBondContact O-CB 3.13Å; F916-N920 PolarHBondContact O-N 3.38Å
917	V	93.5	Very high	91.7	Very high	20 Å²	20	62.8 Å²	62.8	12%	0.121	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-45.1	-179.6	-178.8	0	0	0	0	111.3	F883 C912 T913 K919 N920 N921	F883-V917 HydrophobicContact CE1-CG2 4.12Å; F883-V917 HydrophobicContact CE2-CG2 4.06Å; F883-V917 HydrophobicContact CZ-CG2 3.52Å; C912-V917 HydrophobicContact CB-CG2 4.02Å; T913-V917 PolarHBondContact O-N 3.33Å; V917-K919 VanDerWaalsContact C-N 3.3Å; V917-K919 PolarHBondContact O-N 3.36Å; V917-N920 PolarHBondContact O-N 2.81Å; V917-N921 WeakPolarHBondContact O-CB 2.86Å; V917-N921 PolarHBondContact O-N 3.18Å; V917-N921 PolarHBondContact O-OD1 2.99Å
918	A	94.4	Very high	91.9	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-40.3	176.1	0	0	0	0	0	112.5	P914 G922 Y923 V926 T927 L930	P914-A918 VanDerWaalsContact O-CB 3.28Å; P914-A918 WeakPolarHBondContact O-CB 3.46Å; P914-A918 PolarHBondContact O-N 3.23Å; A918-G922 PolarHBondContact O-N 3.01Å; A918-Y923 WeakPolarHBondContact O-CB 3.43Å; A918-Y923 PolarHBondContact O-N 2.83Å; A918-V926 HydrophobicContact CB-CB 4.09Å; A918-V926 HydrophobicContact CB-CG1 3.48Å; A918-V926 VanDerWaalsContact CB-CG1 3.48Å; A918-T927 PolarHBondContact O-OG1 3.09Å; A918-L930 HydrophobicContact CB-CD1 4.5Å
919	K	93.9	Very high	92.1	Very high	145 Å²	145	66.2 Å²	66.2	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-67.8	-44.5	175.4	-177.7	-168	171.4	-164.8	0	111.8	L915 F916 V917 N921 G922 T927	L915-K919 WeakPolarHBondContact O-CB 3.48Å; L915-K919 PolarHBondContact O-N 3.21Å; F916-K919 PolarHBondContact O-N 3.18Å; V917-K919 VanDerWaalsContact C-N 3.3Å; V917-K919 PolarHBondContact O-N 3.36Å; K919-N921 VanDerWaalsContact C-N 3.33Å; K919-N921 PolarHBondContact O-N 3.01Å; K919-G922 PolarHBondContact O-N 3.07Å; K919-T927 HydrophobicContact CB-CG2 4.34Å; K919-T927 PolarHBondContact N-OG1 3.24Å
920	N	93.3	Very high	92.4	Very high	116 Å²	116	60.2 Å²	60.2	62%	0.62	32%	0.317	S	S	*	.	H	α-helix	trans	-64.9	-37.6	-178.1	-173.1	79.7	0	0	0	111.9	F916 V917 G922	F916-N920 VanDerWaalsContact O-CB 3.32Å; F916-N920 WeakPolarHBondContact O-CB 3.13Å; F916-N920 PolarHBondContact O-N 3.38Å; V917-N920 PolarHBondContact O-N 2.81Å; N920-G922 VanDerWaalsContact C-N 3.27Å; N920-G922 PolarHBondContact O-N 3.27Å
921	N	93.3	Very high	92.6	Very high	71 Å²	71	61.3 Å²	61.3	38%	0.38	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	3.5	178.7	-61.2	5.7	0	0	0	113.2	V917 K919 Y923	V917-N921 WeakPolarHBondContact O-CB 2.86Å; V917-N921 PolarHBondContact O-N 3.18Å; V917-N921 PolarHBondContact O-OD1 2.99Å; K919-N921 VanDerWaalsContact C-N 3.33Å; K919-N921 PolarHBondContact O-N 3.01Å; N921-Y923 HydrophobicContact CB-CD1 4.26Å; N921-Y923 HydrophobicContact CB-CD2 3.85Å; N921-Y923 HydrophobicContact CB-CE1 3.93Å; N921-Y923 HydrophobicContact CB-CE2 3.48Å; N921-Y923 VanDerWaalsContact CB-CE2 3.48Å; N921-Y923 HydrophobicContact CB-CG 4.22Å; N921-Y923 WeakPolarHBondContact O-CD1 3.31Å; N921-Y923 WeakPolarHBondContact O-CE1 3.46Å; N921-Y923 PolarHBondContact O-N 3.39Å
922	G	92.8	Very high	92.4	Very high	44 Å²	44	58.8 Å²	58.8	45%	0.454	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	14	176.4	0	0	0	0	0	115.6	A918 K919 N920 N924	A918-G922 PolarHBondContact O-N 3.01Å; K919-G922 PolarHBondContact O-N 3.07Å; N920-G922 VanDerWaalsContact C-N 3.27Å; N920-G922 PolarHBondContact O-N 3.27Å; G922-N924 VanDerWaalsContact C-N 3.31Å; G922-N924 PolarHBondContact O-N 2.96Å; G922-N924 PolarHBondContact O-ND2 3.34Å
923	Y	95.5	Very high	91.6	Very high	62 Å²	62	69 Å²	69	24%	0.243	35%	0.346	C	S	.	.			trans	-76	78.7	-175.5	-58	-26.3	0	0	0	111.7	A886 S887 N889 A918 N921 A925 V926 T927	A886-Y923 VanDerWaalsContact O-CD2 3.29Å; A886-Y923 WeakPolarHBondContact O-CD2 3.43Å; S887-Y923 WeakPolarHBondContact O-CE2 3.49Å; N889-Y923 HydrophobicContact CB-CD1 3.73Å; N889-Y923 HydrophobicContact CB-CD2 3.81Å; N889-Y923 HydrophobicContact CB-CE1 3.9Å; N889-Y923 HydrophobicContact CB-CE2 3.97Å; N889-Y923 HydrophobicContact CB-CG 3.69Å; N889-Y923 WeakPolarHBondContact OD1-CB 3.32Å; A918-Y923 WeakPolarHBondContact O-CB 3.43Å; A918-Y923 PolarHBondContact O-N 2.83Å; N921-Y923 HydrophobicContact CB-CD1 4.26Å; N921-Y923 HydrophobicContact CB-CD2 3.85Å; N921-Y923 HydrophobicContact CB-CE1 3.93Å; N921-Y923 HydrophobicContact CB-CE2 3.48Å; N921-Y923 VanDerWaalsContact CB-CE2 3.48Å; N921-Y923 HydrophobicContact CB-CG 4.22Å; N921-Y923 WeakPolarHBondContact O-CD1 3.31Å; N921-Y923 WeakPolarHBondContact O-CE1 3.46Å; N921-Y923 PolarHBondContact O-N 3.39Å; Y923-A925 VanDerWaalsContact C-N 3.3Å; Y923-A925 PolarHBondContact O-N 3.45Å; Y923-V926 PolarHBondContact O-N 2.91Å; Y923-T927 WeakPolarHBondContact O-CB 3.47Å; Y923-T927 PolarHBondContact O-N 2.98Å; Y923-T927 PolarHBondContact O-OG1 2.94Å
924	N	91.9	Very high	90.6	Very high	120 Å²	120	73.6 Å²	73.6	64%	0.642	37%	0.366	S	S	*	.	H	α-helix	trans	-60.3	-31.6	-171.7	-74.4	-54.8	0	0	0	114.5	G922 K928	G922-N924 VanDerWaalsContact C-N 3.31Å; G922-N924 PolarHBondContact O-N 2.96Å; G922-N924 PolarHBondContact O-ND2 3.34Å; N924-K928 VanDerWaalsContact O-CG 3.32Å; N924-K928 WeakPolarHBondContact O-CG 3.24Å; N924-K928 PolarHBondContact O-N 2.79Å; N924-K928 VanDerWaalsContact O-N 3.14Å
925	A	90.2	Very high	89.3	Confident	45 Å²	45	76.3 Å²	76.3	37%	0.372	38%	0.384	S	S	.	.	H	α-helix	trans	-69.4	-58.4	177	0	0	0	0	0	111.2	V891 Y923 T927 K928 L929	V891-A925 HydrophobicContact CG1-CB 4.34Å; V891-A925 HydrophobicContact CG2-CB 3.91Å; Y923-A925 VanDerWaalsContact C-N 3.3Å; Y923-A925 PolarHBondContact O-N 3.45Å; A925-T927 PolarHBondContact O-N 2.91Å; A925-K928 WeakPolarHBondContact O-CB 3.49Å; A925-K928 PolarHBondContact O-N 2.83Å; A925-L929 PolarHBondContact O-N 3.29Å; A925-L929 VanDerWaalsContact O-N 3.1Å
926	V	93.2	Very high	87.7	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-53.8	-41.9	173.8	175.6	0	0	0	0	111.6	A886 V891 V894 A918 Y923 K928 L929 L930	A886-V926 HydrophobicContact CB-CG1 3.82Å; V891-V926 HydrophobicContact CG2-CG2 4.2Å; V894-V926 HydrophobicContact CG1-CG1 4.29Å; V894-V926 HydrophobicContact CG2-CG1 4.07Å; V894-V926 HydrophobicContact CG2-CG2 4.14Å; A918-V926 HydrophobicContact CB-CB 4.09Å; A918-V926 HydrophobicContact CB-CG1 3.48Å; A918-V926 VanDerWaalsContact CB-CG1 3.48Å; Y923-V926 PolarHBondContact O-N 2.91Å; V926-K928 VanDerWaalsContact C-N 3.28Å; V926-K928 PolarHBondContact O-N 3.45Å; V926-L929 PolarHBondContact O-N 2.96Å; V926-L930 HydrophobicContact CG1-CD1 3.68Å; V926-L930 HydrophobicContact CG1-CG 4.19Å; V926-L930 WeakPolarHBondContact O-CG 3.21Å; V926-L930 PolarHBondContact O-N 2.92Å
927	T	93.4	Very high	86.1	Confident	10 Å²	10	81.2 Å²	81.2	6%	0.061	42%	0.415	C	S	.	.	H	α-helix	trans	-65.7	-26	178.1	-60.3	0	0	0	0	113.2	L915 A918 K919 Y923 A925 K931	L915-T927 HydrophobicContact CD1-CG2 4.15Å; A918-T927 PolarHBondContact O-OG1 3.09Å; K919-T927 HydrophobicContact CB-CG2 4.34Å; K919-T927 PolarHBondContact N-OG1 3.24Å; Y923-T927 WeakPolarHBondContact O-CB 3.47Å; Y923-T927 PolarHBondContact O-N 2.98Å; Y923-T927 PolarHBondContact O-OG1 2.94Å; A925-T927 PolarHBondContact O-N 2.91Å; T927-K931 HydrophobicContact CG2-CD 4.33Å; T927-K931 WeakPolarHBondContact O-CB 3.01Å; T927-K931 VanDerWaalsContact O-CD 3.26Å; T927-K931 WeakPolarHBondContact O-CD 3.4Å; T927-K931 WeakPolarHBondContact O-CG 3.44Å
928	K	91.9	Very high	84.5	Confident	163 Å²	163	84.3 Å²	84.3	71%	0.709	43%	0.429	S	S	*	.	H	α-helix	trans	-76.7	-45.8	171.4	-76.9	172	-179.8	-177.9	0	111	N924 A925 V926 K931 A932	N924-K928 VanDerWaalsContact O-CG 3.32Å; N924-K928 WeakPolarHBondContact O-CG 3.24Å; N924-K928 PolarHBondContact O-N 2.79Å; N924-K928 VanDerWaalsContact O-N 3.14Å; A925-K928 WeakPolarHBondContact O-CB 3.49Å; A925-K928 PolarHBondContact O-N 2.83Å; V926-K928 VanDerWaalsContact C-N 3.28Å; V926-K928 PolarHBondContact O-N 3.45Å; K928-K931 PolarHBondContact O-N 2.99Å; K928-A932 PolarHBondContact O-N 3.15Å
929	L	91.2	Very high	82.6	Confident	44 Å²	44	92.8 Å²	92.8	23%	0.23	47%	0.469	C	S	.	.	H	α-helix	trans	-59.2	-53.4	179.6	-67.8	166.9	0	0	0	111.9	V891 V894 E895 R904 A925 V926 K931 A932	V891-L929 HydrophobicContact CG1-CD1 3.75Å; V894-L929 HydrophobicContact CG1-CB 4.43Å; V894-L929 HydrophobicContact CG1-CD1 4.25Å; E895-L929 HydrophobicContact CG-CD1 3.55Å; E895-L929 HydrophobicContact CG-CD2 3.88Å; E895-L929 HydrophobicContact CG-CG 4.34Å; R904-L929 PolarHBondContact NH2-O 2.78Å; A925-L929 PolarHBondContact O-N 3.29Å; A925-L929 VanDerWaalsContact O-N 3.1Å; V926-L929 PolarHBondContact O-N 2.96Å; L929-K931 PolarHBondContact O-N 2.82Å; L929-K931 VanDerWaalsContact O-N 3.11Å; L929-A932 WeakPolarHBondContact O-CB 3.26Å; L929-A932 PolarHBondContact O-N 3.36Å
930	L	90.9	Very high	80.6	Confident	9 Å²	9	88 Å²	88	5%	0.047	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.5	179.9	-65.1	177.4	0	0	0	113.9	L882 A886 V894 R904 P914 L915 A918 V926	L882-L930 HydrophobicContact CD1-CD2 4.37Å; L882-L930 HydrophobicContact CD2-CD2 4.39Å; A886-L930 HydrophobicContact CB-CD1 4.05Å; V894-L930 HydrophobicContact CG1-CD2 4.13Å; V894-L930 HydrophobicContact CG1-CG 4.29Å; R904-L930 HydrophobicContact CG-CD2 4.16Å; R904-L930 PolarHBondContact NH1-O 3.47Å; P914-L930 HydrophobicContact CB-CD1 3.88Å; L915-L930 HydrophobicContact CB-CB 4.21Å; L915-L930 HydrophobicContact CB-CD1 4.3Å; L915-L930 HydrophobicContact CD1-CB 3.99Å; A918-L930 HydrophobicContact CB-CD1 4.5Å; V926-L930 HydrophobicContact CG1-CD1 3.68Å; V926-L930 HydrophobicContact CG1-CG 4.19Å; V926-L930 WeakPolarHBondContact O-CG 3.21Å; V926-L930 PolarHBondContact O-N 2.92Å
931	K	90	Very high	78.7	Confident	135 Å²	135	86.8 Å²	86.8	59%	0.587	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-16.8	170.8	-75.5	178.9	-172.3	173.1	0	114.2	L915 T927 K928 L929	L915-K931 HydrophobicContact CD1-CG 3.87Å; L915-K931 HydrophobicContact CD2-CG 4.11Å; T927-K931 HydrophobicContact CG2-CD 4.33Å; T927-K931 WeakPolarHBondContact O-CB 3.01Å; T927-K931 VanDerWaalsContact O-CD 3.26Å; T927-K931 WeakPolarHBondContact O-CD 3.4Å; T927-K931 WeakPolarHBondContact O-CG 3.44Å; K928-K931 PolarHBondContact O-N 2.99Å; L929-K931 PolarHBondContact O-N 2.82Å; L929-K931 VanDerWaalsContact O-N 3.11Å
932	A	84.1	Confident	76.7	Confident	54 Å²	54	90.9 Å²	90.9	45%	0.446	46%	0.461	S	S	.	.	S	Bend	trans	-63.4	160.4	172.2	0	0	0	0	0	109.5	R904 K928 L929 Q934	R904-A932 PolarHBondContact NH1-O 2.87Å; K928-A932 PolarHBondContact O-N 3.15Å; L929-A932 WeakPolarHBondContact O-CB 3.26Å; L929-A932 PolarHBondContact O-N 3.36Å; A932-Q934 PolarHBondContact O-N 3.12Å
933	R	74.9	Confident	74.7	Confident	239 Å²	239	93.8 Å²	93.8	90%	0.902	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-56	136.4	170.6	-174.1	178.6	-177.6	168.4	2.5	108.7
934	Q	72.6	Confident	72.9	Confident	113 Å²	113	92.8 Å²	92.8	53%	0.528	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-52.9	131.5	173.2	-87.9	174	-42.5	0	0	109.8	R904 A932	R904-Q934 HydrophobicContact CG-CG 4.48Å; A932-Q934 PolarHBondContact O-N 3.12Å
935	P	65.4	Low	71	Confident	58 Å²	58	90.7 Å²	90.7	38%	0.377	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-61.1	155.6	169.2	28.2	-33.8	0	0	0	109.3	D898 A899 A937	D898-P935 WeakPolarHBondContact OD2-CD 3.47Å; A899-P935 HydrophobicContact CB-CG 4.5Å; P935-A937 PolarHBondContact O-N 3.25Å
936	K	60.5	Low	69.1	Low	198 Å²	198	95.9 Å²	95.9	86%	0.861	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-62	129.1	162.6	-71.5	-173.1	176.8	-175.1	0	107.1	I938	K936-I938 PolarHBondContact O-N 3.38Å
937	A	60.4	Low	67.2	Low	60 Å²	60	102.3 Å²	102.3	50%	0.496	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-58.4	124.6	179.1	0	0	0	0	0	110	P935 Q939	P935-A937 PolarHBondContact O-N 3.25Å; A937-Q939 PolarHBondContact O-N 3.41Å; A937-Q939 VanDerWaalsContact O-N 3.1Å
938	I	59.8	Low	65.4	Low	84 Å²	84	103.4 Å²	103.4	43%	0.431	50%	0.499	S	S	.	.			trans	-77.7	96.5	178.8	-57.1	174	0	0	0	107.8	W865 A899 K936 L940	W865-I938 HydrophobicContact CH2-CG2 4.14Å; W865-I938 HydrophobicContact CZ2-CG2 4.2Å; A899-I938 HydrophobicContact CB-CD1 4.11Å; A899-I938 WeakPolarHBondContact O-CG1 3.24Å; A899-I938 PolarHBondContact O-N 3.42Å; K936-I938 PolarHBondContact O-N 3.38Å; I938-L940 HydrophobicContact CG2-CD2 4.49Å
939	Q	55.3	Low	63.2	Low	179 Å²	179	97.9 Å²	97.9	84%	0.836	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-76.9	137.1	155.3	-70.3	-169	-24.6	0	0	108.6	A937	A937-Q939 PolarHBondContact O-N 3.41Å; A937-Q939 VanDerWaalsContact O-N 3.1Å
940	L	51.9	Low	61.5	Low	44 Å²	44	99.5 Å²	99.5	23%	0.23	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-86.2	124.9	173	-67.1	172.6	0	0	0	108.9	W865 I938 S944 R945 V948	W865-L940 HydrophobicContact CD2-CD1 3.79Å; W865-L940 HydrophobicContact CE3-CD1 3.85Å; W865-L940 HydrophobicContact CH2-CD1 3.7Å; W865-L940 HydrophobicContact CH2-CD2 3.41Å; W865-L940 VanDerWaalsContact CH2-CD2 3.41Å; W865-L940 HydrophobicContact CH2-CG 3.55Å; W865-L940 HydrophobicContact CZ2-CD1 3.62Å; W865-L940 HydrophobicContact CZ2-CD2 3.8Å; W865-L940 HydrophobicContact CZ2-CG 3.4Å; W865-L940 HydrophobicContact CZ3-CD1 3.76Å; W865-L940 HydrophobicContact CZ3-CD2 3.95Å; W865-L940 HydrophobicContact CZ3-CG 4.13Å; I938-L940 HydrophobicContact CG2-CD2 4.49Å; L940-S944 VanDerWaalsContact CD2-CB 3.44Å; L940-R945 HydrophobicContact CB-CB 4.26Å; L940-R945 HydrophobicContact CD1-CB 4.06Å; L940-R945 HydrophobicContact CD1-CG 4.15Å; L940-V948 HydrophobicContact CD2-CG2 4.31Å
941	D	53.6	Low	60	Low	91 Å²	91	104.9 Å²	104.9	49%	0.487	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-71.3	166	147.5	56.1	39.3	0	0	0	110	N943 S944 R945	D941-N943 PolarHBondContact O-N 3.41Å; D941-N943 PolarHBondContact OD1-N 3.27Å; D941-S944 PolarHBondContact O-N 2.93Å; D941-S944 VanDerWaalsContact O-N 3.17Å; D941-S944 WeakPolarHBondContact OD1-CB 3.2Å; D941-S944 PolarHBondContact OD1-N 2.86Å; D941-S944 PolarHBondContact OD1-OG 3.22Å; D941-R945 PolarHBondContact O-N 2.97Å
942	E	50.3	Low	58.1	Low	157 Å²	157	98.7 Å²	98.7	73%	0.734	48%	0.479	S	S	*	.	H	α-helix	trans	-59.6	-32	-177.3	-60.7	-176.2	149.3	0	0	112.5	R945 W946	E942-R945 WeakPolarHBondContact O-CB 3.32Å; E942-R945 PolarHBondContact O-N 3.45Å; E942-W946 PolarHBondContact O-N 3.44Å
943	N	51.2	Low	56.4	Low	104 Å²	104	97.8 Å²	97.8	56%	0.556	47%	0.472	S	S	*	.	H	α-helix	trans	-67.9	-44.9	177.1	-65	-33.2	0	0	0	111.6	D941 R945 W946 M947	D941-N943 PolarHBondContact O-N 3.41Å; D941-N943 PolarHBondContact OD1-N 3.27Å; N943-R945 VanDerWaalsContact C-N 3.31Å; N943-R945 PolarHBondContact O-N 2.9Å; N943-W946 WeakPolarHBondContact O-CB 3.33Å; N943-W946 PolarHBondContact O-N 2.95Å; N943-M947 WeakPolarHBondContact O-CG 3.49Å; N943-M947 PolarHBondContact O-N 3.28Å
944	S	57.2	Low	55.4	Low	41 Å²	41	92.4 Å²	92.4	29%	0.287	46%	0.455	S	S	.	.	H	α-helix	trans	-64.9	-38.3	175.1	-58.3	0	0	0	0	110.7	L940 D941 W946 M947 V948	L940-S944 VanDerWaalsContact CD2-CB 3.44Å; D941-S944 PolarHBondContact O-N 2.93Å; D941-S944 VanDerWaalsContact O-N 3.17Å; D941-S944 WeakPolarHBondContact OD1-CB 3.2Å; D941-S944 PolarHBondContact OD1-N 2.86Å; D941-S944 PolarHBondContact OD1-OG 3.22Å; S944-W946 VanDerWaalsContact C-N 3.34Å; S944-M947 PolarHBondContact O-N 3.39Å; S944-V948 VanDerWaalsContact O-CG2 3.31Å; S944-V948 WeakPolarHBondContact O-CG2 3.41Å; S944-V948 PolarHBondContact O-N 2.92Å
945	R	52.6	Low	54.5	Low	77 Å²	77	90.6 Å²	90.6	29%	0.291	45%	0.446	S	S	.	.	H	α-helix	trans	-60.8	-43	173	-165.6	175.7	-175.8	151.3	-2.9	110.8	L866 D868 L940 D941 E942 N943 V948 M949	L866-R945 HydrophobicContact CD2-CG 3.85Å; L866-R945 PolarHBondContact O-NE 3.08Å; L866-R945 PolarHBondContact O-NH2 3.24Å; D868-R945 VanDerWaalsContact CG-NH1 3.33Å; D868-R945 VanDerWaalsContact CG-NH2 3.34Å; D868-R945 IonicContact OD1-CZ 2.84Å; D868-R945 IonicContact OD1-NH1 3.91Å; D868-R945 PolarHBondContact OD1-NH1 2.9Å; D868-R945 VanDerWaalsContact OD1-NH1 3.09Å; D868-R945 IonicContact OD1-NH2 2.75Å; D868-R945 IonicContact OD2-CZ 3.36Å; D868-R945 IonicContact OD2-NH1 2.82Å; D868-R945 PolarHBondContact OD2-NH1 3.45Å; D868-R945 IonicContact OD2-NH2 2.66Å; D868-R945 PolarHBondContact OD2-NH2 3.32Å; L940-R945 HydrophobicContact CB-CB 4.26Å; L940-R945 HydrophobicContact CD1-CB 4.06Å; L940-R945 HydrophobicContact CD1-CG 4.15Å; D941-R945 PolarHBondContact O-N 2.97Å; E942-R945 WeakPolarHBondContact O-CB 3.32Å; E942-R945 PolarHBondContact O-N 3.45Å; N943-R945 VanDerWaalsContact C-N 3.31Å; N943-R945 PolarHBondContact O-N 2.9Å; R945-V948 PolarHBondContact O-N 3.49Å; R945-M949 WeakPolarHBondContact O-CB 3.3Å; R945-M949 VanDerWaalsContact O-CG 3.27Å; R945-M949 WeakPolarHBondContact O-CG 3.48Å; R945-M949 PolarHBondContact O-N 2.76Å
946	W	51	Low	53.5	Low	153 Å²	153	89.3 Å²	89.3	58%	0.58	43%	0.434	S	S	*	.	H	α-helix	trans	-60.4	-49.6	171.4	173.3	-91.5	0	0	0	112.6	E942 N943 S944 V948 M949 E950	E942-W946 PolarHBondContact O-N 3.44Å; N943-W946 WeakPolarHBondContact O-CB 3.33Å; N943-W946 PolarHBondContact O-N 2.95Å; S944-W946 VanDerWaalsContact C-N 3.34Å; W946-V948 VanDerWaalsContact C-N 3.25Å; W946-V948 PolarHBondContact O-N 2.71Å; W946-M949 WeakPolarHBondContact O-CB 3.36Å; W946-M949 PolarHBondContact O-N 3.01Å; W946-M949 VanDerWaalsContact O-N 3.16Å; W946-E950 HydrophobicContact CZ2-CB 4.48Å; W946-E950 HydrophobicContact CZ2-CG 4.22Å; W946-E950 PolarHBondContact NE1-OE2 3.06Å; W946-E950 WeakPolarHBondContact O-CB 3.37Å; W946-E950 PolarHBondContact O-N 3.25Å
947	M	53.1	Low	53.2	Low	135 Å²	135	86.1 Å²	86.1	67%	0.665	42%	0.42	S	S	*	.	H	α-helix	trans	-59.6	-37.4	-179.2	-69.7	-179.1	75	0	0	112.4	N943 S944 K951	N943-M947 WeakPolarHBondContact O-CG 3.49Å; N943-M947 PolarHBondContact O-N 3.28Å; S944-M947 PolarHBondContact O-N 3.39Å; M947-K951 WeakPolarHBondContact O-CB 3.32Å; M947-K951 PolarHBondContact O-N 3.29Å
948	V	54.5	Low	53	Low	33 Å²	33	91 Å²	91	20%	0.2	43%	0.43	C	S	.	.	H	α-helix	trans	-69.4	-47.5	174.8	173.1	0	0	0	0	110.8	W865 L866 L940 S944 R945 W946 E950 K951 L952	W865-V948 HydrophobicContact CE3-CG1 4.21Å; W865-V948 HydrophobicContact CZ3-CG1 4.02Å; W865-V948 HydrophobicContact CZ3-CG2 3.99Å; L866-V948 HydrophobicContact CD1-CG1 4.26Å; L866-V948 HydrophobicContact CD2-CB 4.35Å; L866-V948 HydrophobicContact CD2-CG1 3.97Å; L866-V948 HydrophobicContact CG-CG1 4.29Å; L940-V948 HydrophobicContact CD2-CG2 4.31Å; S944-V948 VanDerWaalsContact O-CG2 3.31Å; S944-V948 WeakPolarHBondContact O-CG2 3.41Å; S944-V948 PolarHBondContact O-N 2.92Å; R945-V948 PolarHBondContact O-N 3.49Å; W946-V948 VanDerWaalsContact C-N 3.25Å; W946-V948 PolarHBondContact O-N 2.71Å; V948-E950 VanDerWaalsContact C-N 3.3Å; V948-E950 PolarHBondContact O-N 3.19Å; V948-K951 PolarHBondContact O-N 3.15Å; V948-L952 HydrophobicContact CG1-CD1 3.54Å; V948-L952 WeakPolarHBondContact O-CB 3.26Å; V948-L952 WeakPolarHBondContact O-CD1 3.18Å; V948-L952 WeakPolarHBondContact O-CG 3.48Å; V948-L952 PolarHBondContact O-N 2.99Å
949	M	47.3	Very low	52.4	Low	48 Å²	48	92.5 Å²	92.5	24%	0.236	44%	0.435	C	S	.	.	H	α-helix	trans	-53	-45.6	171.8	-76.1	-70.3	-68.6	0	0	111.9	L866 R945 W946 L952 A953 V970	L866-M949 HydrophobicContact CB-SD 4.06Å; L866-M949 HydrophobicContact CD1-CG 4.23Å; L866-M949 HydrophobicContact CD1-SD 3.49Å; L866-M949 WeakPolarHBondContact CD1-SD 3.41Å; L866-M949 HydrophobicContact CD2-CG 3.71Å; L866-M949 HydrophobicContact CD2-SD 3.82Å; L866-M949 HydrophobicContact CG-CG 4.5Å; L866-M949 HydrophobicContact CG-SD 3.99Å; R945-M949 WeakPolarHBondContact O-CB 3.3Å; R945-M949 VanDerWaalsContact O-CG 3.27Å; R945-M949 WeakPolarHBondContact O-CG 3.48Å; R945-M949 PolarHBondContact O-N 2.76Å; W946-M949 WeakPolarHBondContact O-CB 3.36Å; W946-M949 PolarHBondContact O-N 3.01Å; W946-M949 VanDerWaalsContact O-N 3.16Å; M949-L952 PolarHBondContact O-N 3.06Å; M949-A953 WeakPolarHBondContact O-CB 3.4Å; M949-A953 PolarHBondContact O-N 2.89Å; M949-V970 HydrophobicContact CE-CG2 4.24Å
950	E	54.3	Low	51.8	Low	77 Å²	77	86 Å²	86	36%	0.36	41%	0.406	S	S	.	.	H	α-helix	trans	-71.4	-36.5	-176.1	-156.1	-162.2	125.8	0	0	112	W946 V948 K954	W946-E950 HydrophobicContact CZ2-CB 4.48Å; W946-E950 HydrophobicContact CZ2-CG 4.22Å; W946-E950 PolarHBondContact NE1-OE2 3.06Å; W946-E950 WeakPolarHBondContact O-CB 3.37Å; W946-E950 PolarHBondContact O-N 3.25Å; V948-E950 VanDerWaalsContact C-N 3.3Å; V948-E950 PolarHBondContact O-N 3.19Å; E950-K954 WeakPolarHBondContact O-CD 3.14Å; E950-K954 VanDerWaalsContact O-CG 3.29Å; E950-K954 WeakPolarHBondContact O-CG 3.2Å; E950-K954 PolarHBondContact O-N 3.09Å; E950-K954 VanDerWaalsContact OE1-CE 3.25Å; E950-K954 WeakPolarHBondContact OE1-CE 3.21Å; E950-K954 IonicContact OE1-NZ 2.71Å; E950-K954 PolarHBondContact OE1-NZ 2.85Å
951	K	60.3	Low	51.3	Low	123 Å²	123	86.4 Å²	86.4	54%	0.535	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-46.5	172	-178.7	176.6	170.2	-179.4	0	111.2	M947 V948 K954 E955	M947-K951 WeakPolarHBondContact O-CB 3.32Å; M947-K951 PolarHBondContact O-N 3.29Å; V948-K951 PolarHBondContact O-N 3.15Å; K951-K954 WeakPolarHBondContact O-CA 3.46Å; K951-K954 WeakPolarHBondContact O-CB 3.35Å; K951-K954 PolarHBondContact O-N 3.47Å; K951-E955 WeakPolarHBondContact CE-OE1 3.32Å; K951-E955 IonicContact NZ-OE1 3.9Å; K951-E955 PolarHBondContact O-N 3.1Å
952	L	49.3	Very low	50.6	Low	4 Å²	4	87.7 Å²	87.7	2%	0.021	43%	0.425	C	S	.	.	H	α-helix	trans	-69	-35.5	179	-71.5	154.7	0	0	0	111.9	L859 N862 L866 V948 M949 K954 E955 W956	L859-L952 HydrophobicContact CD2-CD2 3.96Å; N862-L952 HydrophobicContact CB-CD1 3.49Å; N862-L952 VanDerWaalsContact CB-CD1 3.49Å; N862-L952 HydrophobicContact CB-CD2 3.75Å; N862-L952 HydrophobicContact CB-CG 4.27Å; L866-L952 HydrophobicContact CD1-CD1 3.38Å; L866-L952 HydrophobicContact CG-CD1 4.48Å; V948-L952 HydrophobicContact CG1-CD1 3.54Å; V948-L952 WeakPolarHBondContact O-CB 3.26Å; V948-L952 WeakPolarHBondContact O-CD1 3.18Å; V948-L952 WeakPolarHBondContact O-CG 3.48Å; V948-L952 PolarHBondContact O-N 2.99Å; M949-L952 PolarHBondContact O-N 3.06Å; L952-K954 PolarHBondContact O-N 3.3Å; L952-E955 CarbonylContact O-C 3.5Å; L952-E955 PolarHBondContact O-N 3.34Å; L952-E955 VanDerWaalsContact O-N 3.1Å; L952-W956 VanDerWaalsContact O-CB 3.26Å; L952-W956 WeakPolarHBondContact O-CB 3.36Å; L952-W956 VanDerWaalsContact O-CD1 3.29Å; L952-W956 PolarHBondContact O-N 2.9Å
953	A	49.6	Very low	50	Low	36 Å²	36	83.1 Å²	83.1	30%	0.298	41%	0.406	S	S	.	.	H	α-helix	trans	-63.6	-19.5	171.2	0	0	0	0	0	112.9	M949 K957	M949-A953 WeakPolarHBondContact O-CB 3.4Å; M949-A953 PolarHBondContact O-N 2.89Å; A953-K957 WeakPolarHBondContact O-CD 3.44Å; A953-K957 WeakPolarHBondContact O-CE 3.36Å; A953-K957 WeakPolarHBondContact O-CG 3.47Å
954	K	52.5	Low	49.5	Very low	126 Å²	126	84.1 Å²	84.1	55%	0.548	41%	0.405	S	S	.	.	H	α-helix	trans	-84.8	-40.1	169.6	-66.4	161	-170.8	171.4	0	111.5	E950 K951 L952 K958	E950-K954 WeakPolarHBondContact O-CD 3.14Å; E950-K954 VanDerWaalsContact O-CG 3.29Å; E950-K954 WeakPolarHBondContact O-CG 3.2Å; E950-K954 PolarHBondContact O-N 3.09Å; E950-K954 VanDerWaalsContact OE1-CE 3.25Å; E950-K954 WeakPolarHBondContact OE1-CE 3.21Å; E950-K954 IonicContact OE1-NZ 2.71Å; E950-K954 PolarHBondContact OE1-NZ 2.85Å; K951-K954 WeakPolarHBondContact O-CA 3.46Å; K951-K954 WeakPolarHBondContact O-CB 3.35Å; K951-K954 PolarHBondContact O-N 3.47Å; L952-K954 PolarHBondContact O-N 3.3Å; K954-K958 PolarHBondContact O-N 3.4Å
955	E	54.1	Low	48.3	Very low	74 Å²	74	92.4 Å²	92.4	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-70.4	-42.7	177.5	-69.3	173.2	170.7	0	0	112.5	K951 L952 K957 K958 E959	K951-E955 WeakPolarHBondContact CE-OE1 3.32Å; K951-E955 IonicContact NZ-OE1 3.9Å; K951-E955 PolarHBondContact O-N 3.1Å; L952-E955 CarbonylContact O-C 3.5Å; L952-E955 PolarHBondContact O-N 3.34Å; L952-E955 VanDerWaalsContact O-N 3.1Å; E955-K957 PolarHBondContact O-N 3.45Å; E955-K958 WeakPolarHBondContact O-CA 3.19Å; E955-K958 VanDerWaalsContact O-CB 3.32Å; E955-K958 WeakPolarHBondContact O-CB 3.28Å; E955-K958 PolarHBondContact O-N 2.98Å; E955-E959 PolarHBondContact O-N 2.86Å
956	W	45.7	Very low	47.5	Very low	31 Å²	31	95 Å²	95	12%	0.117	45%	0.451	C	S	.	.	H	α-helix	trans	-58.9	-43.2	172.2	-69.3	5.9	0	0	0	112.2	F814 L863 L952 K958 E959 L960 W968	F814-W956 AromaticContact CE1-CD1 3.74Å; F814-W956 HydrophobicContact CE1-CD2 4.21Å; F814-W956 AromaticContact CE1-CE2 3.94Å; F814-W956 HydrophobicContact CE1-CG 4.11Å; F814-W956 AromaticContact CE1-NE1 3.64Å; F814-W956 AromaticContact CZ-CD1 4Å; F814-W956 HydrophobicContact CZ-CD2 4.27Å; F814-W956 AromaticContact CZ-CE2 3.56Å; F814-W956 AromaticContact CZ-CZ2 3.83Å; F814-W956 HydrophobicContact CZ-CZ2 3.83Å; F814-W956 AromaticContact CZ-NE1 3.38Å; L863-W956 HydrophobicContact CB-CZ2 4.26Å; L863-W956 HydrophobicContact CD1-CH2 3.79Å; L863-W956 HydrophobicContact CD1-CZ2 3.96Å; L863-W956 HydrophobicContact CD2-CH2 4.04Å; L863-W956 HydrophobicContact CD2-CZ2 3.99Å; L863-W956 HydrophobicContact CG-CH2 4.44Å; L863-W956 HydrophobicContact CG-CZ2 4.3Å; L952-W956 VanDerWaalsContact O-CB 3.26Å; L952-W956 WeakPolarHBondContact O-CB 3.36Å; L952-W956 VanDerWaalsContact O-CD1 3.29Å; L952-W956 PolarHBondContact O-N 2.9Å; W956-K958 PolarHBondContact O-N 3.13Å; W956-E959 PolarHBondContact O-N 3.47Å; W956-L960 HydrophobicContact CB-CD1 4Å; W956-L960 WeakPolarHBondContact O-CB 3.44Å; W956-L960 VanDerWaalsContact O-CG 3.28Å; W956-L960 WeakPolarHBondContact O-CG 3.45Å; W956-L960 PolarHBondContact O-N 3.33Å; W956-W968 HydrophobicContact CZ3-CH2 4.26Å; W956-W968 HydrophobicContact CZ3-CZ2 4.38Å
957	K	52.8	Low	46.5	Very low	131 Å²	131	94.2 Å²	94.2	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-63.1	-21.4	175.4	-76.8	172	-167.4	160.7	0	112.7	A953 E955	A953-K957 WeakPolarHBondContact O-CD 3.44Å; A953-K957 WeakPolarHBondContact O-CE 3.36Å; A953-K957 WeakPolarHBondContact O-CG 3.47Å; E955-K957 PolarHBondContact O-N 3.45Å
958	K	55.9	Low	45.3	Very low	163 Å²	163	94.7 Å²	94.7	71%	0.709	46%	0.458	S	S	*	.	H	α-helix	trans	-89.2	-41.3	177.7	-169.1	-179.3	179.2	-178.2	0	112.8	K954 E955 W956	K954-K958 PolarHBondContact O-N 3.4Å; E955-K958 WeakPolarHBondContact O-CA 3.19Å; E955-K958 VanDerWaalsContact O-CB 3.32Å; E955-K958 WeakPolarHBondContact O-CB 3.28Å; E955-K958 PolarHBondContact O-N 2.98Å; W956-K958 PolarHBondContact O-N 3.13Å
959	E	48.1	Very low	44	Very low	115 Å²	115	100.2 Å²	100.2	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-81.5	-36.2	178.6	-69.9	-161.8	-171.2	0	0	113.5	L859 E955 W956	L859-E959 WeakPolarHBondContact CD1-OE2 3.45Å; E955-E959 PolarHBondContact O-N 2.86Å; W956-E959 PolarHBondContact O-N 3.47Å
960	L	43.5	Very low	43.3	Very low	44 Å²	44	102 Å²	102	23%	0.23	50%	0.497	C	S	.	.	S	Bend	trans	-79.7	-18.5	-172.9	-64.6	173.2	0	0	0	114.7	F814 P815 W956 M962	F814-L960 HydrophobicContact CD1-CD2 3.97Å; F814-L960 HydrophobicContact CE1-CD2 4.47Å; P815-L960 HydrophobicContact CB-CD2 3.86Å; P815-L960 HydrophobicContact CG-CD2 3.6Å; W956-L960 HydrophobicContact CB-CD1 4Å; W956-L960 WeakPolarHBondContact O-CB 3.44Å; W956-L960 VanDerWaalsContact O-CG 3.28Å; W956-L960 WeakPolarHBondContact O-CG 3.45Å; W956-L960 PolarHBondContact O-N 3.33Å; L960-M962 HydrophobicContact CB-CB 4.18Å; L960-M962 HydrophobicContact CB-CG 3.86Å; L960-M962 HydrophobicContact CB-SD 4.03Å; L960-M962 HydrophobicContact CD1-SD 3.97Å; L960-M962 HydrophobicContact CG-SD 4.44Å; L960-M962 PolarHBondContact O-N 3.03Å
961	G	40	Very low	42	Very low	51 Å²	51	102.6 Å²	102.6	53%	0.526	50%	0.503	S	S	.	.			trans	58.1	12	-172.2	0	0	0	0	0	114.8	N963	G961-N963 PolarHBondContact O-ND2 2.83Å
962	M	39.6	Very low	40.6	Very low	118 Å²	118	103.9 Å²	103.9	58%	0.581	51%	0.511	S	S	*	.			trans	-75.2	132.1	-169	-78.6	177.2	98.1	0	0	112.3	L960	L960-M962 HydrophobicContact CB-CB 4.18Å; L960-M962 HydrophobicContact CB-CG 3.86Å; L960-M962 HydrophobicContact CB-SD 4.03Å; L960-M962 HydrophobicContact CD1-SD 3.97Å; L960-M962 HydrophobicContact CG-SD 4.44Å; L960-M962 PolarHBondContact O-N 3.03Å
963	N	38.5	Very low	39.7	Very low	62 Å²	62	107.2 Å²	107.2	33%	0.332	53%	0.534	S	S	.	.			trans	-136.6	52.5	-172.5	-79.9	-94.3	0	0	0	110.5	K239 G961	K239-N963 HydrophobicContact CB-CB 3.8Å; K239-N963 HydrophobicContact CD-CB 3.56Å; K239-N963 HydrophobicContact CG-CB 3.51Å; K239-N963 PolarHBondContact N-OD1 2.7Å; G961-N963 PolarHBondContact O-ND2 2.83Å
964	K	40.2	Very low	38.8	Very low	124 Å²	124	113.5 Å²	113.5	54%	0.539	56%	0.557	S	S	.	*			trans	-111.3	147.2	163.2	-82	-170.5	176.8	-179.3	0	108.8	E782 E966	E782-K964 IonicContact OE1-NZ 2.65Å; E782-K964 PolarHBondContact OE1-NZ 2.92Å; K964-E966 WeakPolarHBondContact CD-OE1 3.19Å; K964-E966 IonicContact NZ-OE1 3.21Å; K964-E966 PolarHBondContact O-N 2.81Å
965	K	31.8	Very low	37.5	Very low	215 Å²	215	112.8 Å²	112.8	94%	0.935	56%	0.564	S	S	*	*			trans	-90.9	85.8	167.7	-81.6	-174.7	174.6	-179.6	0	109.4
966	E	36	Very low	36.1	Very low	132 Å²	132	114.2 Å²	114.2	62%	0.617	58%	0.577	S	S	*	*			trans	-122	140.4	168.7	-76	167.8	-160.9	0	0	109.5	K964 W968	K964-E966 WeakPolarHBondContact CD-OE1 3.19Å; K964-E966 IonicContact NZ-OE1 3.21Å; K964-E966 PolarHBondContact O-N 2.81Å; E966-W968 PolarHBondContact O-N 2.94Å; E966-W968 VanDerWaalsContact O-N 3.12Å
967	T	29.4	Very low	35.4	Very low	137 Å²	137	119.9 Å²	119.9	84%	0.84	60%	0.602	S	S	*	*			trans	-88	87.4	-154	41.6	0	0	0	0	113.6	M969	T967-M969 PolarHBondContact O-N 3.27Å
968	W	27.2	Very low	34.1	Very low	144 Å²	144	120.9 Å²	120.9	55%	0.545	61%	0.613	S	S	.	*			trans	-71.7	77.7	160.6	-82.2	80	0	0	0	111.3	D822 W956 E966	D822-W968 WeakPolarHBondContact OD1-CH2 3.31Å; D822-W968 WeakPolarHBondContact OD1-CZ2 3.47Å; D822-W968 WeakPolarHBondContact OD2-CZ2 3.31Å; W956-W968 HydrophobicContact CZ3-CH2 4.26Å; W956-W968 HydrophobicContact CZ3-CZ2 4.38Å; E966-W968 PolarHBondContact O-N 2.94Å; E966-W968 VanDerWaalsContact O-N 3.12Å
969	M	27.1	Very low	32.7	Very low	149 Å²	149	116.7 Å²	116.7	73%	0.734	61%	0.608	S	S	*	*			trans	-116.4	106.6	163.8	-150.5	178.5	80	0	0	107.2	T967 D971	T967-M969 PolarHBondContact O-N 3.27Å; M969-D971 PolarHBondContact O-N 3.11Å
970	V	33.2	Very low	31.7	Very low	86 Å²	86	119 Å²	119	52%	0.521	62%	0.624	S	S	.	*			trans	-69.1	100.6	176	177	0	0	0	0	107.6	M949 H972	M949-V970 HydrophobicContact CE-CG2 4.24Å; V970-H972 PolarHBondContact O-N 3.47Å; V970-H972 VanDerWaalsContact O-N 3.16Å
971	D	28.1	Very low	31.1	Very low	89 Å²	89	122.2 Å²	122.2	48%	0.476	65%	0.65	S	S	.	*			trans	-84.8	93.2	-171.4	-169.5	11.4	0	0	0	112.1	M969 S973	M969-D971 PolarHBondContact O-N 3.11Å; D971-S973 PolarHBondContact O-N 3.4Å; D971-S973 VanDerWaalsContact O-N 3.09Å; D971-S973 WeakPolarHBondContact OD1-CB 3.36Å; D971-S973 PolarHBondContact OD1-N 2.91Å; D971-S973 PolarHBondContact OD1-OG 2.79Å; D971-S973 PolarHBondContact OD2-OG 3.22Å
972	H	31.1	Very low	30.5	Very low	151 Å²	151	126.1 Å²	126.1	70%	0.699	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-70.5	14.9	169.8	-74	-9.5	0	0	0	114.1	V970	V970-H972 PolarHBondContact O-N 3.47Å; V970-H972 VanDerWaalsContact O-N 3.16Å
973	S	29.6	Very low	29.9	Very low	73 Å²	73	125.5 Å²	125.5	51%	0.51	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-79	-13.4	177.6	79.8	0	0	0	0	115.5	D971 T975	D971-S973 PolarHBondContact O-N 3.4Å; D971-S973 VanDerWaalsContact O-N 3.09Å; D971-S973 WeakPolarHBondContact OD1-CB 3.36Å; D971-S973 PolarHBondContact OD1-N 2.91Å; D971-S973 PolarHBondContact OD1-OG 2.79Å; D971-S973 PolarHBondContact OD2-OG 3.22Å; S973-T975 PolarHBondContact O-N 2.65Å
974	Q	29.7	Very low	29.5	Very low	169 Å²	169	127.6 Å²	127.6	79%	0.79	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-78.6	18.4	-176.6	-68.3	-156.3	-6.2	0	0	115.6
975	T	26.5	Very low	28.8	Very low	111 Å²	111	125.9 Å²	125.9	68%	0.681	71%	0.708	S	S	*	*	S	Bend	trans	-119.4	133	157.9	49.4	0	0	0	0	110.1	S973	S973-T975 PolarHBondContact O-N 2.65Å
976	V	25.1	Very low	28.7	Very low	103 Å²	103	123.6 Å²	123.6	62%	0.624	71%	0.705	S	S	*	*	S	Bend	trans	68.6	71.5	177.5	-161.4	0	0	0	0	116.2
977	K	29	Very low	28.3	Very low	150 Å²	150	129.5 Å²	129.5	65%	0.652	72%	0.722	S	S	*	*				-173.5	109.2	120.2	-99.9	146.1	-163.4	159.2	0	117.3
978	I	26.8	Very low	28.2	Very low	153 Å²	153	126.4 Å²	126.4	79%	0.785	72%	0.717	S	S	*	*				48.7	102.2	125.4	-53.7	173.7	0	0	0	118.4
979	A	26.1	Very low	28.2	Very low	75 Å²	75	127.8 Å²	127.8	62%	0.62	73%	0.73	S	S	*	*			trans	32.6	135.9	130.4	0	0	0	0	0	122.7
980	N	27.6	Very low	28.2	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	73%	0.727	S	S	*	*			trans	66.9	132.9	154.7	-57.5	-22.9	0	0	0	116.6
981	S	29.9	Very low	28	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	74%	0.737	S	S	*	*			cis	-158.5	150.1	22.5	58.9	0	0	0	0	113.9
982	T	27.6	Very low	28	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	75%	0.751	S	S	*	*			trans	-73	147.7	144.4	53.5	0	0	0	0	107.3
983	S	28.4	Very low	27.7	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	75%	0.752	S	S	*	*			cis	-169.9	-164.7	35.7	60.1	0	0	0	0	110.8
984	S	29.4	Very low	27.5	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	77%	0.767	S	S	*	*			trans	75.8	95.5	159.4	76.6	0	0	0	0	118.8
985	G	25.8	Very low	27.4	Very low	87 Å²	87	130.8 Å²	130.8	90%	0.897	76%	0.759	S	S	*	*			trans	-107.9	67.6	155	0	0	0	0	0	111.6
986	L	29.8	Very low	27.4	Very low	167 Å²	167	134.8 Å²	134.8	87%	0.874	77%	0.773	S	S	*	*			trans	-120.1	135	173.5	-82.9	173.6	0	0	0	111.3
987	R	26.4	Very low	27.6	Very low	257 Å²	257	133.1 Å²	133.1	97%	0.97	78%	0.777	S	S	*	*			trans	-88.5	126.2	175	-61.2	179.9	-178.3	-172.9	2.2	109.5
988	G	27.2	Very low	27.6	Very low	71 Å²	71	131.2 Å²	131.2	73%	0.732	78%	0.782	S	S	*	*			trans	-179.9	100.5	173.1	0	0	0	0	0	115.5
989	Q	28.6	Very low	27.9	Very low	173 Å²	173	132.3 Å²	132.3	81%	0.808	78%	0.783	S	S	*	*			trans	50.6	108.7	148.8	-58.1	-165.9	-101	0	0	121.8
990	E	27.2	Very low	27.9	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.682	79%	0.792	S	S	*	*				56.6	109.4	116.3	-65.7	-180	116.3	0	0	123
991	N	28.8	Very low	27.8	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	79%	0.792	S	S	*	*				79.3	162.3	129.9	-56.2	-30.8	0	0	0	121.5
992	V	26.6	Very low	27.8	Very low	126 Å²	126	136.5 Å²	136.5	76%	0.764	79%	0.788	S	S	*	*			trans	75.3	94.7	168.5	-169.6	0	0	0	0	114.6
993	I	26	Very low	27.8	Very low	141 Å²	141	135.8 Å²	135.8	72%	0.723	79%	0.789	S	S	*	*				97.6	128.7	67.7	-80.7	165.4	0	0	0	112.6
994	D	25.6	Very low	28.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	79%	0.794	S	S	*	*			trans	39.3	149.2	153.1	-63.5	-11.3	0	0	0	122.5
995	A	26.2	Very low	28.3	Very low	77 Å²	77	141 Å²	141	64%	0.636	80%	0.801	S	S	*	*			cis	-172.9	-178.8	-14.2	0	0	0	0	0	109.5
996	M	27.8	Very low	28.5	Very low	196 Å²	196	142.7 Å²	142.7	97%	0.966	79%	0.793	S	S	*	*			trans	73.3	142.4	168.4	-45.7	-173.7	-173.8	0	0	116.6
997	G	28.5	Very low	28.6	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	79%	0.793	S	S	*	*			cis	-176.6	140.7	-8.7	0	0	0	0	0	115.7
998	S	28.8	Very low	29	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	78%	0.779	S	S	*	*			trans	41.6	121.2	141.2	-54.6	0	0	0	0	122.5
999	H	33.6	Very low	29.3	Very low	177 Å²	177	139.3 Å²	139.3	82%	0.819	78%	0.783	S	S	*	*				168.6	121	112.8	-93.7	-81.1	0	0	0	108
1000	K	26.1	Very low	29.2	Very low	185 Å²	185	136.4 Å²	136.4	80%	0.804	78%	0.778	S	S	*	*				55.1	125.6	57.7	-80.8	-170.2	172.4	-176.3	0	112.7
1001	I	26.1	Very low	29.4	Very low	166 Å²	166	137.6 Å²	137.6	85%	0.851	78%	0.783	S	S	*	*			cis	-147.4	-179.2	15.2	17	170.9	0	0	0	109.3
1002	A	29.9	Very low	29.3	Very low	86 Å²	86	137.9 Å²	137.9	71%	0.711	78%	0.784	S	S	*	*			cis	-141.9	-123.5	21.3	0	0	0	0	0	114.2
1003	S	27.4	Very low	29.2	Very low	119 Å²	119	140.4 Å²	140.4	83%	0.832	79%	0.785	S	S	*	*			trans	-161.3	167.2	-175.9	-73	0	0	0	0	112.3
1004	P	37.1	Very low	29.4	Very low	129 Å²	129	141.5 Å²	141.5	84%	0.838	79%	0.787	S	S	*	*			trans	-109.3	176.6	-162.9	41.9	-35.6	0	0	0	115.7
1005	E	30.4	Very low	29.4	Very low	192 Å²	192	142.7 Å²	142.7	90%	0.897	79%	0.788	S	S	*	*			trans	-142.8	118.8	172.6	-149.8	158.7	-136.9	0	0	115.6
1006	V	31.1	Very low	29.3	Very low	121 Å²	121	143.4 Å²	143.4	73%	0.733	79%	0.793	S	S	*	*			trans	-7.9	136	157.9	-156.2	0	0	0	0	120.9
1007	L	30.8	Very low	29.2	Very low	165 Å²	165	142.9 Å²	142.9	86%	0.864	79%	0.788	S	S	*	*				178.7	151	111.9	-90.3	168.6	0	0	0	114
1008	P	35.9	Very low	29	Very low	106 Å²	106	147.5 Å²	147.5	69%	0.688	79%	0.794	S	S	*	*			trans	-112.7	173.2	-176.8	42.6	-34.1	0	0	0	114.2
1009	D	33.4	Very low	28.7	Very low	153 Å²	153	147 Å²	147	82%	0.818	79%	0.791	S	S	*	*			trans	-154.7	-178	145.5	-139	-37	0	0	0	112.9
1010	T	26.9	Very low	28.3	Very low	112 Å²	112	145.5 Å²	145.5	69%	0.687	79%	0.789	S	S	*	*			trans	-111.4	-175.8	-161.6	52.4	0	0	0	0	114.6
1011	Q	30.8	Very low	28.3	Very low	171 Å²	171	143.7 Å²	143.7	80%	0.799	79%	0.787	S	S	*	*			trans	88.8	145.7	177.4	-52.3	-172.8	29.4	0	0	115.7
1012	L	27.1	Very low	28.4	Very low	145 Å²	145	144 Å²	144	76%	0.759	78%	0.784	S	S	*	*			cis	-148	160.3	-4.5	-151.2	73.9	0	0	0	111.7
1013	F	25	Very low	28.1	Very low	179 Å²	179	144.1 Å²	144.1	79%	0.785	78%	0.779	S	S	*	*			trans	-77.2	151.3	164.3	-91.5	-110.2	0	0	0	112.2
1014	Q	28.9	Very low	27.9	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.762	78%	0.775	S	S	*	*				-163.8	152.5	128.4	-111.5	168.1	10.8	0	0	114
1015	H	25.9	Very low	27.5	Very low	178 Å²	178	143.3 Å²	143.3	82%	0.824	77%	0.774	S	S	*	*			trans	-95.9	143	173.3	-80.2	17.9	0	0	0	111.3
1016	A	24.7	Very low	27.1	Very low	92 Å²	92	143.8 Å²	143.8	76%	0.76	77%	0.773	S	S	*	*			trans	174.1	150.1	151.8	0	0	0	0	0	108.7
1017	E	25.4	Very low	27	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	77%	0.772	S	S	*	*			cis	-154	-175.7	-12.9	-124.4	175.9	175.4	0	0	109.9
1018	M	23.8	Very low	26.6	Very low	166 Å²	166	143.3 Å²	143.3	82%	0.818	77%	0.772	S	S	*	*			trans	-89.3	158.8	-172.8	-69.3	165.4	-82.2	0	0	114.8
1019	S	23.4	Very low	26.2	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	78%	0.775	S	S	*	*			trans	82.7	146.3	156.6	77.5	0	0	0	0	119.8
1020	N	24.7	Very low	25.9	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	77%	0.773	S	S	*	*			trans	69.1	144.4	-168.9	-39.8	-71.2	0	0	0	112.4
1021	L	26.4	Very low	25.8	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	78%	0.783	S	S	*	*			cis	-125	135.1	5	-81.7	87.3	0	0	0	109
1022	Q	27.8	Very low	25.7	Very low	172 Å²	172	145 Å²	145	80%	0.804	78%	0.782	S	S	*	*				82.4	134.5	87.6	-156.6	173.5	-9.6	0	0	114.5
1023	C	22.5	Very low	25.8	Very low	90 Å²	90	145 Å²	145	61%	0.608	78%	0.784	S	S	*	*			trans	-90.3	151.9	-172.9	-54.6	0	0	0	0	113.9
1024	G	24.2	Very low	25.8	Very low	72 Å²	72	146.7 Å²	146.7	74%	0.742	79%	0.791	S	S	*	*			trans	82.1	163.6	177.1	0	0	0	0	0	113.8
1025	I	27.7	Very low	25.6	Very low	158 Å²	158	146.3 Å²	146.3	81%	0.81	79%	0.789	S	S	*	*			cis	-144	149.8	9.2	-67.8	175.7	0	0	0	109.4	V1027	I1025-V1027 HydrophobicContact CG2-CG2 4.26Å; I1025-V1027 PolarHBondContact O-N 3.11Å
1026	F	23.7	Very low	25.7	Very low	202 Å²	202	145.7 Å²	145.7	89%	0.886	78%	0.784	S	S	*	*			trans	-64.9	113.2	167.3	-108.3	-92.6	0	0	0	112
1027	V	27.4	Very low	25.8	Very low	116 Å²	116	149.3 Å²	149.3	70%	0.703	79%	0.785	S	S	*	*			trans	-150.3	130	156	-158.8	0	0	0	0	110.9	I1025 T1029	I1025-V1027 HydrophobicContact CG2-CG2 4.26Å; I1025-V1027 PolarHBondContact O-N 3.11Å; V1027-T1029 PolarHBondContact O-N 3.33Å
1028	D	23.6	Very low	26.1	Very low	161 Å²	161	149.9 Å²	149.9	86%	0.861	79%	0.785	S	S	*	*			trans	-66.8	113.5	158.9	-84.2	-61.6	0	0	0	110.3
1029	T	26.2	Very low	26.1	Very low	123 Å²	123	146.1 Å²	146.1	76%	0.755	78%	0.775	S	S	*	*			trans	-165.2	147.6	143.9	1.1	0	0	0	0	113.7	V1027	V1027-T1029 PolarHBondContact O-N 3.33Å
1030	S	28	Very low	26.5	Very low	110 Å²	110	149.4 Å²	149.4	77%	0.769	78%	0.779	S	S	*	*			trans	-46.9	136	177.4	50.9	0	0	0	0	115.8
1031	L	25	Very low	26.7	Very low	171 Å²	171	147.4 Å²	147.4	90%	0.895	78%	0.776	S	S	*	*			trans	-65	131.7	159.5	-93.5	76.7	0	0	0	110.9
1032	H	27.4	Very low	26.7	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.796	78%	0.777	S	S	*	*			trans	-154.4	161.2	145.1	-134.7	-83.6	0	0	0	109.5
1033	D	30.7	Very low	26.7	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	78%	0.775	S	S	*	*			trans	64.1	75.2	168.9	-58.6	-6.7	0	0	0	116.8
1034	F	24	Very low	26.9	Very low	214 Å²	214	144 Å²	144	94%	0.939	78%	0.779	S	S	*	*			trans	-114.4	85.8	165.1	-153.4	-70.5	0	0	0	110.4
1035	E	26.2	Very low	27.1	Very low	155 Å²	155	150.2 Å²	150.2	72%	0.724	79%	0.786	S	S	*	*			trans	-154.9	145.8	171.2	-140.4	-158.6	-158	0	0	116.5
1036	K	26.6	Very low	27	Very low	164 Å²	164	151.3 Å²	151.3	71%	0.713	79%	0.785	S	S	*	*			trans	96.6	133.9	161.8	-59.8	-176.7	169.3	71.9	0	118.8
1037	Q	28	Very low	27.6	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	77%	0.772	S	S	*	*			trans	70.8	123.7	174.8	-48.8	178.6	11.1	0	0	113.6
1038	F	30.1	Very low	27.6	Very low	196 Å²	196	146.9 Å²	146.9	86%	0.86	77%	0.772	S	S	*	*			cis	-128.2	164.1	19.7	-93.8	-95.2	0	0	0	114.4
1039	S	24.9	Very low	27.8	Very low	87 Å²	87	150.7 Å²	150.7	61%	0.608	77%	0.774	S	S	*	*			trans	-117.8	171.2	-177.5	54.3	0	0	0	0	113.5
1040	H	32	Very low	27.8	Very low	168 Å²	168	151.3 Å²	151.3	78%	0.778	78%	0.778	S	S	*	*			trans	88.1	108.1	166	-57.9	-70.5	0	0	0	120.3
1041	S	29	Very low	27.7	Very low	102 Å²	102	155 Å²	155	71%	0.713	78%	0.783	S	S	*	*				100.6	103.7	116	70.1	0	0	0	0	121.1
1042	S	26.5	Very low	28	Very low	110 Å²	110	158.9 Å²	158.9	77%	0.769	79%	0.785	S	S	*	*				94.8	129.6	107.3	-67.9	0	0	0	0	122.4
1043	V	27.1	Very low	28	Very low	128 Å²	128	155.2 Å²	155.2	78%	0.776	78%	0.779	S	S	*	*			trans	86.8	81.7	137.1	174.4	0	0	0	0	118.9
1044	S	25.5	Very low	27.9	Very low	99 Å²	99	154.4 Å²	154.4	69%	0.692	78%	0.775	S	S	*	*				47	132.2	127.2	71	0	0	0	0	122.5
1045	K	30	Very low	28.4	Very low	202 Å²	202	155 Å²	155	88%	0.878	77%	0.773	S	S	*	*				-172.6	132.6	109.7	-102.1	168.4	-176.8	-178.5	0	114.5
1046	F	25.7	Very low	28.5	Very low	181 Å²	181	156.2 Å²	156.2	79%	0.794	78%	0.78	S	S	*	*			trans	-111.8	-177	164	-102.7	-80.1	0	0	0	107.5
1047	P	36.1	Very low	28.9	Very low	94 Å²	94	153 Å²	153	61%	0.61	78%	0.776	S	S	*	*			cis	-134.6	-150.3	-10.6	28.6	-2.2	0	0	0	113.2
1048	D	27.7	Very low	28.9	Very low	131 Å²	131	151.7 Å²	151.7	70%	0.701	78%	0.775	S	S	*	*			trans	82.6	122.8	147.9	-70.9	-8.5	0	0	0	120
1049	W	27.2	Very low	28.9	Very low	242 Å²	242	150.6 Å²	150.6	92%	0.917	78%	0.777	S	S	*	*			cis	-157.7	171.4	39.6	-99.1	-16	0	0	0	115.2
1050	V	24.8	Very low	29.2	Very low	136 Å²	136	152 Å²	152	82%	0.824	78%	0.784	S	S	*	*			trans	-115.5	130.2	171.2	171.7	0	0	0	0	110.8
1051	Q	27.9	Very low	28.9	Very low	187 Å²	187	153.7 Å²	153.7	87%	0.874	79%	0.789	S	S	*	*			trans	171.2	120.1	141.9	-101.6	179.9	11.1	0	0	112.5
1052	R	30.4	Very low	28.9	Very low	252 Å²	252	155.6 Å²	155.6	95%	0.951	79%	0.79	S	S	*	*			trans	-174.1	137	135.4	-109	170.9	-179.1	150	3.7	110.9
1053	S	26.9	Very low	29	Very low	95 Å²	95	157.7 Å²	157.7	66%	0.664	79%	0.786	S	S	*	*			trans	-94.5	-168.8	170.8	55.3	0	0	0	0	111
1054	D	29.3	Very low	29.2	Very low	131 Å²	131	159.1 Å²	159.1	70%	0.701	78%	0.784	S	S	*	*			trans	89.9	149.5	166.4	-41.9	-13.6	0	0	0	114.7
1055	Y	33.4	Very low	29.5	Very low	227 Å²	227	160.5 Å²	160.5	89%	0.89	78%	0.784	S	S	*	*			trans	69.4	93.5	-162.4	-53.7	-79.1	0	0	0	112.8
1056	M	28.8	Very low	29.7	Very low	179 Å²	179	159 Å²	159	88%	0.882	78%	0.777	S	S	*	*			cis	76.4	146.5	46.1	-133.4	-171	-179.7	0	0	112.5
1057	P	35.1	Very low	29.8	Very low	96 Å²	96	159.7 Å²	159.7	62%	0.623	78%	0.78	S	S	*	*				-124.8	-154.9	-79.4	40.2	-25	0	0	0	113.9
1058	D	29	Very low	29.6	Very low	143 Å²	143	162.1 Å²	162.1	77%	0.765	78%	0.783	S	S	*	*			trans	77.6	90.5	164.7	-51.9	-31.1	0	0	0	120.6
1059	L	28.6	Very low	29.8	Very low	172 Å²	172	160.6 Å²	160.6	90%	0.901	78%	0.783	S	S	*	*			trans	-160.3	149.7	145.7	-103.3	135.8	0	0	0	111.1
1060	P	32.2	Very low	30	Very low	117 Å²	117	154.2 Å²	154.2	76%	0.76	76%	0.763	S	S	*	*			trans	-84.6	160.6	-158	-16.3	33.4	0	0	0	118.4	I1062	P1060-I1062 PolarHBondContact O-N 3.11Å
1061	F	25.8	Very low	30.3	Very low	203 Å²	203	154.7 Å²	154.7	89%	0.89	76%	0.761	S	S	*	*			trans	-73.8	97.3	-178.6	-82	-103.1	0	0	0	114.6
1062	I	28.9	Very low	30.4	Very low	142 Å²	142	155.1 Å²	155.1	73%	0.728	75%	0.754	S	S	*	*			trans	-139.6	144.6	156.9	-46.8	-179.9	0	0	0	108.9	P1060	P1060-I1062 PolarHBondContact O-N 3.11Å
1063	F	28.4	Very low	30.3	Very low	154 Å²	154	152.9 Å²	152.9	68%	0.675	75%	0.751	S	S	*	*	S	Bend	trans	76.9	57.8	177.1	-63.1	-80.4	0	0	0	118.8	K1066	F1063-K1066 HydrophobicContact CE1-CD 4.47Å
1064	Q	30.8	Very low	30.4	Very low	158 Å²	158	157 Å²	157	74%	0.738	77%	0.765	S	S	*	*	S	Bend	trans	-112.7	-29.2	159	-142.9	167.7	4.2	0	0	114	K1066	Q1064-K1066 PolarHBondContact O-N 3.2Å
1065	D	32.9	Very low	30.4	Very low	129 Å²	129	154.2 Å²	154.2	69%	0.69	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-70.5	-23.1	-174.5	-62.1	-36.9	0	0	0	115.6	F1067 Q1068	D1065-F1067 VanDerWaalsContact C-N 3.26Å; D1065-F1067 PolarHBondContact O-N 2.71Å; D1065-Q1068 PolarHBondContact O-N 3.34Å
1066	K	33.4	Very low	30.4	Very low	169 Å²	169	149.3 Å²	149.3	74%	0.735	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-74.6	-12	-165.4	-132.7	-178.2	-178	-170	0	114.5	F1063 Q1064	F1063-K1066 HydrophobicContact CE1-CD 4.47Å; Q1064-K1066 PolarHBondContact O-N 3.2Å
1067	F	28.3	Very low	30.5	Very low	197 Å²	197	148 Å²	148	86%	0.864	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-101.4	-20.3	179.4	-144.1	-98.4	0	0	0	113.9	D1065	D1065-F1067 VanDerWaalsContact C-N 3.26Å; D1065-F1067 PolarHBondContact O-N 2.71Å
1068	Q	31.1	Very low	30.3	Very low	144 Å²	144	146.6 Å²	146.6	67%	0.673	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-21.7	179.1	-76.1	-74.4	-16.5	0	0	113.5	D1065 Q1070	D1065-Q1068 PolarHBondContact O-N 3.34Å; Q1068-Q1070 PolarHBondContact O-N 3.21Å
1069	S	32.9	Very low	30.5	Very low	100 Å²	100	148.6 Å²	148.6	70%	0.699	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-73.6	-19.8	-169.1	-166.9	0	0	0	0	115.9
1070	Q	31.4	Very low	30.6	Very low	108 Å²	108	144.5 Å²	144.5	51%	0.505	76%	0.761	S	S	.	*	G	3₁₀ helix	trans	-80.3	-13.9	-174.6	-71.8	-93.7	26.4	0	0	114.5	Q1068	Q1068-Q1070 PolarHBondContact O-N 3.21Å
1071	L	30.3	Very low	30.6	Very low	146 Å²	146	143.9 Å²	143.9	76%	0.764	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-96.7	1.3	-169.2	-82.1	165.1	0	0	0	116.1
1072	W	30	Very low	30.6	Very low	196 Å²	196	144.7 Å²	144.7	74%	0.742	76%	0.757	S	S	*	*	S	Bend	trans	-116.3	29	-169.9	-89.8	75.9	0	0	0	115.9	K375	K375-W1072 VanDerWaalsContact NZ-CH2 3.32Å
1073	K	29.1	Very low	30.5	Very low	205 Å²	205	145 Å²	145	89%	0.891	76%	0.758	S	S	*	*			trans	-135.8	54	174.4	-72.7	-161.8	173.9	-174.3	0	115.6
1074	L	29.5	Very low	30.5	Very low	182 Å²	182	143.2 Å²	143.2	95%	0.953	76%	0.76	S	S	*	*	S	Bend	trans	-148.7	116.7	160.2	-101.3	170.3	0	0	0	110.7
1075	G	29.4	Very low	30.3	Very low	71 Å²	71	140.2 Å²	140.2	73%	0.732	76%	0.756	S	S	*	*			trans	122.4	110.2	167.7	0	0	0	0	0	116.3
1076	S	31.9	Very low	30.1	Very low	125 Å²	125	142.4 Å²	142.4	87%	0.874	76%	0.762	S	S	*	*			trans	-170.7	79.1	163	-83.8	0	0	0	0	114.3
1077	V	32	Very low	30.1	Very low	151 Å²	151	139.1 Å²	139.1	92%	0.915	76%	0.76	S	S	*	*			trans	-162.3	139.4	148.4	-154.6	0	0	0	0	103.9
1078	G	31.5	Very low	30.1	Very low	66 Å²	66	137.2 Å²	137.2	68%	0.68	76%	0.759	S	S	*	*			cis	103.3	125.7	23	0	0	0	0	0	109.2
1079	E	33	Very low	30.3	Very low	186 Å²	186	135 Å²	135	87%	0.869	76%	0.757	S	S	*	*			cis	-160	165.2	5.3	-101.4	-150	85.2	0	0	107.7
1080	S	30.4	Very low	30	Very low	85 Å²	85	141.4 Å²	141.4	59%	0.594	77%	0.766	S	S	*	*			cis	-176.7	177.9	-9.3	-176.9	0	0	0	0	108.7
1081	S	31	Very low	30.2	Very low	105 Å²	105	141.5 Å²	141.5	73%	0.734	78%	0.776	S	S	*	*			trans	64.2	150.3	169.8	37.9	0	0	0	0	119.5
1082	R	27.2	Very low	30.4	Very low	220 Å²	220	141.4 Å²	141.4	83%	0.83	78%	0.776	S	S	*	*			cis	-172.1	164.3	-16.2	-123.9	-179.9	-178.4	172.6	1.5	109.3
1083	I	27.1	Very low	30.4	Very low	147 Å²	147	138 Å²	138	75%	0.754	77%	0.773	S	S	*	*			trans	71.2	139.3	153	-71.6	161.7	0	0	0	117.2
1084	V	26.6	Very low	30.5	Very low	118 Å²	118	136.2 Å²	136.2	72%	0.715	77%	0.771	S	S	*	*			cis	-168.8	156.5	-26.5	81.1	0	0	0	0	109.4
1085	S	27.4	Very low	30.4	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	76%	0.758	S	S	*	*			trans	67.1	156.3	160.6	78.2	0	0	0	0	117.6
1086	E	28.3	Very low	30.5	Very low	175 Å²	175	138.3 Å²	138.3	82%	0.818	77%	0.766	S	S	*	*			cis	-162.3	161.1	-4.9	-132.6	162.8	-134.3	0	0	112.9
1087	S	32.9	Very low	30.2	Very low	99 Å²	99	141.1 Å²	141.1	69%	0.692	76%	0.762	S	S	*	*			trans	70.1	153.8	149.6	82.5	0	0	0	0	119.3
1088	N	28.5	Very low	30.5	Very low	157 Å²	157	138.6 Å²	138.6	84%	0.84	75%	0.749	S	S	*	*			cis	-161.6	176.1	-32	-112.4	-18.6	0	0	0	109.4
1089	P	35.1	Very low	30.6	Very low	98 Å²	98	141.6 Å²	141.6	64%	0.636	75%	0.75	S	S	*	*			trans	-134.4	-165.1	-144	37.2	-14.9	0	0	0	116.2
1090	R	28.3	Very low	30.5	Very low	235 Å²	235	138.8 Å²	138.8	89%	0.887	74%	0.74	S	S	*	*			trans	104.6	154.8	148.8	-79.7	177.3	-179.8	-155.5	0	120.4
1091	P	35.7	Very low	30.5	Very low	110 Å²	110	141.2 Å²	141.2	71%	0.714	75%	0.746	S	S	*	*			trans	-118.3	-179.7	-171.8	44.9	-32.9	0	0	0	114.4
1092	D	33.4	Very low	30.4	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	74%	0.743	S	S	*	*			trans	-142	125.6	160.4	-92.5	-52.3	0	0	0	108
1093	N	30.5	Very low	30.5	Very low	125 Å²	125	138 Å²	138	67%	0.668	74%	0.739	S	S	*	*				78.2	121.9	76.1	-87.3	-50.2	0	0	0	115.3
1094	I	31.7	Very low	30.6	Very low	167 Å²	167	140 Å²	140	86%	0.856	74%	0.739	S	S	*	*				-176.7	140.9	121	-92.9	155.6	0	0	0	109.9
1095	N	27.5	Very low	30.7	Very low	125 Å²	125	138.2 Å²	138.2	67%	0.668	74%	0.737	S	S	*	*			trans	-97	170	-178.1	-59.9	-78.3	0	0	0	112.1
1096	L	30.4	Very low	30.6	Very low	172 Å²	172	138.4 Å²	138.4	90%	0.901	74%	0.738	S	S	*	*				-167.9	130.5	127.1	-101.9	157.7	0	0	0	113.5
1097	F	26.6	Very low	30.6	Very low	184 Å²	184	136.8 Å²	136.8	81%	0.807	74%	0.735	S	S	*	*			trans	-104.3	-168.2	168.7	-89.8	-91	0	0	0	108.4
1098	P	37.2	Very low	30.4	Very low	99 Å²	99	142 Å²	142	64%	0.643	74%	0.74	S	S	*	*			cis	-135	-157.4	-3	25.1	2.7	0	0	0	114.3
1099	D	32.7	Very low	30.1	Very low	129 Å²	129	139 Å²	139	69%	0.69	73%	0.732	S	S	*	*			trans	104.9	136.7	150.4	-63.3	-7.4	0	0	0	118.5
1100	L	32	Very low	29.7	Very low	127 Å²	127	142.9 Å²	142.9	67%	0.665	74%	0.742	S	S	*	*			cis	-162.4	155.3	-10.9	-112.9	167.1	0	0	0	110.5
1101	N	31	Very low	29.7	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	74%	0.735	S	S	*	*			trans	62.7	129.3	163.9	-59.9	-20.1	0	0	0	118.4
1102	S	27.6	Very low	29.3	Very low	95 Å²	95	142.1 Å²	142.1	66%	0.664	74%	0.739	S	S	*	*			cis	105.3	123.2	21	72.7	0	0	0	0	114.2
1103	E	30.1	Very low	28.8	Very low	162 Å²	162	144.1 Å²	144.1	76%	0.757	74%	0.741	S	S	*	*				-179.9	163.9	118.2	-100.3	-173.7	168.2	0	0	114.1
1104	Y	29.6	Very low	29	Very low	191 Å²	191	143 Å²	143	75%	0.749	74%	0.741	S	S	*	*			trans	-2.9	127.2	178.2	-56.6	-80.1	0	0	0	120.2
1105	A	27.5	Very low	28.8	Very low	80 Å²	80	141.4 Å²	141.4	66%	0.661	73%	0.734	S	S	*	*			cis	81.8	118.4	36.5	0	0	0	0	0	116.8
1106	S	25.6	Very low	28.7	Very low	99 Å²	99	142.3 Å²	142.3	69%	0.692	73%	0.734	S	S	*	*			trans	44.9	124.1	151.3	60.6	0	0	0	0	121
1107	N	28.3	Very low	28.5	Very low	140 Å²	140	144.2 Å²	144.2	75%	0.749	73%	0.729	S	S	*	*				179.8	170.1	115.1	-94.6	-36.8	0	0	0	114.4
1108	Y	28.6	Very low	28.6	Very low	208 Å²	208	142.1 Å²	142.1	82%	0.816	73%	0.725	S	S	*	*			trans	73.3	86.9	164.4	-67.3	-66.1	0	0	0	120.2
1109	S	23.7	Very low	28.2	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	74%	0.735	S	S	*	*			trans	-55.4	169.3	131.9	52.5	0	0	0	0	113.8
1110	E	25.1	Very low	28.1	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	74%	0.735	S	S	*	*			trans	75.6	128.7	168.9	-48.9	-168.6	137.2	0	0	118
1111	V	28.2	Very low	27.8	Very low	121 Å²	121	146.9 Å²	146.9	73%	0.733	74%	0.744	S	S	*	*				161.2	122.9	114.6	160.9	0	0	0	0	111.3
1112	Y	26.9	Very low	27.9	Very low	207 Å²	207	145.5 Å²	145.5	81%	0.812	74%	0.742	S	S	*	*			trans	25.4	135	148.5	-66.8	-108.1	0	0	0	121.5
1113	K	24.3	Very low	28.1	Very low	186 Å²	186	146.7 Å²	146.7	81%	0.809	74%	0.741	S	S	*	*				54.4	145.2	65.2	-91.4	-167.2	176.3	-176.7	0	115.3
1114	P	33.4	Very low	28	Very low	101 Å²	101	147 Å²	147	66%	0.656	74%	0.741	S	S	*	*				-133	-132.1	-54.9	32.1	-8.4	0	0	0	109.4
1115	D	27.6	Very low	28	Very low	134 Å²	134	145 Å²	145	72%	0.717	74%	0.742	S	S	*	*			trans	81.3	107.4	160.6	-60.8	-11.7	0	0	0	121.4
1116	E	25.8	Very low	28.1	Very low	143 Å²	143	144.7 Å²	144.7	67%	0.668	75%	0.746	S	S	*	*				44.2	148.8	127.5	-53.4	-166.7	155.7	0	0	124.6
1117	R	26.6	Very low	28.3	Very low	212 Å²	212	144.3 Å²	144.3	80%	0.8	75%	0.749	S	S	*	*				116.4	155.5	119.8	-137.2	174.4	-81.3	-174.6	-2.8	116.1
1118	I	28	Very low	28.5	Very low	140 Å²	140	146 Å²	146	72%	0.718	75%	0.752	S	S	*	*			trans	91.7	92.9	162.6	-59	169.4	0	0	0	117.7
1119	L	28.9	Very low	28.6	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	74%	0.74	S	S	*	*			trans	70.1	146.4	137.1	-55.7	179	0	0	0	120.4
1120	S	30.4	Very low	28.8	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	75%	0.746	S	S	*	*			cis	-166	150.7	-11.5	46.5	0	0	0	0	113.2
1121	F	26	Very low	29.1	Very low	195 Å²	195	142.7 Å²	142.7	86%	0.855	74%	0.742	S	S	*	*			trans	-1.4	156.8	142.3	-80.8	-108.7	0	0	0	119.6
1122	P	34.6	Very low	29.1	Very low	105 Å²	105	147.1 Å²	147.1	68%	0.682	75%	0.752	S	S	*	*			cis	-141.4	-149.1	-6.7	39.8	-15.7	0	0	0	112.4
1123	D	30.4	Very low	29.1	Very low	121 Å²	121	142.4 Å²	142.4	65%	0.647	74%	0.74	S	S	*	*			cis	-162.2	173.6	-6.8	-134.6	-29.4	0	0	0	112.6
1124	F	29.1	Very low	29.2	Very low	169 Å²	169	143.6 Å²	143.6	74%	0.741	74%	0.74	S	S	*	*			trans	62.8	146.6	154.7	-75.4	-158.5	0	0	0	119.3
1125	L	29.8	Very low	29.1	Very low	149 Å²	149	147.7 Å²	147.7	78%	0.78	75%	0.75	S	S	*	*			cis	-147.5	135.3	-10.9	-99.9	160.5	0	0	0	105.2
1126	G	29.2	Very low	29.2	Very low	73 Å²	73	149.1 Å²	149.1	75%	0.753	76%	0.756	S	S	*	*				98.8	136.1	83.3	0	0	0	0	0	111.6
1127	A	30.2	Very low	29.2	Very low	91 Å²	91	146.3 Å²	146.3	75%	0.752	75%	0.752	S	S	*	*			cis	162.4	121.5	-17.3	0	0	0	0	0	106.2
1128	H	32.2	Very low	29.2	Very low	176 Å²	176	143 Å²	143	82%	0.815	75%	0.75	S	S	*	*			trans	-165.8	136.1	139.2	-119.1	-79.3	0	0	0	114
1129	N	30.5	Very low	29.3	Very low	105 Å²	105	142.7 Å²	142.7	56%	0.561	76%	0.755	S	S	*	*			trans	-14.5	143.3	170.9	-52.9	5.8	0	0	0	118.1	Q1131	N1129-Q1131 HydrophobicContact CB-CB 4.19Å
1130	D	26.9	Very low	29.2	Very low	150 Å²	150	139.6 Å²	139.6	80%	0.802	75%	0.747	S	S	*	*			cis	57.9	64.6	7.9	-156.8	22.9	0	0	0	116.5
1131	Q	31.6	Very low	29	Very low	158 Å²	158	143.7 Å²	143.7	74%	0.738	76%	0.755	S	S	*	*			trans	-155.9	62.7	165.1	-155.5	177	-3	0	0	115.6	N1129	N1129-Q1131 HydrophobicContact CB-CB 4.19Å
1132	F	29	Very low	29.1	Very low	214 Å²	214	142.7 Å²	142.7	94%	0.939	76%	0.757	S	S	*	*			trans	-137.2	103	150.5	-151.4	-94.3	0	0	0	111
1133	N	26.6	Very low	28.8	Very low	107 Å²	107	141 Å²	141	57%	0.572	76%	0.759	S	S	*	*			trans	-145.3	133.6	-160.2	-152.3	-41.9	0	0	0	109.2
1134	R	27.1	Very low	28.6	Very low	212 Å²	212	139.9 Å²	139.9	80%	0.8	77%	0.766	S	S	*	*			trans	79.8	163.1	164.9	-44.7	176.9	-173.3	-174.5	-1.6	118.2
1135	Q	30	Very low	28.5	Very low	186 Å²	186	139.5 Å²	139.5	87%	0.869	77%	0.771	S	S	*	*			trans	73.4	133.8	-179.6	-49.4	-173.6	-6.9	0	0	112.5
1136	I	31	Very low	28.3	Very low	164 Å²	164	139.9 Å²	139.9	84%	0.841	77%	0.769	S	S	*	*			cis	-129.7	158.2	12.7	-71	177.3	0	0	0	110.7
1137	S	25.1	Very low	28.2	Very low	85 Å²	85	144 Å²	144	59%	0.594	77%	0.772	S	S	*	*			trans	-104.5	171.6	174.1	56.1	0	0	0	0	113.4
1138	D	26.1	Very low	27.9	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	77%	0.769	S	S	*	*			trans	78.5	165.3	160.2	-51.9	-59.9	0	0	0	119.4
1139	V	31.2	Very low	27.6	Very low	134 Å²	134	145 Å²	145	81%	0.812	77%	0.769	S	S	*	*			trans	65.6	95.7	-177.1	-165	0	0	0	0	114.5
1140	S	25.5	Very low	27.6	Very low	97 Å²	97	144.9 Å²	144.9	68%	0.678	77%	0.774	S	S	*	*			cis	88.9	99.1	30.8	94.4	0	0	0	0	116.8
1141	Q	26.3	Very low	27.6	Very low	184 Å²	184	143.4 Å²	143.4	86%	0.86	77%	0.77	S	S	*	*			trans	66.5	165.6	152.1	-58.2	-171.8	-4.2	0	0	119.9
1142	I	29.2	Very low	27.3	Very low	174 Å²	174	143.1 Å²	143.1	89%	0.892	77%	0.774	S	S	*	*			trans	73.3	130.2	175.1	-46.6	167.2	0	0	0	113.2
1143	G	28.2	Very low	27.4	Very low	71 Å²	71	137 Å²	137	73%	0.732	76%	0.758	S	S	*	*			cis	-164.9	167.2	-0.7	0	0	0	0	0	112.9
1144	A	26.1	Very low	27.5	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	76%	0.761	S	S	*	*			trans	-90.7	177	-174.2	0	0	0	0	0	114.1
1145	L	27.2	Very low	27.6	Very low	161 Å²	161	133 Å²	133	84%	0.843	76%	0.76	S	S	*	*			trans	115	116.4	171.8	-81.6	81.3	0	0	0	111.7
1146	Q	25.5	Very low	27.5	Very low	158 Å²	158	129.8 Å²	129.8	74%	0.738	75%	0.752	S	S	*	*			cis	87.3	100.5	36.1	-171	174.9	-5.5	0	0	114.5
1147	L	27.3	Very low	27.3	Very low	158 Å²	158	129.6 Å²	129.6	83%	0.827	75%	0.752	S	S	*	*			trans	-166.5	120	147.4	-91.1	147.5	0	0	0	104.5
1148	L	24.2	Very low	27.5	Very low	129 Å²	129	128.8 Å²	128.8	68%	0.675	75%	0.751	S	S	*	*				63.6	94.1	60.4	-68.6	169.2	0	0	0	114.3
1149	I	26.3	Very low	27.5	Very low	160 Å²	160	129.2 Å²	129.2	82%	0.821	75%	0.752	S	S	*	*				172.7	153	112.5	-89.1	156.7	0	0	0	110.6
1150	P	30.3	Very low	27.3	Very low	103 Å²	103	129.4 Å²	129.4	67%	0.669	75%	0.749	S	S	*	*			trans	-122.4	-171.2	-168.8	29.1	-6.4	0	0	0	114.8
1151	T	25.9	Very low	27.6	Very low	118 Å²	118	131.1 Å²	131.1	72%	0.724	76%	0.755	S	S	*	*			trans	103.6	131.6	150.8	70	0	0	0	0	121.1
1152	N	25.7	Very low	28	Very low	152 Å²	152	127.5 Å²	127.5	81%	0.813	75%	0.747	S	S	*	*			trans	81.6	124.8	141.6	-68	8.4	0	0	0	122.2
1153	S	30.7	Very low	27.8	Very low	87 Å²	87	124.5 Å²	124.5	61%	0.608	74%	0.74	S	S	*	*			trans	-63.6	171.4	153.1	56.7	0	0	0	0	112.5
1154	S	29.6	Very low	27.9	Very low	89 Å²	89	125.5 Å²	125.5	62%	0.622	74%	0.736	S	S	*	*				165	151.7	104.5	-88.9	0	0	0	0	114
1155	D	28	Very low	28	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	74%	0.735	S	S	*	*			trans	69.2	151.8	148.6	-62.8	-13.8	0	0	0	121.1
1156	V	28	Very low	28.1	Very low	117 Å²	117	128.2 Å²	128.2	71%	0.709	73%	0.726	S	S	*	*			cis	-173.1	164	-35.9	103.7	0	0	0	0	108
1157	L	27.3	Very low	28.3	Very low	160 Å²	160	129 Å²	129	84%	0.838	73%	0.727	S	S	*	*			trans	129.4	146.3	155.1	-70.5	165.9	0	0	0	112.9
1158	A	28.4	Very low	28.4	Very low	69 Å²	69	126 Å²	126	57%	0.57	73%	0.725	S	S	*	*			cis	-179.3	178.8	-30.2	0	0	0	0	0	109.4
1159	L	26.4	Very low	28.5	Very low	150 Å²	150	124.3 Å²	124.3	79%	0.785	72%	0.724	S	S	*	*			trans	80	134.4	165.7	-46.1	169.3	0	0	0	114.6
1160	D	26.7	Very low	28.5	Very low	139 Å²	139	123.4 Å²	123.4	74%	0.743	72%	0.719	S	S	*	*			cis	-158.1	175.5	-3.7	-122.3	-18	0	0	0	114.8
1161	V	33	Very low	28.4	Very low	133 Å²	133	127 Å²	127	81%	0.806	73%	0.725	S	S	*	*			trans	-152.6	-160.3	-179.5	-118.6	0	0	0	0	109.2
1162	P	33.9	Very low	28.7	Very low	108 Å²	108	129.1 Å²	129.1	70%	0.701	73%	0.726	S	S	*	*			cis	-141.4	176.4	2.1	45.6	-27	0	0	0	118.4
1163	C	24.4	Very low	28.7	Very low	111 Å²	111	131.6 Å²	131.6	75%	0.75	72%	0.724	S	S	*	*			trans	63	115.3	134.4	-81.2	0	0	0	0	126.3
1164	S	31.7	Very low	28.5	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	73%	0.725	S	S	*	*				57	167.3	109.6	71.3	0	0	0	0	125.8
1165	F	27.9	Very low	28.4	Very low	173 Å²	173	136.9 Å²	136.9	76%	0.759	73%	0.732	S	S	*	*			trans	113.3	152.9	161.2	-78	-95.6	0	0	0	117.4
1166	E	30	Very low	28.4	Very low	140 Å²	140	135.3 Å²	135.3	65%	0.654	73%	0.733	S	S	*	*			cis	179.3	174	-35.6	-159	-166.3	-137.2	0	0	111.6
1167	K	29.5	Very low	28.4	Very low	175 Å²	175	132.7 Å²	132.7	76%	0.761	73%	0.73	S	S	*	*			trans	96.2	126.1	160.2	-64.8	165.3	-174.4	169.2	0	117.2
1168	A	28.7	Very low	28.4	Very low	96 Å²	96	130.6 Å²	130.6	79%	0.793	73%	0.728	S	S	*	*				92.3	150.1	52.6	0	0	0	0	0	112.5
1169	S	27	Very low	28.4	Very low	93 Å²	93	135.7 Å²	135.7	65%	0.65	74%	0.74	S	S	*	*			cis	-170.6	135.8	35.4	-170.5	0	0	0	0	115.9
1170	I	25.7	Very low	28.5	Very low	140 Å²	140	133 Å²	133	72%	0.718	73%	0.734	S	S	*	*			trans	52.2	154.5	133.4	-48.9	171.1	0	0	0	123
1171	F	27.9	Very low	28.6	Very low	180 Å²	180	131.6 Å²	131.6	79%	0.789	74%	0.735	S	S	*	*			trans	99.9	133.8	165.1	-69.9	-88.3	0	0	0	117
1172	H	32.1	Very low	28.5	Very low	162 Å²	162	132.3 Å²	132.3	75%	0.75	73%	0.734	S	S	*	*			cis	-154.6	-178.5	-14.7	-154.3	-107	0	0	0	112.4
1173	R	26.3	Very low	28.3	Very low	203 Å²	203	131.7 Å²	131.7	77%	0.766	73%	0.733	S	S	*	*			trans	-107.4	150.1	-172	-177.3	-159.9	-72.2	-176.7	-4.9	113
1174	L	26.4	Very low	28.4	Very low	120 Å²	120	132 Å²	132	63%	0.628	73%	0.731	S	S	*	*				156.8	139.6	127	-80	166.6	0	0	0	114.8
1175	E	27.7	Very low	28.2	Very low	168 Å²	168	135.3 Å²	135.3	79%	0.785	74%	0.741	S	S	*	*			trans	44.8	153.3	140.5	-68.3	162.1	-170.3	0	0	122.5
1176	S	28.4	Very low	28.3	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	74%	0.744	S	S	*	*			cis	-173	162	-17.9	58.2	0	0	0	0	110.1
1177	G	27.4	Very low	28.3	Very low	63 Å²	63	132.2 Å²	132.2	65%	0.649	75%	0.751	S	S	*	*			trans	90.8	136.4	176.1	0	0	0	0	0	114.3
1178	S	28	Very low	28.2	Very low	115 Å²	115	132 Å²	132	80%	0.804	76%	0.757	S	S	*	*				64.7	125.2	64.2	72.8	0	0	0	0	112.7
1179	E	27.7	Very low	28.2	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.822	75%	0.75	S	S	*	*			cis	-159.3	162.4	15.3	-145.7	162.2	-141.2	0	0	112.7
1180	S	28.4	Very low	28.3	Very low	95 Å²	95	131.9 Å²	131.9	66%	0.664	76%	0.755	S	S	*	*			trans	19.3	138.6	161.1	61.5	0	0	0	0	124.3
1181	S	28.7	Very low	28.2	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	76%	0.756	S	S	*	*			trans	91.1	123.9	137.8	71.4	0	0	0	0	122.6
1182	D	30.9	Very low	28.5	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	76%	0.757	S	S	*	*			trans	52.9	96	140.9	-71.2	-18.5	0	0	0	123.8
1183	S	29.6	Very low	28.4	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	76%	0.757	S	S	*	*				100.5	144.3	103	79.4	0	0	0	0	121.5
1184	T	26.7	Very low	28.5	Very low	117 Å²	117	126.9 Å²	126.9	72%	0.718	75%	0.753	S	S	*	*			trans	65	107.5	158.1	47.2	0	0	0	0	121.6
1185	L	28.3	Very low	28.7	Very low	162 Å²	162	129.2 Å²	129.2	85%	0.848	76%	0.763	S	S	*	*				50.7	110.9	123.6	-70.6	164.6	0	0	0	120.3
1186	A	29.1	Very low	28.7	Very low	100 Å²	100	130.5 Å²	130.5	83%	0.826	76%	0.761	S	S	*	*				-159.5	145.2	123.9	0	0	0	0	0	112.2
1187	N	29.3	Very low	28.8	Very low	148 Å²	148	131 Å²	131	79%	0.791	75%	0.754	S	S	*	*			trans	-78.4	156.1	171.3	-49.4	-68.2	0	0	0	111.2
1188	L	27.9	Very low	28.8	Very low	171 Å²	171	132.5 Å²	132.5	90%	0.895	76%	0.755	S	S	*	*				179.3	152.9	120	-98.7	161.5	0	0	0	114.3
1189	A	28.3	Very low	28.7	Very low	77 Å²	77	134 Å²	134	64%	0.636	75%	0.754	S	S	*	*			trans	33.3	120.1	160.2	0	0	0	0	0	119.8
1190	S	28.9	Very low	28.6	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	75%	0.75	S	S	*	*			cis	72.5	161.9	42.4	94.6	0	0	0	0	115.8
1191	Y	25	Very low	28.4	Very low	189 Å²	189	132.1 Å²	132.1	74%	0.741	76%	0.755	S	S	*	*			trans	81.7	83.9	165.7	-121.6	-106.7	0	0	0	118.7
1192	F	34.6	Very low	28.3	Very low	187 Å²	187	133 Å²	133	82%	0.82	76%	0.756	S	S	*	*				-176.6	121.4	106.5	-99.7	-61	0	0	0	116.1
1193	S	28.3	Very low	28	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	75%	0.752	S	S	*	*			trans	-46.4	147.2	173.1	-46.1	0	0	0	0	121.2
1194	S	29.6	Very low	27.9	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	76%	0.763	S	S	*	*				66	122	121.1	-168.2	0	0	0	0	122.4
1195	M	31.2	Very low	27.8	Very low	168 Å²	168	136.9 Å²	136.9	83%	0.828	77%	0.766	S	S	*	*				162.1	153.3	120.8	-91	-168.6	-67.6	0	0	110.4
1196	R	27.3	Very low	27.7	Very low	195 Å²	195	139.1 Å²	139.1	74%	0.736	77%	0.769	S	S	*	*			cis	-176.4	158.3	-26.9	-125	-174	148.7	152.8	2.6	107
1197	D	29	Very low	27.6	Very low	122 Å²	122	138 Å²	138	65%	0.652	76%	0.76	S	S	*	*			trans	40.5	137.2	141.9	-50.3	-12.6	0	0	0	120.1
1198	S	27.9	Very low	27.4	Very low	95 Å²	95	137 Å²	137	66%	0.664	76%	0.76	S	S	*	*			cis	176.1	167.8	8.3	48.5	0	0	0	0	112.4
1199	N	26	Very low	27.2	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	75%	0.753	S	S	*	*			trans	72.3	154.7	142.6	-69.7	-9.1	0	0	0	124.9
1200	S	26.3	Very low	27.1	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	76%	0.762	S	S	*	*			trans	67.2	113.8	166.4	50.6	0	0	0	0	117.7
1201	T	24.4	Very low	27.1	Very low	128 Å²	128	139.6 Å²	139.6	79%	0.785	76%	0.758	S	S	*	*			cis	94.4	146.8	41.4	61.6	0	0	0	0	114.4
1202	V	26	Very low	27.2	Very low	126 Å²	126	138.4 Å²	138.4	76%	0.764	76%	0.759	S	S	*	*			trans	71.9	98	174.6	-170.9	0	0	0	0	112.9
1203	S	24.5	Very low	27	Very low	101 Å²	101	135 Å²	135	71%	0.706	75%	0.75	S	S	*	*				66.5	108.9	62.1	82.8	0	0	0	0	115.7
1204	E	27	Very low	27	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	75%	0.747	S	S	*	*				177.5	156.6	128	-100.5	-168.6	171.2	0	0	113.2
1205	N	25.8	Very low	26.9	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	75%	0.749	S	S	*	*			trans	-89.3	146.5	-170.5	-59.7	-59.8	0	0	0	114.1
1206	K	26.4	Very low	26.8	Very low	209 Å²	209	134.7 Å²	134.7	91%	0.909	75%	0.747	S	S	*	*			trans	143.9	150.3	141	-79.5	152.6	-170.4	164.8	0	111.1
1207	A	25.9	Very low	26.9	Very low	78 Å²	78	132.9 Å²	132.9	65%	0.645	75%	0.746	S	S	*	*			cis	163	162.8	-22	0	0	0	0	0	106.7
1208	T	26.3	Very low	26.9	Very low	127 Å²	127	133.2 Å²	133.2	78%	0.779	75%	0.748	S	S	*	*			trans	68.6	115	164.7	58.2	0	0	0	0	121.6
1209	C	23.6	Very low	27	Very low	110 Å²	110	135.5 Å²	135.5	74%	0.743	75%	0.749	S	S	*	*			trans	58.1	136.9	130.5	-55.6	0	0	0	0	120.7
1210	F	26.1	Very low	27.2	Very low	189 Å²	189	136 Å²	136	83%	0.829	75%	0.746	S	S	*	*				-160.8	149.8	71.7	-104.7	-91.9	0	0	0	114.2
1211	T	27.6	Very low	27.3	Very low	111 Å²	111	136 Å²	136	68%	0.681	73%	0.733	S	S	*	*			trans	0.3	143.2	151.5	61.8	0	0	0	0	119.8
1212	E	28.2	Very low	27.5	Very low	164 Å²	164	138.9 Å²	138.9	77%	0.766	73%	0.731	S	S	*	*				-177.9	168.7	68	-112.2	-142.2	170.6	0	0	109.4
1213	N	28.9	Very low	27.5	Very low	115 Å²	115	139.5 Å²	139.5	62%	0.615	73%	0.729	S	S	*	*			cis	-160.8	-177.2	-4	-156.8	-25.8	0	0	0	109
1214	S	28	Very low	27.6	Very low	98 Å²	98	137.8 Å²	137.8	69%	0.685	73%	0.728	S	S	*	*			trans	39.3	136.8	148.1	65.9	0	0	0	0	120.5
1215	A	29.1	Very low	27.6	Very low	88 Å²	88	134.5 Å²	134.5	73%	0.727	72%	0.715	S	S	*	*			cis	163.9	163.6	14.3	0	0	0	0	0	104.9
1216	K	28.3	Very low	27.5	Very low	181 Å²	181	130.7 Å²	130.7	79%	0.787	70%	0.699	S	S	*	*			cis	-164.3	158.4	8.7	-130.6	176.8	-174.8	176.9	0	110.8
1217	Q	30.1	Very low	28.1	Very low	156 Å²	156	124.2 Å²	124.2	73%	0.729	68%	0.678	S	S	*	*			trans	82.7	126	148.4	-76.1	179.6	-73	0	0	123.2
1218	N	29.2	Very low	28.3	Very low	129 Å²	129	129.4 Å²	129.4	69%	0.69	68%	0.681	S	S	*	*			trans	72.5	92	148.3	-56.6	14.1	0	0	0	116
1219	E	29.2	Very low	28.6	Very low	144 Å²	144	130.5 Å²	130.5	67%	0.673	68%	0.682	S	S	*	*			cis	64.3	132.3	43.2	-118.7	-179.5	175.2	0	0	111.6	K1221	E1219-K1221 VanDerWaalsContact OE1-CE 3.27Å; E1219-K1221 WeakPolarHBondContact OE1-CE 3.38Å; E1219-K1221 IonicContact OE1-NZ 3.19Å; E1219-K1221 PolarHBondContact OE1-NZ 2.69Å
1220	E	30.8	Very low	28.9	Very low	158 Å²	158	129.7 Å²	129.7	74%	0.738	68%	0.684	S	S	*	*			cis	-138.7	162.8	33.5	-69	-146.3	95.2	0	0	114.1
1221	K	27.5	Very low	29	Very low	102 Å²	102	129.3 Å²	129.3	44%	0.443	68%	0.684	S	S	.	*				144.5	34.7	75.6	-14.8	-158.7	-165.9	83.7	0	118.2	E1219	E1219-K1221 VanDerWaalsContact OE1-CE 3.27Å; E1219-K1221 WeakPolarHBondContact OE1-CE 3.38Å; E1219-K1221 IonicContact OE1-NZ 3.19Å; E1219-K1221 PolarHBondContact OE1-NZ 2.69Å
1222	Y	28.4	Very low	29.3	Very low	189 Å²	189	131.9 Å²	131.9	74%	0.741	69%	0.694	S	S	*	*			trans	67.4	175.9	139	-77.3	-154.8	0	0	0	121.2
1223	L	27	Very low	29.2	Very low	139 Å²	139	130.6 Å²	130.6	73%	0.728	69%	0.692	S	S	*	*			cis	174.7	162.1	-47.8	-130.9	131.6	0	0	0	108.9	I1225	L1223-I1225 HydrophobicContact CD2-CD1 4.37Å
1224	G	26.5	Very low	29.2	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	71%	0.708	S	S	*	*			trans	134.4	64.7	152.1	0	0	0	0	0	122.7
1225	I	26	Very low	29	Very low	123 Å²	123	138.9 Å²	138.9	63%	0.631	71%	0.707	S	S	*	*				23.5	113.6	119.6	-59.1	172.8	0	0	0	119.2	P199 L1223	P199-I1225 HydrophobicContact CG-CG2 4.35Å; L1223-I1225 HydrophobicContact CD2-CD1 4.37Å
1226	C	24.7	Very low	28.8	Very low	68 Å²	68	141.8 Å²	141.8	46%	0.459	71%	0.71	S	S	.	*				39.5	170.6	108.7	-74	0	0	0	0	122.7	P199	P199-C1226 HydrophobicContact CG-CB 4.42Å
1227	P	38.1	Very low	28.7	Very low	73 Å²	73	138.3 Å²	138.3	47%	0.474	71%	0.708	S	S	.	*			cis	-155.8	-164.1	-47.7	47.7	-29.1	0	0	0	117	F200	F200-P1227 HydrophobicContact CD1-CB 4.46Å; F200-P1227 HydrophobicContact CD1-CG 3.91Å; F200-P1227 HydrophobicContact CD2-CB 3.58Å; F200-P1227 HydrophobicContact CD2-CG 3.43Å; F200-P1227 VanDerWaalsContact CD2-CG 3.43Å; F200-P1227 HydrophobicContact CE1-CB 4.07Å; F200-P1227 HydrophobicContact CE1-CG 3.94Å; F200-P1227 HydrophobicContact CE2-CB 3.14Å; F200-P1227 HydrophobicContact CE2-CG 3.53Å; F200-P1227 HydrophobicContact CG-CB 4.3Å; F200-P1227 HydrophobicContact CG-CG 3.71Å; F200-P1227 HydrophobicContact CZ-CB 3.43Å; F200-P1227 VanDerWaalsContact CZ-CB 3.43Å; F200-P1227 HydrophobicContact CZ-CG 3.8Å
1228	R	30.8	Very low	28.4	Very low	187 Å²	187	137.8 Å²	137.8	71%	0.706	71%	0.709	S	S	*	*			trans	126.8	133.8	137.4	-176	168.5	-74	-151.6	1.9	116.5	F200	F200-R1228 HydrophobicContact CD1-CB 4.28Å; F200-R1228 HydrophobicContact CD1-CG 4.39Å; F200-R1228 HydrophobicContact CE1-CB 3.61Å; F200-R1228 HydrophobicContact CE1-CG 3.79Å; F200-R1228 HydrophobicContact CZ-CB 4.24Å
1229	D	32.8	Very low	28.2	Very low	150 Å²	150	138.1 Å²	138.1	80%	0.802	72%	0.716	S	S	*	*			trans	166	156.4	145.8	-87.8	-6	0	0	0	109.4
1230	A	30.2	Very low	28	Very low	93 Å²	93	139.1 Å²	139.1	77%	0.769	73%	0.726	S	S	*	*			cis	-142.1	-111.4	-10.4	0	0	0	0	0	111.7
1231	E	28.3	Very low	27.8	Very low	181 Å²	181	136.6 Å²	136.6	85%	0.846	73%	0.732	S	S	*	*			trans	-138.2	153.7	-164.3	-61.3	173.2	141.5	0	0	113.5
1232	D	33.6	Very low	27.7	Very low	166 Å²	166	135.8 Å²	135.8	89%	0.888	75%	0.745	S	S	*	*			trans	-162.5	153.4	131.5	-130.9	-26.4	0	0	0	110.8
1233	L	26.1	Very low	27.7	Very low	136 Å²	136	134.3 Å²	134.3	71%	0.712	75%	0.749	S	S	*	*			trans	-109.6	151.3	-170.4	-70	118.9	0	0	0	114
1234	Y	29	Very low	27.9	Very low	243 Å²	243	134.8 Å²	134.8	95%	0.953	75%	0.753	S	S	*	*			trans	-151.8	155.9	133.2	-114.8	-76.4	0	0	0	110.9
1235	E	24.3	Very low	27.7	Very low	145 Å²	145	137.5 Å²	137.5	68%	0.678	76%	0.76	S	S	*	*			trans	-136.1	156.9	-154.7	-146.4	-167.1	159.8	0	0	111.9
1236	L	24.2	Very low	27.7	Very low	148 Å²	148	137.9 Å²	137.9	78%	0.775	77%	0.768	S	S	*	*			trans	66.1	158.3	165.2	-64.4	153.2	0	0	0	116.2
1237	S	26.3	Very low	27.7	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	78%	0.782	S	S	*	*			cis	-144.2	150.3	-0	54.9	0	0	0	0	114
1238	I	24.1	Very low	27	Very low	145 Å²	145	146.1 Å²	146.1	74%	0.744	80%	0.801	S	S	*	*			trans	-54.7	143.5	167.7	-52	154.9	0	0	0	113.2
1239	T	24.9	Very low	26.7	Very low	137 Å²	137	143.7 Å²	143.7	84%	0.84	81%	0.807	S	S	*	*				178.6	158.2	123.5	27.3	0	0	0	0	114
1240	N	24.7	Very low	26.3	Very low	164 Å²	164	141.6 Å²	141.6	88%	0.877	80%	0.804	S	S	*	*			trans	-81.7	150.8	-178.7	-50.3	-31.5	0	0	0	112.4
1241	A	27	Very low	26.3	Very low	105 Å²	105	146.7 Å²	146.7	87%	0.868	81%	0.812	S	S	*	*			trans	-153.8	150.7	148.4	0	0	0	0	0	109.8
1242	A	25.9	Very low	26.4	Very low	86 Å²	86	146.8 Å²	146.8	71%	0.711	81%	0.812	S	S	*	*			trans	-102.9	177.1	171.5	0	0	0	0	0	110.5
1243	D	27.4	Very low	26.4	Very low	157 Å²	157	147.8 Å²	147.8	84%	0.84	81%	0.812	S	S	*	*			trans	17	112.1	154.8	-51.6	-27.6	0	0	0	118.4
1244	D	30.8	Very low	26.3	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	81%	0.812	S	S	*	*			trans	-153	154	132.2	-141.7	-24.2	0	0	0	112.7
1245	C	22	Very low	26.3	Very low	123 Å²	123	140.3 Å²	140.3	83%	0.831	81%	0.806	S	S	*	*			trans	-106.9	115.2	169.9	-80.5	0	0	0	0	109.4
1246	T	26.5	Very low	26.5	Very low	130 Å²	130	140 Å²	140	80%	0.798	81%	0.809	S	S	*	*			trans	-144.7	136.5	166.6	-17.5	0	0	0	0	113.4
1247	I	24.2	Very low	26.8	Very low	147 Å²	147	140.2 Å²	140.2	75%	0.754	81%	0.809	S	S	*	*			trans	-84.9	128.8	175.7	-59.7	159.5	0	0	0	108.5
1248	L	24.8	Very low	26.8	Very low	168 Å²	168	140.4 Å²	140.4	88%	0.88	81%	0.806	S	S	*	*			trans	-139	129.9	148.9	-78.6	-177.2	0	0	0	110.1
1249	V	23.5	Very low	27	Very low	136 Å²	136	144.6 Å²	144.6	82%	0.824	81%	0.814	S	S	*	*			trans	-109	124.4	169.8	172.9	0	0	0	0	107.1
1250	S	24.4	Very low	27.3	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	80%	0.803	S	S	*	*			trans	-158.8	110.8	168.3	58.8	0	0	0	0	111.8
1251	E	30.3	Very low	27.6	Very low	201 Å²	201	140.7 Å²	140.7	94%	0.939	80%	0.802	S	S	*	*			trans	-148.9	118.7	137.7	-119.8	171.7	-163.8	0	0	107.5
1252	E	30.1	Very low	27.7	Very low	183 Å²	183	139.7 Å²	139.7	86%	0.855	79%	0.789	S	S	*	*			trans	-90.4	172.3	178.7	-64.3	-176.3	111.4	0	0	110.9
1253	Q	33.6	Very low	27.9	Very low	187 Å²	187	143.5 Å²	143.5	87%	0.874	79%	0.794	S	S	*	*			trans	79.2	85.4	-177.4	-49.1	173.9	33.1	0	0	112.4
1254	A	25.1	Very low	28	Very low	88 Å²	88	144.6 Å²	144.6	73%	0.727	79%	0.794	S	S	*	*			cis	61.4	98.5	35.9	0	0	0	0	0	114.5
1255	T	28.8	Very low	27.7	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	79%	0.794	S	S	*	*				-173	149.3	109.3	23.4	0	0	0	0	114
1256	D	28.1	Very low	28	Very low	138 Å²	138	145.7 Å²	145.7	74%	0.738	79%	0.789	S	S	*	*			trans	83.8	123.5	141.2	-80.1	12.7	0	0	0	126.5
1257	I	29.5	Very low	28	Very low	153 Å²	153	144.4 Å²	144.4	79%	0.785	78%	0.781	S	S	*	*			trans	89.6	95.2	140.6	-60.8	162.9	0	0	0	119.1
1258	T	26.8	Very low	28.1	Very low	111 Å²	111	144.1 Å²	144.1	68%	0.681	78%	0.776	S	S	*	*			trans	-75.6	179.7	174.1	43.7	0	0	0	0	116.2
1259	Y	29.5	Very low	28.2	Very low	233 Å²	233	143.9 Å²	143.9	91%	0.914	77%	0.768	S	S	*	*			trans	81	137.2	165.8	-68.2	-80.6	0	0	0	118
1260	G	30.2	Very low	28.3	Very low	59 Å²	59	142.9 Å²	142.9	61%	0.608	76%	0.762	S	S	*	*			cis	179.1	-174.3	-2.9	0	0	0	0	0	115.1
1261	D	32.1	Very low	28.2	Very low	160 Å²	160	143.4 Å²	143.4	86%	0.856	77%	0.765	S	S	*	*			trans	67.9	143	168.8	-72.2	-43.6	0	0	0	120.1
1262	S	28.1	Very low	28	Very low	84 Å²	84	141 Å²	141	59%	0.587	76%	0.758	S	S	*	*			cis	-168.3	154.7	-21.3	-118.7	0	0	0	0	111.7
1263	M	29.7	Very low	27.9	Very low	166 Å²	166	139.4 Å²	139.4	82%	0.818	76%	0.755	S	S	*	*			trans	66.6	145.3	164.1	-61	168.2	-177	0	0	117.9
1264	E	30.6	Very low	27.6	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	75%	0.752	S	S	*	*			cis	-150.5	171.1	-2.9	-125.5	173.3	-179.9	0	0	111.9
1265	K	24.4	Very low	27.6	Very low	184 Å²	184	137.6 Å²	137.6	80%	0.8	75%	0.746	S	S	*	*			trans	-98	161.5	-168.9	-61.6	-176.9	178	177.3	0	114.5
1266	P	28	Very low	27.5	Very low	112 Å²	112	139.4 Å²	139.4	73%	0.727	75%	0.745	S	S	*	*				-130.4	146	87	40.5	-31.7	0	0	0	112.1
1267	T	26	Very low	27.4	Very low	104 Å²	104	141 Å²	141	64%	0.638	75%	0.75	S	S	*	*				50.4	130	66.9	60.1	0	0	0	0	113.7
1268	E	27	Very low	27.2	Very low	140 Å²	140	138.3 Å²	138.3	65%	0.654	75%	0.751	S	S	*	*			cis	-159.9	171.6	12.8	-129	-179.6	145.3	0	0	111.2
1269	K	25.9	Very low	27.2	Very low	164 Å²	164	139 Å²	139	71%	0.713	76%	0.755	S	S	*	*			trans	23	146.1	141.3	-71.8	171.5	-169.6	156.3	0	120.6
1270	T	25.3	Very low	27.2	Very low	114 Å²	114	135 Å²	135	70%	0.699	75%	0.749	S	S	*	*			cis	-167.7	159.1	24.5	-4.3	0	0	0	0	112.9
1271	C	23.4	Very low	27.1	Very low	117 Å²	117	140 Å²	140	79%	0.791	76%	0.755	S	S	*	*			trans	58.4	132.4	145	-69	0	0	0	0	122.9
1272	L	26.5	Very low	26.9	Very low	150 Å²	150	141.1 Å²	141.1	79%	0.785	75%	0.752	S	S	*	*			trans	-61.3	157.6	145.1	-66.4	69.6	0	0	0	109.6
1273	D	27.7	Very low	27	Very low	150 Å²	150	139.8 Å²	139.8	80%	0.802	75%	0.751	S	S	*	*			trans	-137	127.9	152.3	-148.3	-15.2	0	0	0	110.7
1274	N	26.8	Very low	26.9	Very low	149 Å²	149	138.2 Å²	138.2	80%	0.797	75%	0.751	S	S	*	*			trans	-108.6	105.2	-175.8	-97.2	-20.2	0	0	0	108.6
1275	S	26.1	Very low	27	Very low	87 Å²	87	135.1 Å²	135.1	61%	0.608	75%	0.749	S	S	*	*			trans	-156.2	141.6	177.8	59.4	0	0	0	0	114.4
1276	Q	26.4	Very low	27.2	Very low	173 Å²	173	131.4 Å²	131.4	81%	0.808	75%	0.746	S	S	*	*	S	Bend	trans	59.1	84	172.3	-86	67.9	54.4	0	0	118.3
1277	M	26.4	Very low	27.5	Very low	171 Å²	171	130.8 Å²	130.8	84%	0.842	75%	0.751	S	S	*	*				-166.5	80.6	105	-99.3	-174.4	-179.6	0	0	110
1278	A	24.7	Very low	27.6	Very low	96 Å²	96	129.9 Å²	129.9	79%	0.793	75%	0.754	S	S	*	*			trans	-148.8	65.7	-176.6	0	0	0	0	0	113.2
1279	T	25.6	Very low	27.9	Very low	127 Å²	127	132.5 Å²	132.5	78%	0.779	77%	0.768	S	S	*	*			trans	-146.3	128.2	158.1	45.8	0	0	0	0	104.4
1280	D	30	Very low	28	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	77%	0.771	S	S	*	*			cis	-112.1	148.2	43.4	-57.2	-51	0	0	0	117.3
1281	F	28.3	Very low	28.3	Very low	165 Å²	165	134.6 Å²	134.6	72%	0.724	78%	0.782	S	S	*	*			trans	-101.2	162.9	154.6	-99.3	-115.2	0	0	0	107.3
1282	F	29	Very low	28.6	Very low	184 Å²	184	135.3 Å²	135.3	81%	0.807	78%	0.778	S	S	*	*			cis	-150.2	161.8	37.7	-77.6	-96.7	0	0	0	110.9	V1284	F1282-V1284 HydrophobicContact CD1-CG2 4.42Å
1283	G	28.8	Very low	28.9	Very low	55 Å²	55	136.7 Å²	136.7	57%	0.567	79%	0.785	S	S	*	*			cis	143.1	-174.1	-4.2	0	0	0	0	0	113.2
1284	V	28.4	Very low	29.1	Very low	134 Å²	134	133.1 Å²	133.1	81%	0.812	78%	0.784	S	S	*	*			trans	67.2	135	167	-142.4	0	0	0	0	114.6	F1282	F1282-V1284 HydrophobicContact CD1-CG2 4.42Å
1285	S	32.3	Very low	29.2	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	78%	0.784	S	S	*	*			cis	-140.7	175.1	26.5	-158.4	0	0	0	0	115
1286	S	29.9	Very low	29.7	Very low	105 Å²	105	131 Å²	131	73%	0.734	79%	0.79	S	S	*	*			trans	-133.1	155	-165.1	55.4	0	0	0	0	114.6
1287	A	32.7	Very low	29.8	Very low	100 Å²	100	127.8 Å²	127.8	83%	0.826	79%	0.787	S	S	*	*			trans	-156.8	118.4	147.2	0	0	0	0	0	107.1
1288	A	29.4	Very low	30	Very low	85 Å²	85	126.3 Å²	126.3	70%	0.702	79%	0.788	S	S	*	*			cis	91.3	104	27.8	0	0	0	0	0	114.9
1289	M	32.9	Very low	30.2	Very low	194 Å²	194	125.9 Å²	125.9	96%	0.956	78%	0.784	S	S	*	*			trans	-135	141.5	144.8	-80.6	-157.7	171.8	0	0	109.1
1290	N	28.4	Very low	30.4	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	79%	0.788	S	S	*	*			trans	-95.3	159.6	-172.2	-59.3	-45.2	0	0	0	112.1
1291	L	31.5	Very low	30.5	Very low	178 Å²	178	128.4 Å²	128.4	93%	0.932	79%	0.786	S	S	*	*			trans	-150.1	123.3	134.5	-112.1	164.9	0	0	0	110.1
1292	D	29	Very low	30.7	Very low	132 Å²	132	125 Å²	125	71%	0.706	78%	0.783	S	S	*	*			trans	-72.3	157.8	-179.7	-79	-78.2	0	0	0	113.4
1293	L	32.9	Very low	31	Very low	179 Å²	179	122.1 Å²	122.1	94%	0.937	78%	0.783	S	S	*	*				166.2	143.6	111.3	-86.8	166.7	0	0	0	112.5
1294	G	32.2	Very low	31.1	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	78%	0.783	S	S	*	*			trans	152.3	-53.3	138.7	0	0	0	0	0	120.5
1295	G	29.5	Very low	31.3	Very low	77 Å²	77	126.9 Å²	126.9	79%	0.794	79%	0.787	S	S	*	*			trans	71	-155.5	179.5	0	0	0	0	0	116.9
1296	P	36.7	Very low	31.1	Very low	114 Å²	114	126.9 Å²	126.9	74%	0.74	78%	0.782	S	S	*	*				-141.8	162.8	-81.1	39.7	-25.7	0	0	0	118.1
1297	S	27.8	Very low	31.1	Very low	106 Å²	106	127.8 Å²	127.8	74%	0.741	79%	0.786	S	S	*	*			trans	62.7	132.9	141.6	66.6	0	0	0	0	122.7
1298	V	31.3	Very low	31.2	Very low	141 Å²	141	129.4 Å²	129.4	86%	0.855	79%	0.785	S	S	*	*				-144.8	151.1	110.9	178	0	0	0	0	107.6
1299	A	27.9	Very low	31.2	Very low	87 Å²	87	130.2 Å²	130.2	72%	0.719	79%	0.785	S	S	*	*			trans	-141.8	156.2	-174	0	0	0	0	0	114.4
1300	Y	30.5	Very low	31.1	Very low	221 Å²	221	128.8 Å²	128.8	87%	0.867	78%	0.782	S	S	*	*			trans	-160.5	145	160.8	-83	-78.5	0	0	0	108.5
1301	S	32.1	Very low	31.1	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	78%	0.781	S	S	*	*			cis	-169.6	136.2	-32.1	46.2	0	0	0	0	108.7
1302	S	31.3	Very low	31	Very low	95 Å²	95	126.3 Å²	126.3	66%	0.664	77%	0.773	S	S	*	*			trans	-88.6	-178	-179.2	58.7	0	0	0	0	113.8	S1304	S1302-S1304 PolarHBondContact OG-OG 2.79Å
1303	P	36.6	Very low	30.8	Very low	123 Å²	123	128.6 Å²	128.6	80%	0.799	77%	0.772	S	S	*	*				-137.2	153.1	90.3	37	-24.1	0	0	0	114
1304	S	29.6	Very low	30.6	Very low	83 Å²	83	124.8 Å²	124.8	58%	0.58	76%	0.76	S	S	*	*			cis	97.2	111.5	18.6	-60.3	0	0	0	0	116.3	S1302	S1302-S1304 PolarHBondContact OG-OG 2.79Å
1305	F	32.5	Very low	30.4	Very low	205 Å²	205	126.7 Å²	126.7	90%	0.899	76%	0.757	S	S	*	*			trans	-165.2	90.1	150.7	-99.5	-72.3	0	0	0	108.5
1306	V	29.3	Very low	30.3	Very low	115 Å²	115	131.1 Å²	131.1	70%	0.697	76%	0.761	S	S	*	*				74.3	108.9	87.4	174.3	0	0	0	0	114.4
1307	P	29.9	Very low	29.9	Very low	124 Å²	124	129.5 Å²	129.5	81%	0.805	77%	0.765	S	S	*	*			trans	-93.8	159.3	166.7	37.2	-32.8	0	0	0	112.5
1308	V	33.6	Very low	29.9	Very low	135 Å²	135	130.9 Å²	130.9	82%	0.818	77%	0.769	S	S	*	*			trans	-135.4	126.8	168.6	178.1	0	0	0	0	109.5
1309	S	30.9	Very low	29.6	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	76%	0.76	S	S	*	*			trans	-86.7	142	174	53.1	0	0	0	0	111.8
1310	N	30.7	Very low	29.4	Very low	164 Å²	164	134.6 Å²	134.6	88%	0.877	76%	0.76	S	S	*	*			trans	-163.9	150.1	137	-104.5	-37	0	0	0	114.4
1311	V	27.3	Very low	29.1	Very low	125 Å²	125	131 Å²	131	76%	0.758	75%	0.753	S	S	*	*			trans	-73.2	147.1	-175.4	174.8	0	0	0	0	112.3
1312	L	29.4	Very low	28.7	Very low	146 Å²	146	136.5 Å²	136.5	76%	0.764	76%	0.758	S	S	*	*				178.4	113.2	129.2	-95	165.3	0	0	0	116.1
1313	R	25.9	Very low	28.4	Very low	179 Å²	179	141.5 Å²	141.5	68%	0.675	77%	0.771	S	S	*	*			trans	47.1	121.2	132.4	-79	-176	-171	-175.3	2.1	122.8
1314	S	28.2	Very low	28	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	77%	0.772	S	S	*	*				65.9	148.7	119.7	81.5	0	0	0	0	120.1
1315	T	27.8	Very low	28	Very low	115 Å²	115	146.8 Å²	146.8	71%	0.706	79%	0.787	S	S	*	*			cis	-168.9	164.9	4.9	0.1	0	0	0	0	110
1316	L	27	Very low	27.7	Very low	170 Å²	170	147.5 Å²	147.5	89%	0.89	79%	0.785	S	S	*	*			trans	63.4	136.1	152	-67.6	160.4	0	0	0	119.3
1317	G	28.8	Very low	27.8	Very low	80 Å²	80	147.4 Å²	147.4	83%	0.825	78%	0.78	S	S	*	*			trans	165.4	87.4	170.5	0	0	0	0	0	113.6
1318	T	26.4	Very low	27.7	Very low	135 Å²	135	149.7 Å²	149.7	83%	0.828	78%	0.777	S	S	*	*			trans	-86.2	166.2	-178.8	48.8	0	0	0	0	113.9
1319	E	25	Very low	27.6	Very low	142 Å²	142	153.3 Å²	153.3	66%	0.664	78%	0.782	S	S	*	*			trans	98.3	116.2	158.2	-55.4	-138.9	95.8	0	0	120.2
1320	K	25.1	Very low	27.8	Very low	165 Å²	165	153 Å²	153	72%	0.717	79%	0.785	S	S	*	*				27.5	119.7	127.8	-51.5	164	-169.9	148.4	0	117.7
1321	M	23.2	Very low	27.7	Very low	145 Å²	145	155.8 Å²	155.8	71%	0.714	78%	0.783	S	S	*	*				164.9	146.9	102.7	-88.4	-147.6	-172	0	0	114.7
1322	R	24.2	Very low	28.2	Very low	221 Å²	221	155.1 Å²	155.1	83%	0.834	78%	0.781	S	S	*	*			trans	64.6	122.9	145	-72.3	171.3	175.5	171.6	-0.4	121.4
1323	Q	25.7	Very low	28.4	Very low	200 Å²	200	155.8 Å²	155.8	94%	0.935	78%	0.778	S	S	*	*			trans	-14.6	134.6	145.6	-60.6	170.1	-18.1	0	0	117.5
1324	G	26.6	Very low	28.8	Very low	81 Å²	81	153.8 Å²	153.8	84%	0.835	78%	0.781	S	S	*	*			trans	-162.3	99.2	165	0	0	0	0	0	114.3
1325	R	29.5	Very low	29.1	Very low	236 Å²	236	154.5 Å²	154.5	89%	0.891	78%	0.781	S	S	*	*			trans	-91.3	125.9	168.1	-61.3	175	-178.1	166.4	-2.5	110.4
1326	Y	28	Very low	29.4	Very low	220 Å²	220	159.5 Å²	159.5	86%	0.863	79%	0.787	S	S	*	*			trans	-156.8	142.8	158.3	-88.2	-88	0	0	0	110.8
1327	I	30.1	Very low	29.6	Very low	112 Å²	112	161.7 Å²	161.7	57%	0.574	79%	0.785	S	S	*	*			cis	-166.9	150.8	-24.9	-130.9	-162.6	0	0	0	114.3
1328	K	29.3	Very low	29.9	Very low	173 Å²	173	162.6 Å²	162.6	75%	0.752	78%	0.777	S	S	*	*			trans	27.8	144.5	152.5	-62	168.8	-170	166.1	0	123.8
1329	K	30.6	Very low	30.2	Very low	211 Å²	211	162.1 Å²	162.1	92%	0.917	77%	0.774	S	S	*	*				-162.7	151.7	106	-94.9	171.4	-175.4	177.7	0	108.8
1330	A	34.1	Very low	30.7	Very low	93 Å²	93	160.6 Å²	160.6	77%	0.769	78%	0.779	S	S	*	*			cis	-156.9	169	-30.9	0	0	0	0	0	109.6
1331	W	29.9	Very low	31.2	Very low	224 Å²	224	156.8 Å²	156.8	85%	0.848	77%	0.773	S	S	*	*			trans	-119.9	170.9	-169.7	-115.9	47.8	0	0	0	110.8	K1333	W1331-K1333 HydrophobicContact CE3-CG 4.25Å; W1331-K1333 HydrophobicContact CZ3-CG 4.47Å
1332	P	37.3	Very low	31.9	Very low	110 Å²	110	155.9 Å²	155.9	71%	0.714	77%	0.771	S	S	*	*				-167.2	140.3	71.7	41.5	-16.5	0	0	0	123.4
1333	K	33.3	Very low	32.3	Very low	160 Å²	160	155.4 Å²	155.4	70%	0.696	77%	0.769	S	S	*	*				84.7	147.6	121.5	-75.3	-177.2	177.1	-178.8	0	126.7	W1331	W1331-K1333 HydrophobicContact CE3-CG 4.25Å; W1331-K1333 HydrophobicContact CZ3-CG 4.47Å
1334	N	35.4	Very low	32.6	Very low	138 Å²	138	153.1 Å²	153.1	74%	0.738	76%	0.756	S	S	*	*			trans	89.3	136.3	153.3	-68.6	-5.3	0	0	0	118.2
1335	T	34.8	Very low	32.5	Very low	114 Å²	114	160.8 Å²	160.8	70%	0.699	77%	0.77	S	S	*	*			cis	-159	125.5	-0.4	7.2	0	0	0	0	115.7
1336	R	33.9	Very low	32.7	Very low	220 Å²	220	157 Å²	157	83%	0.83	76%	0.764	S	S	*	*			trans	56.6	111.4	139.6	-65.9	-171.3	172	-170.4	-1.9	124.8
1337	Y	30.7	Very low	32.9	Very low	216 Å²	216	153.7 Å²	153.7	85%	0.847	76%	0.759	S	S	*	*				58.7	166.3	109.8	-77.3	-56.3	0	0	0	123
1338	P	35	Very low	33.1	Very low	99 Å²	99	156 Å²	156	64%	0.643	77%	0.769	S	S	*	*			cis	-137.9	161	-4.5	35.6	-15.4	0	0	0	119
1339	T	33.1	Very low	33.3	Very low	125 Å²	125	155 Å²	155	77%	0.767	77%	0.77	S	S	*	*			trans	51.4	149.4	142.4	56.3	0	0	0	0	122.5
1340	S	34.4	Very low	33.5	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	76%	0.761	S	S	*	*			cis	179.2	-176.1	-13.3	61.5	0	0	0	0	107.5
1341	S	37.2	Very low	33.4	Very low	85 Å²	85	155.4 Å²	155.4	59%	0.594	76%	0.76	S	S	*	*			cis	-159.3	166.3	5.9	81.6	0	0	0	0	110.9
1342	N	36.1	Very low	33.7	Very low	126 Å²	126	150.5 Å²	150.5	67%	0.674	75%	0.754	S	S	*	*			trans	55.3	116.7	151.4	-65.7	-30.2	0	0	0	120.1
1343	R	33.4	Very low	33.4	Very low	211 Å²	211	153.6 Å²	153.6	80%	0.796	76%	0.757	S	S	*	*				71.7	134.3	67.9	-70.3	-173.8	168.5	-165.2	-1.4	112.6
1344	K	32.3	Very low	33.4	Very low	152 Å²	152	153.1 Å²	153.1	66%	0.661	76%	0.762	S	S	*	*			cis	-161.3	139.6	6.7	-125.8	-179.8	157.8	-71.7	0	113.3
1345	Q	24.6	Very low	33.2	Very low	241 Å²	241	154.5 Å²	154.5	100%	1.126	76%	0.764	S	S	*	*				-96.5	0	119	-74.9	175	-46.8	0	0	106

Retrieved 1,345 of 1,345 residues in 1067.8 ms (Link to these results)

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