A0A5K4F339_SCHMA Loading...

Calponin-homology (CH) domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F339, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 850 aa.

						>A0A5K4F339_SCHMA|A0A5K4F339
MLDSFVVSNKSDDALKNDTDNKDSIFCDYYSNRQGIFSNCRLRDFSNISETLKFVEHLDLSRNFITNVPNGIEQYRLLTTLDLSFNKIFSLPNSLCKLPSLRILLMSNNYLSSLPASICELQNLQELDLSFNRFKCFPSSICSLQSLKVLLLGCNLIEKLPEDIVGLRCLKILDLHSNGVKQLPLNIRFMWCLEKLSLEENPLSPPLLTIVARGIPYIFAFLNQQSLCNSNNTSCEKFHDSLTQSSSAHVINTSNQQNAMKLPESQYVTSDSSSQSFEKTEINTDYDQRYISKSEITNPSLIIQNSTYSTTNNKKEQFDKSNVKLHLTDYNCTENFSHNESTHSCINETLKSGSSFSSLSNDDNESLTTNMHSSAYENVILDKNDNEGFYLTSNISQQLAQAINNSQIKQPISPGNDNAKKAIVPTVLNGNDSAVQKVNGYIIANERLCSVFEPTNNGQIEYCPTNHSSFKYNRRDKGGPISSNNRLRNSKRQQIEHDRTFYCSSGYITPDSYLSESYSISQTNGYDCQNLSQYHIDEQLVKQRNHTQILYHPQQNGLYNKDISNKTTRVGVALCMPSECTLKLPKNFQTSHNYQPQINTHCQDSNVAFSTGYSNKDISRKGETQNINTSEYMKMNSPKDIVKWEELNSDDLIRIHQLRKIIDKELNIRLPINPKHLIIELSTGVILIQLLNKFIGTTSNIKICLPRNDQRNNMLNEVVKSYRRNLRRCRATIYRYGVPKEYLFSTESIINPQNADGLLSLANSISILYNLHNNNNNTKSPINASSSNKIQEDFSTNIDNQYNTSVSQIQSTSPSLQQIHSGKHQPTDKTANHRRIHQMTIWSNYLCSDV
					

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(Predicted Aligned Error values between residue pairs)

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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	22.4	Very low	26.8	Very low	250 Å²	250	122.9 Å²	122.9	100%	1.232	67%	0.666	S	S	*	*				0	2.1	0	-111.1	-176.2	-175.2	0	0	113.4
2	L	24.3	Very low	26.7	Very low	141 Å²	141	125.1 Å²	125.1	74%	0.738	68%	0.677	S	S	*	*			trans	-115.1	4	-169.7	-83.4	161	0	0	0	115.7
3	D	25	Very low	27	Very low	165 Å²	165	128.5 Å²	128.5	88%	0.882	70%	0.695	S	S	*	*	S	Bend	trans	-107.4	18.7	-165.2	-73.4	-33	0	0	0	117.2
4	S	24.3	Very low	26.9	Very low	91 Å²	91	124.9 Å²	124.9	64%	0.636	69%	0.691	S	S	*	*			trans	-149	63.3	-173	68.6	0	0	0	0	116.1
5	F	30	Very low	26.7	Very low	121 Å²	121	126 Å²	126	53%	0.531	69%	0.694	S	S	.	*			trans	-139.8	55.1	161.3	-78.4	-78.1	0	0	0	111.1	N32 S49	F5-N32 PolarHBondContact O-ND2 3.31Å; F5-N32 VanDerWaalsContact O-ND2 3.13Å; F5-S49 WeakPolarHBondContact CD1-OG 3.47Å
6	V	31.1	Very low	26.8	Very low	79 Å²	79	131.4 Å²	131.4	48%	0.479	71%	0.709	S	S	.	*	S	Bend	trans	-74.4	138.3	156.2	180	0	0	0	0	106.4	S8	V6-S8 PolarHBondContact O-N 3.43Å
7	V	33.1	Very low	26.8	Very low	30 Å²	30	132.2 Å²	132.2	18%	0.182	71%	0.713	C	S	.	*			trans	-53.8	90.2	162.7	177.2	0	0	0	0	106.4	N9 N47 I48	V7-N9 PolarHBondContact O-N 3.37Å; V7-N47 HydrophobicContact CG1-CB 3.74Å; V7-I48 HydrophobicContact CG2-CG1 4.33Å
8	S	28.3	Very low	26.6	Very low	74 Å²	74	131.6 Å²	131.6	52%	0.517	71%	0.709	S	S	.	*			trans	-87.1	108.4	-167.5	41.3	0	0	0	0	107.5	V6 K10 N47	V6-S8 PolarHBondContact O-N 3.43Å; S8-K10 PolarHBondContact O-N 3.32Å; S8-N47 VanDerWaalsContact O-CG 3.28Å; S8-N47 PolarHBondContact O-ND2 3.1Å; S8-N47 VanDerWaalsContact O-ND2 3.16Å
9	N	25.8	Very low	26.7	Very low	112 Å²	112	131.1 Å²	131.1	60%	0.599	71%	0.711	S	S	*	*			trans	-61.9	103.6	160.1	-80.1	-18	0	0	0	107.5	V7 S11 N47	V7-N9 PolarHBondContact O-N 3.37Å; N9-S11 PolarHBondContact O-N 3.47Å; N9-N47 WeakPolarHBondContact CA-ND2 3.42Å; N9-N47 PolarHBondContact OD1-ND2 2.9Å
10	K	24.6	Very low	26.8	Very low	184 Å²	184	132 Å²	132	80%	0.8	72%	0.715	S	S	*	*			trans	-63	112.7	160.8	-80.1	-174.9	174.7	-179.6	0	108.5	S8	S8-K10 PolarHBondContact O-N 3.32Å
11	S	25.5	Very low	26.9	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	71%	0.713	S	S	*	*			trans	-165.3	94.7	133.9	24.5	0	0	0	0	107.4	N9	N9-S11 PolarHBondContact O-N 3.47Å
12	D	26.7	Very low	27.2	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	69%	0.692	S	S	*	*			trans	-57	139.7	161.3	-68.6	-51.2	0	0	0	109.7	A14	D12-A14 PolarHBondContact O-N 3.4Å
13	D	30.4	Very low	27.5	Very low	170 Å²	170	128.1 Å²	128.1	91%	0.909	69%	0.691	S	S	*	*	S	Bend	trans	70.5	6.9	154.8	-66.1	-23.2	0	0	0	123
14	A	25.7	Very low	28	Very low	77 Å²	77	124.1 Å²	124.1	64%	0.636	68%	0.676	S	S	*	*	S	Bend	trans	-139.9	88.4	169.8	0	0	0	0	0	112.8	D12	D12-A14 PolarHBondContact O-N 3.4Å
15	L	24	Very low	28.8	Very low	142 Å²	142	122.4 Å²	122.4	74%	0.743	66%	0.66	S	S	*	*			trans	166	84.9	141.8	-88.5	154.6	0	0	0	108.8	N17	L15-N17 PolarHBondContact O-N 3.28Å; L15-N17 VanDerWaalsContact O-N 3.11Å
16	K	27.8	Very low	29	Very low	213 Å²	213	124.1 Å²	124.1	93%	0.926	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	12.4	176.3	-139.6	173.8	-171.9	174	0	113.8
17	N	26.4	Very low	29.6	Very low	145 Å²	145	121 Å²	121	78%	0.775	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	3.3	-170.2	-78.6	-9.5	0	0	0	117.2	L15	L15-N17 PolarHBondContact O-N 3.28Å; L15-N17 VanDerWaalsContact O-N 3.11Å
18	D	24.5	Very low	30	Very low	120 Å²	120	123.9 Å²	123.9	64%	0.642	66%	0.663	S	S	*	*			trans	-109	90.7	172.9	-78.6	-23.4	0	0	0	111	D20	D18-D20 PolarHBondContact O-N 3.12Å
19	T	27.5	Very low	30.4	Very low	122 Å²	122	125.6 Å²	125.6	75%	0.748	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	0.8	176	40.1	0	0	0	0	114.5
20	D	29.5	Very low	31	Very low	149 Å²	149	126.5 Å²	126.5	80%	0.797	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	3.7	-173.3	-74	-5.8	0	0	0	115.1	D18	D18-D20 PolarHBondContact O-N 3.12Å
21	N	28.8	Very low	32.2	Very low	124 Å²	124	119 Å²	119	66%	0.663	63%	0.626	S	S	*	*			trans	-111.1	26.8	-175.7	-127.9	1.9	0	0	0	114.8
22	K	27.9	Very low	33.5	Very low	183 Å²	183	114.5 Å²	114.5	80%	0.796	59%	0.593	S	S	*	*			trans	-90.2	2.4	176.7	-78.3	-171.6	177.9	178.4	0	115.4	S24	K22-S24 PolarHBondContact O-N 2.94Å
23	D	31.1	Very low	34.9	Very low	135 Å²	135	115.8 Å²	115.8	72%	0.722	59%	0.587	S	S	*	*			trans	-79.9	38.8	174.8	-76.2	-12.8	0	0	0	112.6	I25	D23-I25 PolarHBondContact O-N 3.03Å; D23-I25 VanDerWaalsContact O-N 3.15Å
24	S	34.9	Very low	36.6	Very low	81 Å²	81	113.4 Å²	113.4	57%	0.566	57%	0.57	S	S	*	*			trans	-74.6	101.6	171.7	66.1	0	0	0	0	109	K22 F26	K22-S24 PolarHBondContact O-N 2.94Å; S24-F26 PolarHBondContact O-N 2.8Å
25	I	40.6	Very low	38.7	Very low	56 Å²	56	109.8 Å²	109.8	29%	0.287	54%	0.54	S	S	.	.			trans	-74.8	123.8	-172.5	-72.7	151.5	0	0	0	110.9	D23 C27 C40 R41	D23-I25 PolarHBondContact O-N 3.03Å; D23-I25 VanDerWaalsContact O-N 3.15Å; I25-C27 VanDerWaalsContact C-N 3.34Å; I25-C27 PolarHBondContact O-N 3.24Å; I25-C40 WeakPolarHBondContact CB-O 3.34Å; I25-C40 WeakPolarHBondContact CD1-O 3.48Å; I25-C40 HydrophobicContact CG2-CB 4.38Å; I25-C40 VanDerWaalsContact CG2-O 3.26Å; I25-C40 WeakPolarHBondContact CG2-O 3.44Å; I25-R41 HydrophobicContact CD1-CB 3.27Å; I25-R41 HydrophobicContact CD1-CG 3.61Å
26	F	35.1	Very low	41.1	Very low	157 Å²	157	104.9 Å²	104.9	69%	0.689	51%	0.514	S	S	*	.			trans	-58.2	93.6	168.3	-159.4	-93.9	0	0	0	108.3	S24 D28	S24-F26 PolarHBondContact O-N 2.8Å; F26-D28 WeakPolarHBondContact CD1-OD1 3.47Å; F26-D28 PolarHBondContact O-N 2.77Å
27	C	43.5	Very low	43.3	Very low	13 Å²	13	94.8 Å²	94.8	9%	0.088	47%	0.47	C	S	.	.			trans	-75.1	112.9	164.6	-61.8	0	0	0	0	105.6	I25 F37	I25-C27 VanDerWaalsContact C-N 3.34Å; I25-C27 PolarHBondContact O-N 3.24Å; C27-F37 HydrophobicContact CB-CD1 3.86Å; C27-F37 HydrophobicContact CB-CE1 3.89Å
28	D	42.1	Very low	45.3	Very low	91 Å²	91	88.4 Å²	88.4	49%	0.487	44%	0.437	S	S	.	.			trans	-50.8	146	-177.8	-72	-33	0	0	0	110.8	F26 Y30 S31	F26-D28 WeakPolarHBondContact CD1-OD1 3.47Å; F26-D28 PolarHBondContact O-N 2.77Å; D28-Y30 PolarHBondContact O-N 3.42Å; D28-S31 VanDerWaalsContact O-CB 3.28Å; D28-S31 WeakPolarHBondContact O-CB 3.29Å; D28-S31 PolarHBondContact O-N 2.99Å
29	Y	35.6	Very low	47.3	Very low	110 Å²	110	87.3 Å²	87.3	43%	0.431	43%	0.431	S	S	.	.	H	α-helix	trans	-46.1	-30.7	-177.6	177	-96.1	0	0	0	114.1	N32 R33	Y29-N32 PolarHBondContact O-N 2.79Å; Y29-R33 PolarHBondContact OH-NE 2.74Å; Y29-R33 PolarHBondContact OH-NH2 3.47Å
30	Y	39	Very low	49.2	Very low	131 Å²	131	82.4 Å²	82.4	51%	0.514	40%	0.402	S	S	.	.	H	α-helix	trans	-67.3	-42.9	176.7	-69.4	-82.2	0	0	0	114	D28 N32 R33 Q34	D28-Y30 PolarHBondContact O-N 3.42Å; Y30-N32 PolarHBondContact O-N 3.38Å; Y30-R33 PolarHBondContact O-N 3.27Å; Y30-Q34 PolarHBondContact O-N 3.29Å
31	S	49.4	Very low	51.2	Low	27 Å²	27	83 Å²	83	19%	0.189	39%	0.393	C	S	.	.	H	α-helix	trans	-54.7	-40	174.9	-72	0	0	0	0	111.2	D28 R33 G35 I36	D28-S31 VanDerWaalsContact O-CB 3.28Å; D28-S31 WeakPolarHBondContact O-CB 3.29Å; D28-S31 PolarHBondContact O-N 2.99Å; S31-R33 PolarHBondContact O-N 2.87Å; S31-G35 PolarHBondContact O-N 3.47Å; S31-I36 WeakPolarHBondContact CA-O 3.41Å; S31-I36 WeakPolarHBondContact CB-O 3.35Å; S31-I36 PolarHBondContact O-N 2.83Å; S31-I36 VanDerWaalsContact O-N 3.07Å; S31-I36 PolarHBondContact OG-O 3.49Å
32	N	53.8	Low	53.4	Low	10 Å²	10	77.9 Å²	77.9	5%	0.053	37%	0.365	C	S	.	.	H	α-helix	trans	-66.1	-30.5	-178.8	-81	-29.1	0	0	0	114.8	F5 Y29 Y30 F37 L52	F5-N32 PolarHBondContact O-ND2 3.31Å; F5-N32 VanDerWaalsContact O-ND2 3.13Å; Y29-N32 PolarHBondContact O-N 2.79Å; Y30-N32 PolarHBondContact O-N 3.38Å; N32-F37 WeakPolarHBondContact OD1-CE1 3.4Å; N32-F37 VanDerWaalsContact OD1-CZ 3.23Å; N32-F37 WeakPolarHBondContact OD1-CZ 3.46Å; N32-L52 WeakPolarHBondContact O-CD2 3.38Å
33	R	55.9	Low	55.8	Low	176 Å²	176	77.5 Å²	77.5	66%	0.664	36%	0.359	S	S	*	.	H	α-helix	trans	-88.6	-34.3	178.3	-81.3	-161.4	-173.1	-145.3	2.8	113.3	Y29 Y30 S31	Y29-R33 PolarHBondContact OH-NE 2.74Å; Y29-R33 PolarHBondContact OH-NH2 3.47Å; Y30-R33 PolarHBondContact O-N 3.27Å; S31-R33 PolarHBondContact O-N 2.87Å
34	Q	65.8	Low	58.1	Low	120 Å²	120	74.3 Å²	74.3	56%	0.561	34%	0.342	S	S	*	.	H	α-helix	trans	-87.9	-8.6	-177.2	-66.4	-172.7	-5.4	0	0	113.2	Y30 I36	Y30-Q34 PolarHBondContact O-N 3.29Å; Q34-I36 VanDerWaalsContact C-N 3.34Å; Q34-I36 HydrophobicContact CB-CD1 3.85Å; Q34-I36 HydrophobicContact CB-CG1 3.91Å
35	G	70	Confident	60.2	Low	0 Å²	0	70.5 Å²	70.5	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	24	-175	0	0	0	0	0	113.3	S31 L58 D59	S31-G35 PolarHBondContact O-N 3.47Å; G35-L58 CarbonylContact O-C 3.42Å; G35-L58 WeakPolarHBondContact O-CA 3.46Å; G35-L58 WeakPolarHBondContact O-CD1 3.42Å; G35-D59 PolarHBondContact O-N 3.16Å
36	I	73.5	Confident	61.8	Low	40 Å²	40	70.8 Å²	70.8	21%	0.205	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-110.5	101	-172.4	-56.1	175.6	0	0	0	109.8	S31 Q34 N673	S31-I36 WeakPolarHBondContact CA-O 3.41Å; S31-I36 WeakPolarHBondContact CB-O 3.35Å; S31-I36 PolarHBondContact O-N 2.83Å; S31-I36 VanDerWaalsContact O-N 3.07Å; S31-I36 PolarHBondContact OG-O 3.49Å; Q34-I36 VanDerWaalsContact C-N 3.34Å; Q34-I36 HydrophobicContact CB-CD1 3.85Å; Q34-I36 HydrophobicContact CB-CG1 3.91Å; I36-N673 HydrophobicContact CG2-CB 4.41Å; I36-N673 WeakPolarHBondContact CG2-ND2 3.35Å
37	F	74	Confident	62.9	Low	0 Å²	0	66.1 Å²	66.1	0%	0	30%	0.304	C	S	.	.			trans	-122.1	24.8	-176.6	-61.7	-85.6	0	0	0	112.3	C27 N32 N39 C40 L42 I48 L52 L58 D59 L60 N63	C27-F37 HydrophobicContact CB-CD1 3.86Å; C27-F37 HydrophobicContact CB-CE1 3.89Å; N32-F37 WeakPolarHBondContact OD1-CE1 3.4Å; N32-F37 VanDerWaalsContact OD1-CZ 3.23Å; N32-F37 WeakPolarHBondContact OD1-CZ 3.46Å; F37-N39 PolarHBondContact O-N 2.99Å; F37-C40 VanDerWaalsContact C-SG 3.58Å; F37-C40 WeakPolarHBondContact O-CB 3.33Å; F37-C40 PolarHBondContact O-SG 3.34Å; F37-L42 HydrophobicContact CB-CD1 3.77Å; F37-L42 HydrophobicContact CD1-CD1 4.29Å; F37-L42 HydrophobicContact CG-CD1 4.28Å; F37-I48 HydrophobicContact CD2-CD1 4.38Å; F37-I48 HydrophobicContact CE2-CD1 4.27Å; F37-I48 HydrophobicContact CE2-CG2 4.4Å; F37-I48 HydrophobicContact CZ-CD1 4.33Å; F37-I48 HydrophobicContact CZ-CG2 3.89Å; F37-L52 HydrophobicContact CE2-CD1 3.73Å; F37-L52 HydrophobicContact CE2-CD2 3.85Å; F37-L52 HydrophobicContact CE2-CG 4.3Å; F37-L52 HydrophobicContact CZ-CD1 4.17Å; F37-L52 HydrophobicContact CZ-CD2 4.18Å; F37-L52 HydrophobicContact CZ-CG 4.48Å; F37-L58 HydrophobicContact CD2-CD1 3.82Å; F37-L58 HydrophobicContact CE2-CD1 3.96Å; F37-D59 CarbonylContact C-O 3.5Å; F37-D59 WeakPolarHBondContact CA-O 3.27Å; F37-D59 PolarHBondContact N-O 3.41Å; F37-L60 HydrophobicContact CB-CD2 3.81Å; F37-L60 HydrophobicContact CD2-CD2 4.26Å; F37-L60 HydrophobicContact CG-CD2 4.26Å; F37-N63 PolarHBondContact O-ND2 3.03Å
38	S	69.4	Low	63.6	Low	11 Å²	11	65.9 Å²	65.9	8%	0.077	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	135.8	-179.3	28.7	0	0	0	0	112.1	C40 D59 S61 N673 H676	S38-C40 PolarHBondContact O-N 3.35Å; S38-D59 VanDerWaalsContact CB-OD2 3.27Å; S38-D59 WeakPolarHBondContact CB-OD2 3.41Å; S38-D59 PolarHBondContact N-O 3.21Å; S38-D59 PolarHBondContact OG-OD2 3.29Å; S38-S61 CarbonylContact C-O 3.2Å; S38-S61 WeakPolarHBondContact CA-O 3.43Å; S38-S61 WeakPolarHBondContact CB-OG 3.42Å; S38-N673 PolarHBondContact OG-ND2 3.16Å; S38-H676 WeakPolarHBondContact CB-NE2 3.28Å; S38-H676 PolarHBondContact OG-CD2 3.37Å; S38-H676 VanDerWaalsContact OG-CD2 3.28Å
39	N	65.8	Low	64.2	Low	98 Å²	98	62.4 Å²	62.4	52%	0.524	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	31.5	177.7	-167.4	42.5	0	0	0	114.9	F37 R41 S61 R62 H676	F37-N39 PolarHBondContact O-N 2.99Å; N39-R41 VanDerWaalsContact C-N 3.26Å; N39-R41 PolarHBondContact O-N 3.43Å; N39-S61 PolarHBondContact N-O 3.18Å; N39-R62 WeakPolarHBondContact CA-O 3.42Å; N39-R62 HydrophobicContact CB-CB 4.13Å; N39-H676 VanDerWaalsContact CB-CE1 3.47Å; N39-H676 WeakPolarHBondContact CB-CE1 3.09Å
40	C	66.9	Low	65.5	Low	18 Å²	18	63.9 Å²	63.9	12%	0.122	30%	0.296	C	S	.	.	S	Bend	trans	-87.9	12.5	174.9	-67.3	0	0	0	0	113	I25 F37 S38 L42 N63	I25-C40 WeakPolarHBondContact CB-O 3.34Å; I25-C40 WeakPolarHBondContact CD1-O 3.48Å; I25-C40 HydrophobicContact CG2-CB 4.38Å; I25-C40 VanDerWaalsContact CG2-O 3.26Å; I25-C40 WeakPolarHBondContact CG2-O 3.44Å; F37-C40 VanDerWaalsContact C-SG 3.58Å; F37-C40 WeakPolarHBondContact O-CB 3.33Å; F37-C40 PolarHBondContact O-SG 3.34Å; S38-C40 PolarHBondContact O-N 3.35Å; C40-L42 HydrophobicContact CB-CD1 4.27Å; C40-L42 HydrophobicContact CB-CD2 4.35Å; C40-L42 HydrophobicContact CB-CG 3.86Å; C40-L42 PolarHBondContact O-N 3.2Å; C40-N63 VanDerWaalsContact C-OD1 3.29Å; C40-N63 WeakPolarHBondContact CA-OD1 2.99Å; C40-N63 PolarHBondContact N-OD1 3.15Å
41	R	71.2	Confident	66.6	Low	163 Å²	163	60.4 Å²	60.4	62%	0.615	29%	0.288	S	S	*	.			trans	45.4	32.3	-173	-33.6	173.8	170.4	165	-4.1	114.3	I25 N39 R43 N63 F64	I25-R41 HydrophobicContact CD1-CB 3.27Å; I25-R41 HydrophobicContact CD1-CG 3.61Å; N39-R41 VanDerWaalsContact C-N 3.26Å; N39-R41 PolarHBondContact O-N 3.43Å; R41-R43 PolarHBondContact O-N 3.46Å; R41-N63 PolarHBondContact N-OD1 3.36Å; R41-F64 HydrophobicContact CB-CD2 3.74Å; R41-F64 HydrophobicContact CB-CE2 3.61Å; R41-F64 HydrophobicContact CG-CE2 4.11Å
42	L	75.6	Confident	67.6	Low	16 Å²	16	59.2 Å²	59.2	8%	0.084	28%	0.28	C	S	.	.			trans	-63.5	131.2	178.1	-62	175.5	0	0	0	110	F37 C40 L60 N63 F64 I65	F37-L42 HydrophobicContact CB-CD1 3.77Å; F37-L42 HydrophobicContact CD1-CD1 4.29Å; F37-L42 HydrophobicContact CG-CD1 4.28Å; C40-L42 HydrophobicContact CB-CD1 4.27Å; C40-L42 HydrophobicContact CB-CD2 4.35Å; C40-L42 HydrophobicContact CB-CG 3.86Å; C40-L42 PolarHBondContact O-N 3.2Å; L42-L60 HydrophobicContact CD1-CD2 3.91Å; L42-N63 HydrophobicContact CB-CB 4.06Å; L42-N63 PolarHBondContact N-OD1 3.43Å; L42-N63 WeakPolarHBondContact O-CB 3.29Å; L42-F64 CarbonylContact O-C 3.22Å; L42-F64 VanDerWaalsContact O-CA 3.27Å; L42-F64 WeakPolarHBondContact O-CA 3.5Å; L42-F64 PolarHBondContact O-N 2.98Å; L42-I65 HydrophobicContact CB-CG1 4.35Å; L42-I65 PolarHBondContact O-N 3.12Å
43	R	79.2	Confident	68.7	Low	175 Å²	175	61.8 Å²	61.8	66%	0.66	29%	0.29	S	S	*	.	S	Bend	trans	-94	-23.8	171.6	-66.7	-175.7	-177	-174.1	4.1	112.6	R41 F64	R41-R43 PolarHBondContact O-N 3.46Å; R43-F64 HydrophobicContact CG-CB 4.01Å
44	D	79.5	Confident	69.7	Low	67 Å²	67	60.9 Å²	60.9	36%	0.358	29%	0.292	S	S	.	.			trans	-151.7	159.2	178.8	-177.4	21.7	0	0	0	108.8	S46	D44-S46 PolarHBondContact OD1-N 3.27Å; D44-S46 PolarHBondContact OD1-OG 2.94Å; D44-S46 WeakPolarHBondContact OD2-CB 3.45Å; D44-S46 PolarHBondContact OD2-OG 3.03Å
45	F	77.7	Confident	70.5	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	27%	0.269	C	S	.	.			trans	-132.2	16	175.7	68.5	-86.6	0	0	0	114	N47 I48 L60 I65 V68 P69 I72 L83	F45-N47 PolarHBondContact O-N 3.43Å; F45-N47 VanDerWaalsContact O-N 3.16Å; F45-I48 HydrophobicContact CB-CD1 3.35Å; F45-I48 HydrophobicContact CB-CG1 3.65Å; F45-I48 HydrophobicContact CD2-CD1 4.34Å; F45-I48 HydrophobicContact CG-CD1 4.28Å; F45-I48 WeakPolarHBondContact O-CG1 3.43Å; F45-I48 PolarHBondContact O-N 3.28Å; F45-L60 HydrophobicContact CB-CD2 4.33Å; F45-L60 HydrophobicContact CD1-CD1 4.07Å; F45-L60 HydrophobicContact CD2-CD1 3.91Å; F45-L60 HydrophobicContact CE1-CD1 3.96Å; F45-L60 HydrophobicContact CE2-CD1 3.8Å; F45-L60 HydrophobicContact CG-CD1 4.01Å; F45-L60 HydrophobicContact CZ-CD1 3.77Å; F45-I65 HydrophobicContact CD1-CD1 3.77Å; F45-I65 HydrophobicContact CD1-CG1 4.22Å; F45-I65 HydrophobicContact CD1-CG2 3.91Å; F45-I65 HydrophobicContact CE1-CD1 4.16Å; F45-I65 HydrophobicContact CE1-CG2 3.8Å; F45-V68 HydrophobicContact CE1-CB 4.39Å; F45-V68 HydrophobicContact CE1-CG2 4.17Å; F45-V68 HydrophobicContact CZ-CB 4.17Å; F45-V68 HydrophobicContact CZ-CG1 3.85Å; F45-V68 HydrophobicContact CZ-CG2 4.07Å; F45-P69 HydrophobicContact CD1-CG 4.49Å; F45-P69 HydrophobicContact CD2-CG 3.79Å; F45-P69 HydrophobicContact CE1-CG 4.42Å; F45-P69 VanDerWaalsContact CE2-CD 3.44Å; F45-P69 HydrophobicContact CE2-CG 3.72Å; F45-P69 HydrophobicContact CG-CG 4.22Å; F45-P69 HydrophobicContact CZ-CG 4.09Å; F45-I72 HydrophobicContact CE2-CD1 4Å; F45-I72 HydrophobicContact CZ-CD1 4.09Å; F45-L83 HydrophobicContact CE1-CD2 4.21Å; F45-L83 HydrophobicContact CZ-CD2 4.29Å
46	S	74.1	Confident	71.4	Confident	62 Å²	62	61 Å²	61	43%	0.434	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-35.7	174.3	-56.8	0	0	0	0	113.5	D44 P69	D44-S46 PolarHBondContact OD1-N 3.27Å; D44-S46 PolarHBondContact OD1-OG 2.94Å; D44-S46 WeakPolarHBondContact OD2-CB 3.45Å; D44-S46 PolarHBondContact OD2-OG 3.03Å; S46-P69 WeakPolarHBondContact OG-CB 3.35Å
47	N	58.2	Low	71.9	Confident	60 Å²	60	63.9 Å²	63.9	32%	0.321	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	11.2	-177	-67.8	-31.7	0	0	0	113.6	V7 S8 N9 F45 S49	V7-N47 HydrophobicContact CG1-CB 3.74Å; S8-N47 VanDerWaalsContact O-CG 3.28Å; S8-N47 PolarHBondContact O-ND2 3.1Å; S8-N47 VanDerWaalsContact O-ND2 3.16Å; N9-N47 WeakPolarHBondContact CA-ND2 3.42Å; N9-N47 PolarHBondContact OD1-ND2 2.9Å; F45-N47 PolarHBondContact O-N 3.43Å; F45-N47 VanDerWaalsContact O-N 3.16Å; N47-S49 PolarHBondContact O-N 2.96Å
48	I	59.3	Low	72.6	Confident	8 Å²	8	64 Å²	64	4%	0.041	31%	0.306	C	S	.	.			trans	-69.7	115	179.1	-52.9	179.1	0	0	0	109.9	V7 F37 F45 L52 L60	V7-I48 HydrophobicContact CG2-CG1 4.33Å; F37-I48 HydrophobicContact CD2-CD1 4.38Å; F37-I48 HydrophobicContact CE2-CD1 4.27Å; F37-I48 HydrophobicContact CE2-CG2 4.4Å; F37-I48 HydrophobicContact CZ-CD1 4.33Å; F37-I48 HydrophobicContact CZ-CG2 3.89Å; F45-I48 HydrophobicContact CB-CD1 3.35Å; F45-I48 HydrophobicContact CB-CG1 3.65Å; F45-I48 HydrophobicContact CD2-CD1 4.34Å; F45-I48 HydrophobicContact CG-CD1 4.28Å; F45-I48 WeakPolarHBondContact O-CG1 3.43Å; F45-I48 PolarHBondContact O-N 3.28Å; I48-L52 HydrophobicContact CB-CD1 3.81Å; I48-L52 HydrophobicContact CD1-CD1 4.09Å; I48-L52 HydrophobicContact CG2-CB 4.47Å; I48-L52 HydrophobicContact CG2-CD1 3.11Å; I48-L52 HydrophobicContact CG2-CG 3.52Å; I48-L60 HydrophobicContact CD1-CD2 3.95Å
49	S	54	Low	73.3	Confident	18 Å²	18	64.4 Å²	64.4	13%	0.126	31%	0.307	C	S	.	.			trans	-7.9	135.8	168.6	-179.7	0	0	0	0	117.2	F5 N47 T51 L52	F5-S49 WeakPolarHBondContact CD1-OG 3.47Å; N47-S49 PolarHBondContact O-N 2.96Å; S49-T51 VanDerWaalsContact CB-OG1 3.32Å; S49-T51 WeakPolarHBondContact CB-OG1 3.12Å; S49-T51 PolarHBondContact O-N 3.38Å; S49-T51 WeakPolarHBondContact OG-CB 2.78Å; S49-T51 VanDerWaalsContact OG-CG2 3.27Å; S49-T51 WeakPolarHBondContact OG-CG2 3.13Å; S49-T51 PolarHBondContact OG-N 2.83Å; S49-T51 PolarHBondContact OG-OG1 3.44Å; S49-L52 PolarHBondContact O-N 3.22Å
50	E	63.1	Low	74.3	Confident	140 Å²	140	59.7 Å²	59.7	65%	0.654	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-51.8	-22.6	167.7	-60.2	-160.2	115.2	0	0	113.5	L52 K53	E50-L52 PolarHBondContact O-N 2.66Å; E50-K53 HydrophobicContact CB-CD 4.33Å; E50-K53 VanDerWaalsContact O-CB 3.31Å; E50-K53 WeakPolarHBondContact O-CB 3.47Å; E50-K53 VanDerWaalsContact O-CG 3.28Å; E50-K53 WeakPolarHBondContact O-CG 3.18Å; E50-K53 PolarHBondContact O-N 3.12Å; E50-K53 VanDerWaalsContact O-N 3.12Å; E50-K53 IonicContact OE1-NZ 3.36Å; E50-K53 PolarHBondContact OE1-NZ 2.95Å
51	T	62.1	Low	75	Confident	59 Å²	59	59.1 Å²	59.1	36%	0.362	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-61.3	-26.1	176.1	62.8	0	0	0	0	113.1	S49 K53	S49-T51 VanDerWaalsContact CB-OG1 3.32Å; S49-T51 WeakPolarHBondContact CB-OG1 3.12Å; S49-T51 PolarHBondContact O-N 3.38Å; S49-T51 WeakPolarHBondContact OG-CB 2.78Å; S49-T51 VanDerWaalsContact OG-CG2 3.27Å; S49-T51 WeakPolarHBondContact OG-CG2 3.13Å; S49-T51 PolarHBondContact OG-N 2.83Å; S49-T51 PolarHBondContact OG-OG1 3.44Å; T51-K53 VanDerWaalsContact C-N 3.26Å; T51-K53 PolarHBondContact O-N 3.3Å
52	L	70.5	Confident	75.2	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-74.5	-12.6	178	-75.9	-161.3	0	0	0	113.8	N32 F37 I48 S49 E50 F54 V55 L58 Y75	N32-L52 WeakPolarHBondContact O-CD2 3.38Å; F37-L52 HydrophobicContact CE2-CD1 3.73Å; F37-L52 HydrophobicContact CE2-CD2 3.85Å; F37-L52 HydrophobicContact CE2-CG 4.3Å; F37-L52 HydrophobicContact CZ-CD1 4.17Å; F37-L52 HydrophobicContact CZ-CD2 4.18Å; F37-L52 HydrophobicContact CZ-CG 4.48Å; I48-L52 HydrophobicContact CB-CD1 3.81Å; I48-L52 HydrophobicContact CD1-CD1 4.09Å; I48-L52 HydrophobicContact CG2-CB 4.47Å; I48-L52 HydrophobicContact CG2-CD1 3.11Å; I48-L52 HydrophobicContact CG2-CG 3.52Å; S49-L52 PolarHBondContact O-N 3.22Å; E50-L52 PolarHBondContact O-N 2.66Å; L52-F54 PolarHBondContact O-N 3.21Å; L52-V55 HydrophobicContact CD2-CB 4.38Å; L52-V55 HydrophobicContact CD2-CG2 3.61Å; L52-V55 WeakPolarHBondContact O-CB 3.19Å; L52-V55 PolarHBondContact O-N 3.21Å; L52-L58 HydrophobicContact CD1-CD1 3.78Å; L52-L58 HydrophobicContact CD1-CD2 4.5Å; L52-Y75 HydrophobicContact CB-CD1 4.14Å; L52-Y75 HydrophobicContact CB-CE1 3.5Å; L52-Y75 VanDerWaalsContact CB-CE1 3.5Å; L52-Y75 HydrophobicContact CD1-CE1 4.48Å; L52-Y75 VanDerWaalsContact O-CD1 3.28Å; L52-Y75 WeakPolarHBondContact O-CD1 3.22Å
53	K	76.1	Confident	75.4	Confident	65 Å²	65	54 Å²	54	28%	0.283	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-55.6	-22.4	179.5	-69.7	173.7	178.4	173.7	0	112.8	E50 T51	E50-K53 HydrophobicContact CB-CD 4.33Å; E50-K53 VanDerWaalsContact O-CB 3.31Å; E50-K53 WeakPolarHBondContact O-CB 3.47Å; E50-K53 VanDerWaalsContact O-CG 3.28Å; E50-K53 WeakPolarHBondContact O-CG 3.18Å; E50-K53 PolarHBondContact O-N 3.12Å; E50-K53 VanDerWaalsContact O-N 3.12Å; E50-K53 IonicContact OE1-NZ 3.36Å; E50-K53 PolarHBondContact OE1-NZ 2.95Å; T51-K53 VanDerWaalsContact C-N 3.26Å; T51-K53 PolarHBondContact O-N 3.3Å
54	F	78.7	Confident	75.5	Confident	157 Å²	157	50.4 Å²	50.4	69%	0.689	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-101.5	4.7	-178.7	-53.8	-74.7	0	0	0	114.5	L52 L77	L52-F54 PolarHBondContact O-N 3.21Å; F54-L77 HydrophobicContact CB-CD1 4.44Å; F54-L77 HydrophobicContact CD1-CD1 4.43Å
55	V	81.8	Confident	75.9	Confident	14 Å²	14	47.2 Å²	47.2	9%	0.085	23%	0.231	C	C	.	.			trans	-81.7	131.2	-176.5	166.7	0	0	0	0	111.2	L52 H57 L58 L78	L52-V55 HydrophobicContact CD2-CB 4.38Å; L52-V55 HydrophobicContact CD2-CG2 3.61Å; L52-V55 WeakPolarHBondContact O-CB 3.19Å; L52-V55 PolarHBondContact O-N 3.21Å; V55-H57 WeakPolarHBondContact CG1-O 3.14Å; V55-L58 HydrophobicContact CG1-CB 4.47Å; V55-L78 WeakPolarHBondContact O-CA 3.45Å; V55-L78 PolarHBondContact O-N 3.31Å
56	E	88.3	Confident	76.5	Confident	109 Å²	109	50 Å²	50	51%	0.509	25%	0.248	S	C	.	.	S	Bend	trans	-85.4	-27.6	173.9	-62.6	-175.6	-175.3	0	0	112.9	L77 T79 T80	E56-L77 WeakPolarHBondContact CA-O 3.31Å; E56-L77 HydrophobicContact CG-CB 4.4Å; E56-T79 PolarHBondContact O-N 2.02Å; E56-T79 PolarHBondContact O-OG1 3.45Å; E56-T80 PolarHBondContact O-N 3.43Å
57	H	85.3	Confident	77.2	Confident	99 Å²	99	50.4 Å²	50.4	46%	0.458	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	111.9	-176	-57.9	-40.7	0	0	0	110.7	V55 T79 T80	V55-H57 WeakPolarHBondContact CG1-O 3.14Å; H57-T79 PolarHBondContact CE1-OG1 3.1Å; H57-T79 VanDerWaalsContact CE1-OG1 3.27Å; H57-T79 PolarHBondContact ND1-OG1 3.36Å; H57-T80 WeakPolarHBondContact CA-O 3.2Å; H57-T80 VanDerWaalsContact ND1-CB 3.32Å; H57-T80 WeakPolarHBondContact ND1-CB 3.38Å; H57-T80 PolarHBondContact ND1-OG1 3.36Å; H57-T80 VanDerWaalsContact ND1-OG1 3.16Å
58	L	88.4	Confident	78.8	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	106.5	178.8	-176	56.3	0	0	0	109.8	G35 F37 L52 V55 L60 L78 T80 L81 D82	G35-L58 CarbonylContact O-C 3.42Å; G35-L58 WeakPolarHBondContact O-CA 3.46Å; G35-L58 WeakPolarHBondContact O-CD1 3.42Å; F37-L58 HydrophobicContact CD2-CD1 3.82Å; F37-L58 HydrophobicContact CE2-CD1 3.96Å; L52-L58 HydrophobicContact CD1-CD1 3.78Å; L52-L58 HydrophobicContact CD1-CD2 4.5Å; V55-L58 HydrophobicContact CG1-CB 4.47Å; L58-L60 HydrophobicContact CD1-CD1 4.34Å; L58-L60 HydrophobicContact CD1-CG 4.12Å; L58-L60 HydrophobicContact CD2-CD1 3.82Å; L58-L60 HydrophobicContact CD2-CG 4.47Å; L58-L60 HydrophobicContact CG-CD1 3.84Å; L58-L60 HydrophobicContact CG-CG 3.98Å; L58-L78 HydrophobicContact CB-CD1 3.47Å; L58-L78 VanDerWaalsContact CB-CD1 3.47Å; L58-L78 HydrophobicContact CB-CD2 4.47Å; L58-T80 PolarHBondContact N-O 3.45Å; L58-L81 HydrophobicContact CB-CD1 4.05Å; L58-L81 HydrophobicContact CD2-CD1 4.01Å; L58-L81 HydrophobicContact CG-CD1 4.06Å; L58-D82 PolarHBondContact O-N 3.16Å
59	D	83.2	Confident	80	Confident	19 Å²	19	48.4 Å²	48.4	10%	0.102	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	104.7	173.6	176	13.8	0	0	0	109.9	G35 F37 S38 S61	G35-D59 PolarHBondContact O-N 3.16Å; F37-D59 CarbonylContact C-O 3.5Å; F37-D59 WeakPolarHBondContact CA-O 3.27Å; F37-D59 PolarHBondContact N-O 3.41Å; S38-D59 VanDerWaalsContact CB-OD2 3.27Å; S38-D59 WeakPolarHBondContact CB-OD2 3.41Å; S38-D59 PolarHBondContact N-O 3.21Å; S38-D59 PolarHBondContact OG-OD2 3.29Å; D59-S61 WeakPolarHBondContact OD1-CB 3.45Å; D59-S61 PolarHBondContact OD1-N 2.97Å; D59-S61 PolarHBondContact OD1-OG 3.32Å
60	L	87.1	Confident	81.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.265	C	S	.	.			trans	-110.2	19	174.5	-73.1	163.5	0	0	0	111.1	F37 L42 F45 I48 L58 N63 I65 L81 D82 L83 N86	F37-L60 HydrophobicContact CB-CD2 3.81Å; F37-L60 HydrophobicContact CD2-CD2 4.26Å; F37-L60 HydrophobicContact CG-CD2 4.26Å; L42-L60 HydrophobicContact CD1-CD2 3.91Å; F45-L60 HydrophobicContact CB-CD2 4.33Å; F45-L60 HydrophobicContact CD1-CD1 4.07Å; F45-L60 HydrophobicContact CD2-CD1 3.91Å; F45-L60 HydrophobicContact CE1-CD1 3.96Å; F45-L60 HydrophobicContact CE2-CD1 3.8Å; F45-L60 HydrophobicContact CG-CD1 4.01Å; F45-L60 HydrophobicContact CZ-CD1 3.77Å; I48-L60 HydrophobicContact CD1-CD2 3.95Å; L58-L60 HydrophobicContact CD1-CD1 4.34Å; L58-L60 HydrophobicContact CD1-CG 4.12Å; L58-L60 HydrophobicContact CD2-CD1 3.82Å; L58-L60 HydrophobicContact CD2-CG 4.47Å; L58-L60 HydrophobicContact CG-CD1 3.84Å; L58-L60 HydrophobicContact CG-CG 3.98Å; L60-N63 VanDerWaalsContact C-ND2 3.33Å; L60-N63 PolarHBondContact O-ND2 3.03Å; L60-I65 HydrophobicContact CB-CD1 3.8Å; L60-I65 HydrophobicContact CD1-CD1 4.36Å; L60-I65 HydrophobicContact CD2-CD1 4Å; L60-I65 HydrophobicContact CG-CD1 4.28Å; L60-L81 HydrophobicContact CD1-CD1 4.35Å; L60-D82 CarbonylContact C-O 3.46Å; L60-D82 WeakPolarHBondContact CA-O 3.42Å; L60-D82 WeakPolarHBondContact CB-O 3.33Å; L60-D82 PolarHBondContact N-O 3.47Å; L60-L83 HydrophobicContact CB-CD2 3.9Å; L60-L83 HydrophobicContact CD1-CD2 3.83Å; L60-N86 PolarHBondContact O-ND2 3.36Å
61	S	80.9	Confident	82.5	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.042	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	156.6	-173.6	67.4	0	0	0	0	113.2	S38 N39 D59 N63 D82 S84	S38-S61 CarbonylContact C-O 3.2Å; S38-S61 WeakPolarHBondContact CA-O 3.43Å; S38-S61 WeakPolarHBondContact CB-OG 3.42Å; N39-S61 PolarHBondContact N-O 3.18Å; D59-S61 WeakPolarHBondContact OD1-CB 3.45Å; D59-S61 PolarHBondContact OD1-N 2.97Å; D59-S61 PolarHBondContact OD1-OG 3.32Å; S61-N63 VanDerWaalsContact C-N 3.27Å; S61-N63 PolarHBondContact O-N 3.44Å; S61-N63 PolarHBondContact O-ND2 3.31Å; S61-D82 PolarHBondContact N-O 2.97Å; S61-S84 CarbonylContact C-O 3.47Å; S61-S84 WeakPolarHBondContact CA-O 3.42Å; S61-S84 VanDerWaalsContact CB-O 3.3Å; S61-S84 WeakPolarHBondContact CB-O 3.45Å
62	R	76.8	Confident	83.7	Confident	68 Å²	68	46 Å²	46	26%	0.257	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	33.2	176.5	-57.3	179.6	-177.6	-123	-0.8	114.2	N39 S84 F85 E680	N39-R62 WeakPolarHBondContact CA-O 3.42Å; N39-R62 HydrophobicContact CB-CB 4.13Å; R62-S84 PolarHBondContact N-O 2.79Å; R62-F85 VanDerWaalsContact CA-O 3.27Å; R62-F85 WeakPolarHBondContact CA-O 3.38Å; R62-F85 HydrophobicContact CB-CB 4.31Å; R62-F85 HydrophobicContact CG-CB 3.66Å; R62-F85 HydrophobicContact CG-CD2 4.26Å; R62-F85 HydrophobicContact CG-CG 4.07Å; R62-E680 IonicContact CZ-OE1 2.74Å; R62-E680 IonicContact NH1-OE1 3.28Å; R62-E680 PolarHBondContact NH1-OE1 3.16Å; R62-E680 IonicContact NH2-OE1 3.47Å; R62-E680 PolarHBondContact NH2-OE1 3.18Å
63	N	79.9	Confident	84.5	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	25%	0.245	C	C	.	.	S	Bend	trans	-102.9	-170.2	172.8	-75.7	-61.9	0	0	0	110.6	F37 C40 R41 L42 L60 S61 I65 N86	F37-N63 PolarHBondContact O-ND2 3.03Å; C40-N63 VanDerWaalsContact C-OD1 3.29Å; C40-N63 WeakPolarHBondContact CA-OD1 2.99Å; C40-N63 PolarHBondContact N-OD1 3.15Å; R41-N63 PolarHBondContact N-OD1 3.36Å; L42-N63 HydrophobicContact CB-CB 4.06Å; L42-N63 PolarHBondContact N-OD1 3.43Å; L42-N63 WeakPolarHBondContact O-CB 3.29Å; L60-N63 VanDerWaalsContact C-ND2 3.33Å; L60-N63 PolarHBondContact O-ND2 3.03Å; S61-N63 VanDerWaalsContact C-N 3.27Å; S61-N63 PolarHBondContact O-N 3.44Å; S61-N63 PolarHBondContact O-ND2 3.31Å; N63-I65 HydrophobicContact CB-CD1 4.02Å; N63-I65 HydrophobicContact CB-CG1 3.94Å; N63-N86 WeakPolarHBondContact CA-OD1 3.41Å; N63-N86 WeakPolarHBondContact CB-OD1 3.48Å; N63-N86 PolarHBondContact N-OD1 2.8Å; N63-N86 PolarHBondContact O-OD1 3.02Å; N63-N86 VanDerWaalsContact O-OD1 3.12Å
64	F	81.7	Confident	85	Confident	100 Å²	100	50.3 Å²	50.3	44%	0.439	25%	0.251	S	S	.	.			trans	-107.1	26.4	173.8	-61	-58.7	0	0	0	111.6	R41 L42 R43 T66	R41-F64 HydrophobicContact CB-CD2 3.74Å; R41-F64 HydrophobicContact CB-CE2 3.61Å; R41-F64 HydrophobicContact CG-CE2 4.11Å; L42-F64 CarbonylContact O-C 3.22Å; L42-F64 VanDerWaalsContact O-CA 3.27Å; L42-F64 WeakPolarHBondContact O-CA 3.5Å; L42-F64 PolarHBondContact O-N 2.98Å; R43-F64 HydrophobicContact CG-CB 4.01Å; F64-T66 PolarHBondContact O-N 2.9Å
65	I	87.7	Confident	85.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.			trans	-65.1	125.7	-176.8	-62.4	165.4	0	0	0	108.4	L42 F45 L60 N63 N67 N86 K87 I88	L42-I65 HydrophobicContact CB-CG1 4.35Å; L42-I65 PolarHBondContact O-N 3.12Å; F45-I65 HydrophobicContact CD1-CD1 3.77Å; F45-I65 HydrophobicContact CD1-CG1 4.22Å; F45-I65 HydrophobicContact CD1-CG2 3.91Å; F45-I65 HydrophobicContact CE1-CD1 4.16Å; F45-I65 HydrophobicContact CE1-CG2 3.8Å; L60-I65 HydrophobicContact CB-CD1 3.8Å; L60-I65 HydrophobicContact CD1-CD1 4.36Å; L60-I65 HydrophobicContact CD2-CD1 4Å; L60-I65 HydrophobicContact CG-CD1 4.28Å; N63-I65 HydrophobicContact CB-CD1 4.02Å; N63-I65 HydrophobicContact CB-CG1 3.94Å; I65-N67 VanDerWaalsContact CG2-O 3.26Å; I65-N67 WeakPolarHBondContact CG2-O 3.26Å; I65-N86 HydrophobicContact CB-CB 4.29Å; I65-N86 VanDerWaalsContact CB-OD1 3.32Å; I65-N86 WeakPolarHBondContact CB-OD1 3.36Å; I65-N86 PolarHBondContact N-OD1 3.1Å; I65-K87 CarbonylContact O-C 3.44Å; I65-K87 VanDerWaalsContact O-C 3.25Å; I65-K87 WeakPolarHBondContact O-CA 3.38Å; I65-K87 PolarHBondContact O-N 3.29Å; I65-I88 HydrophobicContact CG2-CD1 4.3Å; I65-I88 HydrophobicContact CG2-CG1 4.18Å; I65-I88 WeakPolarHBondContact O-CG1 3.28Å; I65-I88 PolarHBondContact O-N 2.74Å
66	T	90.4	Very high	85.8	Confident	59 Å²	59	51.2 Å²	51.2	36%	0.362	25%	0.248	S	C	.	.			trans	-102.6	-30.8	179.2	51.5	0	0	0	0	112.3	F64 K87 I88 F89	F64-T66 PolarHBondContact O-N 2.9Å; T66-K87 HydrophobicContact CG2-CB 3.98Å; T66-I88 WeakPolarHBondContact O-CA 3.34Å; T66-F89 WeakPolarHBondContact O-CE1 3.1Å
67	N	88.2	Confident	85.9	Confident	70 Å²	70	49.9 Å²	49.9	37%	0.374	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-136.1	142.4	179.9	-66.1	-48.6	0	0	0	109.8	I65 F89	I65-N67 VanDerWaalsContact CG2-O 3.26Å; I65-N67 WeakPolarHBondContact CG2-O 3.26Å; N67-F89 WeakPolarHBondContact OD1-CE1 3.28Å; N67-F89 WeakPolarHBondContact OD1-CZ 3.46Å
68	V	90.9	Very high	86.2	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.042	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-81.6	130.8	163.6	170.3	0	0	0	0	107.3	F45 I72 L83 I88 L91 P92 L95	F45-V68 HydrophobicContact CE1-CB 4.39Å; F45-V68 HydrophobicContact CE1-CG2 4.17Å; F45-V68 HydrophobicContact CZ-CB 4.17Å; F45-V68 HydrophobicContact CZ-CG1 3.85Å; F45-V68 HydrophobicContact CZ-CG2 4.07Å; V68-I72 HydrophobicContact CG1-CB 4.24Å; V68-I72 HydrophobicContact CG1-CD1 3.63Å; V68-I72 HydrophobicContact CG1-CG1 4.49Å; V68-I72 HydrophobicContact CG1-CG2 4.07Å; V68-L83 HydrophobicContact CG2-CD1 3.68Å; V68-L83 HydrophobicContact CG2-CD2 4.39Å; V68-I88 HydrophobicContact CG2-CD1 4.21Å; V68-L91 HydrophobicContact CG2-CD2 4.21Å; V68-P92 HydrophobicContact CB-CG 3.94Å; V68-P92 HydrophobicContact CG1-CG 3.79Å; V68-P92 WeakPolarHBondContact O-CG 3.32Å; V68-L95 HydrophobicContact CG1-CD1 4.1Å; V68-L95 HydrophobicContact CG2-CD1 4.22Å
69	P	86	Confident	86.5	Confident	19 Å²	19	46.4 Å²	46.4	12%	0.123	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-67.8	150.1	-179	28.4	-34.1	0	0	0	112.2	F45 S46	F45-P69 HydrophobicContact CD1-CG 4.49Å; F45-P69 HydrophobicContact CD2-CG 3.79Å; F45-P69 HydrophobicContact CE1-CG 4.42Å; F45-P69 VanDerWaalsContact CE2-CD 3.44Å; F45-P69 HydrophobicContact CE2-CG 3.72Å; F45-P69 HydrophobicContact CG-CG 4.22Å; F45-P69 HydrophobicContact CZ-CG 4.09Å; S46-P69 WeakPolarHBondContact OG-CB 3.35Å
70	N	83.7	Confident	87	Confident	139 Å²	139	46 Å²	46	74%	0.743	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	141	165.4	-67.4	-24.4	0	0	0	108.8	P92	N70-P92 WeakPolarHBondContact OD1-CB 3.38Å
71	G	84.5	Confident	87.4	Confident	26 Å²	26	46 Å²	46	27%	0.268	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	100.2	-3.2	-175.5	0	0	0	0	0	114.9	E73 Q74	G71-E73 WeakPolarHBondContact CA-OE2 3.41Å; G71-E73 PolarHBondContact N-OE2 3Å; G71-E73 VanDerWaalsContact N-OE2 3.09Å; G71-E73 PolarHBondContact O-N 3.2Å; G71-E73 VanDerWaalsContact O-N 3.08Å; G71-Q74 WeakPolarHBondContact O-CB 3.18Å; G71-Q74 WeakPolarHBondContact O-CG 3.11Å; G71-Q74 PolarHBondContact O-N 2.92Å; G71-Q74 VanDerWaalsContact O-N 3.08Å
72	I	88.3	Confident	87.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-57.7	-22	176	-163.3	174.7	0	0	0	112.5	F45 V68 Q74 Y75 L81 L95 L98	F45-I72 HydrophobicContact CE2-CD1 4Å; F45-I72 HydrophobicContact CZ-CD1 4.09Å; V68-I72 HydrophobicContact CG1-CB 4.24Å; V68-I72 HydrophobicContact CG1-CD1 3.63Å; V68-I72 HydrophobicContact CG1-CG1 4.49Å; V68-I72 HydrophobicContact CG1-CG2 4.07Å; I72-Q74 PolarHBondContact O-N 3.39Å; I72-Y75 HydrophobicContact CB-CD2 4.29Å; I72-Y75 HydrophobicContact CB-CE2 4.41Å; I72-Y75 HydrophobicContact CG1-CD2 3.52Å; I72-Y75 HydrophobicContact CG1-CE2 3.82Å; I72-Y75 WeakPolarHBondContact O-CD2 3.13Å; I72-Y75 PolarHBondContact O-N 3.09Å; I72-Y75 VanDerWaalsContact O-N 3.1Å; I72-L81 HydrophobicContact CD1-CD2 3.81Å; I72-L95 VanDerWaalsContact CG2-CA 3.48Å; I72-L95 HydrophobicContact CG2-CB 3.96Å; I72-L98 HydrophobicContact CG1-CD1 4.49Å; I72-L98 WeakPolarHBondContact O-CD2 3.33Å
73	E	87.7	Confident	88.7	Confident	72 Å²	72	43 Å²	43	34%	0.336	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-58.2	-16.7	174.2	67.6	-90.7	-142.8	0	0	114.1	G71 Y75 S94 K97	G71-E73 WeakPolarHBondContact CA-OE2 3.41Å; G71-E73 PolarHBondContact N-OE2 3Å; G71-E73 VanDerWaalsContact N-OE2 3.09Å; G71-E73 PolarHBondContact O-N 3.2Å; G71-E73 VanDerWaalsContact O-N 3.08Å; E73-Y75 PolarHBondContact O-N 3.42Å; E73-S94 WeakPolarHBondContact OE2-CB 3.35Å; E73-K97 HydrophobicContact CB-CB 3.92Å
74	Q	86.2	Confident	89.2	Confident	85 Å²	85	43.1 Å²	43.1	40%	0.397	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-67.4	-20.3	175.8	76.1	-173.6	-23.4	0	0	113.6	G71 I72 R76	G71-Q74 WeakPolarHBondContact O-CB 3.18Å; G71-Q74 WeakPolarHBondContact O-CG 3.11Å; G71-Q74 PolarHBondContact O-N 2.92Å; G71-Q74 VanDerWaalsContact O-N 3.08Å; I72-Q74 PolarHBondContact O-N 3.39Å; Q74-R76 PolarHBondContact O-N 3.4Å
75	Y	88.2	Confident	89.4	Confident	6 Å²	6	42.4 Å²	42.4	2%	0.024	21%	0.214	C	C	.	.			trans	-78.4	66.8	177.7	-56.8	-69.1	0	0	0	110.7	L52 I72 E73 L77 L78	L52-Y75 HydrophobicContact CB-CD1 4.14Å; L52-Y75 HydrophobicContact CB-CE1 3.5Å; L52-Y75 VanDerWaalsContact CB-CE1 3.5Å; L52-Y75 HydrophobicContact CD1-CE1 4.48Å; L52-Y75 VanDerWaalsContact O-CD1 3.28Å; L52-Y75 WeakPolarHBondContact O-CD1 3.22Å; I72-Y75 HydrophobicContact CB-CD2 4.29Å; I72-Y75 HydrophobicContact CB-CE2 4.41Å; I72-Y75 HydrophobicContact CG1-CD2 3.52Å; I72-Y75 HydrophobicContact CG1-CE2 3.82Å; I72-Y75 WeakPolarHBondContact O-CD2 3.13Å; I72-Y75 PolarHBondContact O-N 3.09Å; I72-Y75 VanDerWaalsContact O-N 3.1Å; E73-Y75 PolarHBondContact O-N 3.42Å; Y75-L77 VanDerWaalsContact C-N 3.26Å; Y75-L77 PolarHBondContact O-N 3.41Å; Y75-L78 WeakPolarHBondContact O-CB 3.34Å; Y75-L78 PolarHBondContact O-N 3.12Å
76	R	88.4	Confident	89.4	Confident	184 Å²	184	42.4 Å²	42.4	69%	0.694	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.9	-170.2	-65.6	-176.7	179.1	179.7	0.8	114.4	Q74 P99 S100	Q74-R76 PolarHBondContact O-N 3.4Å; R76-P99 HydrophobicContact CB-CG 4.26Å; R76-P99 HydrophobicContact CG-CG 4.47Å; R76-S100 WeakPolarHBondContact O-CB 3.47Å; R76-S100 PolarHBondContact O-OG 3.05Å
77	L	90.2	Very high	89.5	Confident	81 Å²	81	43.2 Å²	43.2	42%	0.424	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.3	178.1	-59.7	-173	0	0	0	113.2	F54 E56 Y75 T79	F54-L77 HydrophobicContact CB-CD1 4.44Å; F54-L77 HydrophobicContact CD1-CD1 4.43Å; E56-L77 WeakPolarHBondContact CA-O 3.31Å; E56-L77 HydrophobicContact CG-CB 4.4Å; Y75-L77 VanDerWaalsContact C-N 3.26Å; Y75-L77 PolarHBondContact O-N 3.41Å; L77-T79 PolarHBondContact O-N 3.27Å; L77-T79 VanDerWaalsContact O-N 3.1Å
78	L	92.5	Very high	89.8	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.195	C	C	.	.			trans	-66.5	113.4	-173.9	-167.8	67	0	0	0	111.1	V55 L58 Y75 T80 L81 L98 S100 L101	V55-L78 WeakPolarHBondContact O-CA 3.45Å; V55-L78 PolarHBondContact O-N 3.31Å; L58-L78 HydrophobicContact CB-CD1 3.47Å; L58-L78 VanDerWaalsContact CB-CD1 3.47Å; L58-L78 HydrophobicContact CB-CD2 4.47Å; Y75-L78 WeakPolarHBondContact O-CB 3.34Å; Y75-L78 PolarHBondContact O-N 3.12Å; L78-T80 WeakPolarHBondContact CD1-O 3.31Å; L78-L81 HydrophobicContact CD2-CB 4.04Å; L78-L81 HydrophobicContact CD2-CD1 4.3Å; L78-L81 HydrophobicContact CD2-CD2 4.31Å; L78-L81 HydrophobicContact CD2-CG 4.45Å; L78-L98 HydrophobicContact CB-CD2 4.41Å; L78-L98 HydrophobicContact CD2-CD1 4.11Å; L78-L98 HydrophobicContact CD2-CD2 4.26Å; L78-S100 CarbonylContact O-C 3.16Å; L78-S100 VanDerWaalsContact O-C 3.22Å; L78-L101 HydrophobicContact CD2-CD1 4.42Å; L78-L101 HydrophobicContact CG-CD1 4.26Å; L78-L101 VanDerWaalsContact O-CA 3.32Å; L78-L101 WeakPolarHBondContact O-CA 3.41Å; L78-L101 PolarHBondContact O-N 3.49Å
79	T	94.8	Very high	90	Very high	28 Å²	28	44.5 Å²	44.5	17%	0.172	22%	0.215	C	C	.	.			trans	-102	-29.6	177.4	63	0	0	0	0	112.3	E56 H57 L77 S100 R102 I103	E56-T79 PolarHBondContact O-N 2.02Å; E56-T79 PolarHBondContact O-OG1 3.45Å; H57-T79 PolarHBondContact CE1-OG1 3.1Å; H57-T79 VanDerWaalsContact CE1-OG1 3.27Å; H57-T79 PolarHBondContact ND1-OG1 3.36Å; L77-T79 PolarHBondContact O-N 3.27Å; L77-T79 VanDerWaalsContact O-N 3.1Å; T79-S100 WeakPolarHBondContact CA-O 3.45Å; T79-R102 WeakPolarHBondContact O-CA 3.23Å; T79-R102 PolarHBondContact O-N 2.87Å; T79-I103 PolarHBondContact O-N 3.34Å
80	T	93.8	Very high	90.4	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.8	179.1	-56.2	0	0	0	0	110.2	E56 H57 L58 L78 I103 I672	E56-T80 PolarHBondContact O-N 3.43Å; H57-T80 WeakPolarHBondContact CA-O 3.2Å; H57-T80 VanDerWaalsContact ND1-CB 3.32Å; H57-T80 WeakPolarHBondContact ND1-CB 3.38Å; H57-T80 PolarHBondContact ND1-OG1 3.36Å; H57-T80 VanDerWaalsContact ND1-OG1 3.16Å; L58-T80 PolarHBondContact N-O 3.45Å; L78-T80 WeakPolarHBondContact CD1-O 3.31Å; T80-I103 WeakPolarHBondContact CA-O 3.24Å; T80-I103 HydrophobicContact CG2-CB 3.99Å; T80-I103 HydrophobicContact CG2-CG2 3.99Å; T80-I672 HydrophobicContact CG2-CD1 4.41Å
81	L	94.8	Very high	90.9	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	116	173.8	178	55.7	0	0	0	109.6	L58 L60 I72 L78 L83 L95 L98 L101 I103 L104 L105	L58-L81 HydrophobicContact CB-CD1 4.05Å; L58-L81 HydrophobicContact CD2-CD1 4.01Å; L58-L81 HydrophobicContact CG-CD1 4.06Å; L60-L81 HydrophobicContact CD1-CD1 4.35Å; I72-L81 HydrophobicContact CD1-CD2 3.81Å; L78-L81 HydrophobicContact CD2-CB 4.04Å; L78-L81 HydrophobicContact CD2-CD1 4.3Å; L78-L81 HydrophobicContact CD2-CD2 4.31Å; L78-L81 HydrophobicContact CD2-CG 4.45Å; L81-L83 HydrophobicContact CD1-CD1 4.44Å; L81-L83 HydrophobicContact CD1-CD2 4.33Å; L81-L83 HydrophobicContact CD1-CG 4.06Å; L81-L83 HydrophobicContact CD2-CD1 3.93Å; L81-L83 HydrophobicContact CD2-CG 4.42Å; L81-L83 HydrophobicContact CG-CD1 4.04Å; L81-L83 HydrophobicContact CG-CG 4.01Å; L81-L95 HydrophobicContact CD2-CD1 3.95Å; L81-L98 HydrophobicContact CD2-CD1 4.33Å; L81-L101 HydrophobicContact CB-CD1 3.8Å; L81-I103 PolarHBondContact N-O 2.98Å; L81-L104 HydrophobicContact CB-CD1 4.06Å; L81-L104 HydrophobicContact CD2-CD1 3.94Å; L81-L104 HydrophobicContact CG-CD1 4.05Å; L81-L105 PolarHBondContact O-N 2.94Å
82	D	91.6	Very high	91.4	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.07	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.7	174.1	-162.9	-14.9	0	0	0	111.2	L58 L60 S61 S84 L105	L58-D82 PolarHBondContact O-N 3.16Å; L60-D82 CarbonylContact C-O 3.46Å; L60-D82 WeakPolarHBondContact CA-O 3.42Å; L60-D82 WeakPolarHBondContact CB-O 3.33Å; L60-D82 PolarHBondContact N-O 3.47Å; S61-D82 PolarHBondContact N-O 2.97Å; D82-S84 WeakPolarHBondContact OD1-CB 3.36Å; D82-S84 PolarHBondContact OD1-N 3.39Å; D82-S84 PolarHBondContact OD1-OG 3.24Å; D82-L105 HydrophobicContact CB-CB 4.22Å; D82-L105 HydrophobicContact CB-CD1 3.99Å; D82-L105 HydrophobicContact CB-CG 4.45Å; D82-L105 WeakPolarHBondContact OD1-CB 3.11Å
83	L	94.3	Very high	91.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.			trans	-116	16.5	175.8	-66.6	165.2	0	0	0	110.9	F45 L60 V68 L81 N86 I88 L95 L105 M106 N109	F45-L83 HydrophobicContact CE1-CD2 4.21Å; F45-L83 HydrophobicContact CZ-CD2 4.29Å; L60-L83 HydrophobicContact CB-CD2 3.9Å; L60-L83 HydrophobicContact CD1-CD2 3.83Å; V68-L83 HydrophobicContact CG2-CD1 3.68Å; V68-L83 HydrophobicContact CG2-CD2 4.39Å; L81-L83 HydrophobicContact CD1-CD1 4.44Å; L81-L83 HydrophobicContact CD1-CD2 4.33Å; L81-L83 HydrophobicContact CD1-CG 4.06Å; L81-L83 HydrophobicContact CD2-CD1 3.93Å; L81-L83 HydrophobicContact CD2-CG 4.42Å; L81-L83 HydrophobicContact CG-CD1 4.04Å; L81-L83 HydrophobicContact CG-CG 4.01Å; L83-N86 WeakPolarHBondContact O-CB 3.48Å; L83-N86 PolarHBondContact O-ND2 3.32Å; L83-I88 HydrophobicContact CB-CD1 3.74Å; L83-I88 HydrophobicContact CD1-CD1 4Å; L83-I88 HydrophobicContact CD2-CD1 4.03Å; L83-I88 HydrophobicContact CG-CD1 4.15Å; L83-L95 HydrophobicContact CD1-CD1 4.26Å; L83-L105 CarbonylContact C-O 3Å; L83-L105 WeakPolarHBondContact CA-O 3.49Å; L83-L105 PolarHBondContact N-O 3.48Å; L83-M106 HydrophobicContact CB-CG 4.21Å; L83-M106 HydrophobicContact CD1-CG 4.38Å; L83-M106 HydrophobicContact CD1-SD 4.42Å; L83-N109 PolarHBondContact O-ND2 3.01Å
84	S	88.8	Confident	91.9	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.028	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	153.1	-175.9	-56.2	0	0	0	0	112.3	S61 R62 D82 N86 L105 S107	S61-S84 CarbonylContact C-O 3.47Å; S61-S84 WeakPolarHBondContact CA-O 3.42Å; S61-S84 VanDerWaalsContact CB-O 3.3Å; S61-S84 WeakPolarHBondContact CB-O 3.45Å; R62-S84 PolarHBondContact N-O 2.79Å; D82-S84 WeakPolarHBondContact OD1-CB 3.36Å; D82-S84 PolarHBondContact OD1-N 3.39Å; D82-S84 PolarHBondContact OD1-OG 3.24Å; S84-N86 VanDerWaalsContact C-N 3.31Å; S84-N86 PolarHBondContact O-N 3.19Å; S84-N86 PolarHBondContact O-ND2 3.01Å; S84-L105 PolarHBondContact N-O 3.32Å; S84-S107 CarbonylContact C-O 3.47Å; S84-S107 WeakPolarHBondContact CA-O 3.33Å; S84-S107 VanDerWaalsContact CB-OG 3.27Å; S84-S107 WeakPolarHBondContact CB-OG 3.49Å; S84-S107 PolarHBondContact OG-N 2.85Å; S84-S107 PolarHBondContact OG-OG 3.05Å
85	F	86.3	Confident	92.3	Very high	85 Å²	85	37.3 Å²	37.3	37%	0.373	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	39.8	178.7	-59.8	-90.8	0	0	0	113.9	R62 S107 N108	R62-F85 VanDerWaalsContact CA-O 3.27Å; R62-F85 WeakPolarHBondContact CA-O 3.38Å; R62-F85 HydrophobicContact CB-CB 4.31Å; R62-F85 HydrophobicContact CG-CB 3.66Å; R62-F85 HydrophobicContact CG-CD2 4.26Å; R62-F85 HydrophobicContact CG-CG 4.07Å; F85-S107 PolarHBondContact N-O 3.18Å; F85-N108 VanDerWaalsContact CA-O 3.31Å; F85-N108 WeakPolarHBondContact CA-O 3.31Å; F85-N108 HydrophobicContact CB-CB 4.44Å; F85-N108 HydrophobicContact CD1-CB 3.54Å; F85-N108 HydrophobicContact CD2-CB 4.4Å; F85-N108 HydrophobicContact CE1-CB 3.77Å; F85-N108 VanDerWaalsContact CE1-CG 3.45Å; F85-N108 WeakPolarHBondContact CE1-ND2 3.21Å; F85-N108 HydrophobicContact CG-CB 3.88Å; F85-N108 HydrophobicContact CZ-CB 4.28Å; F85-N108 WeakPolarHBondContact CZ-ND2 3.37Å; F85-N108 PolarHBondContact N-O 3.46Å
86	N	88.4	Confident	92.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.179	C	C	.	.	S	Bend	trans	-107.9	-159.8	173.6	-84.3	-73.7	0	0	0	110.6	L60 N63 I65 L83 S84 I88 N108 N109	L60-N86 PolarHBondContact O-ND2 3.36Å; N63-N86 WeakPolarHBondContact CA-OD1 3.41Å; N63-N86 WeakPolarHBondContact CB-OD1 3.48Å; N63-N86 PolarHBondContact N-OD1 2.8Å; N63-N86 PolarHBondContact O-OD1 3.02Å; N63-N86 VanDerWaalsContact O-OD1 3.12Å; I65-N86 HydrophobicContact CB-CB 4.29Å; I65-N86 VanDerWaalsContact CB-OD1 3.32Å; I65-N86 WeakPolarHBondContact CB-OD1 3.36Å; I65-N86 PolarHBondContact N-OD1 3.1Å; L83-N86 WeakPolarHBondContact O-CB 3.48Å; L83-N86 PolarHBondContact O-ND2 3.32Å; S84-N86 VanDerWaalsContact C-N 3.31Å; S84-N86 PolarHBondContact O-N 3.19Å; S84-N86 PolarHBondContact O-ND2 3.01Å; N86-I88 HydrophobicContact CB-CD1 4.17Å; N86-I88 HydrophobicContact CB-CG1 3.98Å; N86-N108 PolarHBondContact N-O 3.22Å; N86-N109 VanDerWaalsContact CA-OD1 3.29Å; N86-N109 WeakPolarHBondContact CA-OD1 3.17Å; N86-N109 WeakPolarHBondContact CB-OD1 3.07Å; N86-N109 PolarHBondContact N-OD1 2.68Å; N86-N109 PolarHBondContact O-OD1 3.04Å
87	K	92.2	Very high	92.9	Very high	76 Å²	76	34 Å²	34	33%	0.33	17%	0.171	S	C	.	.			trans	-122.2	28.2	178.8	-54.3	-64.4	165.3	-164.2	0	111.1	I65 T66 F89 N109 Y110	I65-K87 CarbonylContact O-C 3.44Å; I65-K87 VanDerWaalsContact O-C 3.25Å; I65-K87 WeakPolarHBondContact O-CA 3.38Å; I65-K87 PolarHBondContact O-N 3.29Å; T66-K87 HydrophobicContact CG2-CB 3.98Å; K87-F89 PolarHBondContact O-N 3.24Å; K87-N109 PolarHBondContact N-OD1 2.79Å; K87-Y110 HydrophobicContact CB-CD2 4.21Å; K87-Y110 HydrophobicContact CB-CE2 3.9Å; K87-Y110 HydrophobicContact CD-CD2 4.38Å; K87-Y110 HydrophobicContact CD-CE2 3.36Å; K87-Y110 WeakPolarHBondContact CD-OH 3.44Å; K87-Y110 HydrophobicContact CG-CE2 4.22Å; K87-Y110 PolarHBondContact NZ-OH 2.95Å; K87-Y110 VanDerWaalsContact NZ-OH 3.13Å
88	I	95.2	Very high	93.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.			trans	-73.1	127.9	-173.8	-56.6	172.2	0	0	0	109.9	I65 T66 V68 L83 N86 S90 L91 N109 Y110 L111	I65-I88 HydrophobicContact CG2-CD1 4.3Å; I65-I88 HydrophobicContact CG2-CG1 4.18Å; I65-I88 WeakPolarHBondContact O-CG1 3.28Å; I65-I88 PolarHBondContact O-N 2.74Å; T66-I88 WeakPolarHBondContact O-CA 3.34Å; V68-I88 HydrophobicContact CG2-CD1 4.21Å; L83-I88 HydrophobicContact CB-CD1 3.74Å; L83-I88 HydrophobicContact CD1-CD1 4Å; L83-I88 HydrophobicContact CD2-CD1 4.03Å; L83-I88 HydrophobicContact CG-CD1 4.15Å; N86-I88 HydrophobicContact CB-CD1 4.17Å; N86-I88 HydrophobicContact CB-CG1 3.98Å; I88-S90 WeakPolarHBondContact CG2-O 3.49Å; I88-L91 HydrophobicContact CG2-CD2 3.86Å; I88-N109 HydrophobicContact CB-CB 4.41Å; I88-N109 WeakPolarHBondContact CB-OD1 3.25Å; I88-N109 PolarHBondContact N-OD1 3.14Å; I88-Y110 CarbonylContact O-C 3.58Å; I88-Y110 VanDerWaalsContact O-C 3.3Å; I88-Y110 WeakPolarHBondContact O-CA 3.36Å; I88-Y110 PolarHBondContact O-N 3.35Å; I88-L111 HydrophobicContact CG2-CD2 3.94Å; I88-L111 PolarHBondContact O-N 3.23Å
89	F	94.9	Very high	93	Very high	104 Å²	104	33.5 Å²	33.5	46%	0.456	17%	0.172	S	C	.	.			trans	-113.6	-18.3	179.3	60.1	-90.9	0	0	0	113.6	T66 N67 K87	T66-F89 WeakPolarHBondContact O-CE1 3.1Å; N67-F89 WeakPolarHBondContact OD1-CE1 3.28Å; N67-F89 WeakPolarHBondContact OD1-CZ 3.46Å; K87-F89 PolarHBondContact O-N 3.24Å
90	S	93.9	Very high	93	Very high	48 Å²	48	34.1 Å²	34.1	34%	0.336	18%	0.177	S	C	.	.	B	Isolated β-bridge	trans	-149	155.7	174.3	55.9	0	0	0	0	111.6	I88	I88-S90 WeakPolarHBondContact CG2-O 3.49Å
91	L	94.6	Very high	93.2	Very high	16 Å²	16	33.7 Å²	33.7	8%	0.084	18%	0.175	C	C	.	.			trans	-113.3	141.7	175.2	-56.2	174	0	0	0	110.5	V68 I88 L95 M106 L111 L114 P115	V68-L91 HydrophobicContact CG2-CD2 4.21Å; I88-L91 HydrophobicContact CG2-CD2 3.86Å; L91-L95 HydrophobicContact CD2-CD1 4.27Å; L91-M106 HydrophobicContact CD1-CE 3.62Å; L91-M106 HydrophobicContact CD1-SD 3.48Å; L91-M106 WeakPolarHBondContact CD1-SD 3.46Å; L91-M106 HydrophobicContact CD2-SD 3.74Å; L91-M106 HydrophobicContact CG-SD 4.21Å; L91-L111 HydrophobicContact CD2-CD2 4.23Å; L91-L111 HydrophobicContact CG-CD2 3.95Å; L91-L114 HydrophobicContact CD1-CD2 3.63Å; L91-P115 HydrophobicContact CB-CG 4.26Å
92	P	94.2	Very high	93.4	Very high	18 Å²	18	39.8 Å²	39.8	12%	0.117	20%	0.198	C	C	.	.			trans	-78.3	153.1	174.3	35.6	-38.2	0	0	0	111.3	V68 N70 S94 L95	V68-P92 HydrophobicContact CB-CG 3.94Å; V68-P92 HydrophobicContact CG1-CG 3.79Å; V68-P92 WeakPolarHBondContact O-CG 3.32Å; N70-P92 WeakPolarHBondContact OD1-CB 3.38Å; P92-S94 VanDerWaalsContact CB-OG 3.27Å; P92-S94 WeakPolarHBondContact CB-OG 3.29Å; P92-S94 VanDerWaalsContact CG-OG 3.22Å; P92-S94 WeakPolarHBondContact CG-OG 3.36Å; P92-S94 PolarHBondContact O-N 3.24Å; P92-L95 HydrophobicContact CG-CB 4.37Å; P92-L95 WeakPolarHBondContact O-CB 3.45Å; P92-L95 PolarHBondContact O-N 3.19Å; P92-L95 VanDerWaalsContact O-N 3.14Å
93	N	94.1	Very high	93.6	Very high	97 Å²	97	41.3 Å²	41.3	52%	0.519	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-61.9	-23.6	176.4	-66.9	-9.4	0	0	0	112.7	L95 C96 P115 S117	N93-L95 VanDerWaalsContact C-N 3.28Å; N93-L95 PolarHBondContact O-N 2.89Å; N93-C96 WeakPolarHBondContact O-CB 3.28Å; N93-C96 PolarHBondContact O-N 3.29Å; N93-C96 VanDerWaalsContact O-N 3.12Å; N93-P115 VanDerWaalsContact OD1-CB 3.28Å; N93-P115 WeakPolarHBondContact OD1-CB 3.38Å; N93-S117 PolarHBondContact OD1-OG 3.2Å
94	S	92.8	Very high	93.8	Very high	11 Å²	11	41.3 Å²	41.3	8%	0.077	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-57	-38.5	173.8	41.8	0	0	0	0	113.1	E73 P92 C96 K97	E73-S94 WeakPolarHBondContact OE2-CB 3.35Å; P92-S94 VanDerWaalsContact CB-OG 3.27Å; P92-S94 WeakPolarHBondContact CB-OG 3.29Å; P92-S94 VanDerWaalsContact CG-OG 3.22Å; P92-S94 WeakPolarHBondContact CG-OG 3.36Å; P92-S94 PolarHBondContact O-N 3.24Å; S94-C96 PolarHBondContact O-N 2.92Å; S94-K97 PolarHBondContact O-N 3.45Å
95	L	95	Very high	94.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-60.5	-33.1	178.1	-176.9	148.2	0	0	0	111.2	V68 I72 L81 L83 L91 P92 N93 K97 L98 L104 L121	V68-L95 HydrophobicContact CG1-CD1 4.1Å; V68-L95 HydrophobicContact CG2-CD1 4.22Å; I72-L95 VanDerWaalsContact CG2-CA 3.48Å; I72-L95 HydrophobicContact CG2-CB 3.96Å; L81-L95 HydrophobicContact CD2-CD1 3.95Å; L83-L95 HydrophobicContact CD1-CD1 4.26Å; L91-L95 HydrophobicContact CD2-CD1 4.27Å; P92-L95 HydrophobicContact CG-CB 4.37Å; P92-L95 WeakPolarHBondContact O-CB 3.45Å; P92-L95 PolarHBondContact O-N 3.19Å; P92-L95 VanDerWaalsContact O-N 3.14Å; N93-L95 VanDerWaalsContact C-N 3.28Å; N93-L95 PolarHBondContact O-N 2.89Å; L95-K97 PolarHBondContact O-N 2.84Å; L95-L98 HydrophobicContact CG-CD1 4.31Å; L95-L98 WeakPolarHBondContact O-CD1 3.38Å; L95-L98 WeakPolarHBondContact O-CG 3.43Å; L95-L98 PolarHBondContact O-N 3.4Å; L95-L104 HydrophobicContact CD2-CD2 3.79Å; L95-L121 HydrophobicContact CD2-CD1 4.36Å
96	C	94.7	Very high	94.6	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-72.6	-10.8	179.7	-52	0	0	0	0	114.1	N93 S94 P115 S117 I118 E120 L121	N93-C96 WeakPolarHBondContact O-CB 3.28Å; N93-C96 PolarHBondContact O-N 3.29Å; N93-C96 VanDerWaalsContact O-N 3.12Å; S94-C96 PolarHBondContact O-N 2.92Å; C96-P115 WeakPolarHBondContact SG-CG 3.43Å; C96-S117 WeakPolarHBondContact CB-O 3.28Å; C96-S117 VanDerWaalsContact SG-C 3.59Å; C96-S117 PolarHBondContact SG-OG 3.33Å; C96-I118 VanDerWaalsContact SG-CA 3.56Å; C96-I118 PolarHBondContact SG-N 3.36Å; C96-I118 VanDerWaalsContact SG-N 3.43Å; C96-E120 WeakPolarHBondContact O-CB 3.35Å; C96-L121 VanDerWaalsContact O-CD2 3.3Å; C96-L121 WeakPolarHBondContact O-CD2 3.11Å
97	K	93.5	Very high	94.7	Very high	120 Å²	120	37.4 Å²	37.4	52%	0.522	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-97.8	8.8	-179.7	-63	-178.2	178.6	-175.8	0	113.4	E73 S94 L95 P99	E73-K97 HydrophobicContact CB-CB 3.92Å; S94-K97 PolarHBondContact O-N 3.45Å; L95-K97 PolarHBondContact O-N 2.84Å; K97-P99 VanDerWaalsContact O-CD 3.28Å; K97-P99 WeakPolarHBondContact O-CD 3.24Å
98	L	94.7	Very high	94.7	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.187	C	C	.	.			trans	-68.6	110.9	175.5	-75.8	167	0	0	0	110	I72 L78 L81 L95 S100 L101 L121	I72-L98 HydrophobicContact CG1-CD1 4.49Å; I72-L98 WeakPolarHBondContact O-CD2 3.33Å; L78-L98 HydrophobicContact CB-CD2 4.41Å; L78-L98 HydrophobicContact CD2-CD1 4.11Å; L78-L98 HydrophobicContact CD2-CD2 4.26Å; L81-L98 HydrophobicContact CD2-CD1 4.33Å; L95-L98 HydrophobicContact CG-CD1 4.31Å; L95-L98 WeakPolarHBondContact O-CD1 3.38Å; L95-L98 WeakPolarHBondContact O-CG 3.43Å; L95-L98 PolarHBondContact O-N 3.4Å; L98-S100 PolarHBondContact O-N 3.5Å; L98-L101 HydrophobicContact CB-CB 3.82Å; L98-L101 HydrophobicContact CB-CD2 4.38Å; L98-L101 HydrophobicContact CD1-CD1 4.33Å; L98-L101 HydrophobicContact CD1-CD2 3.93Å; L98-L121 HydrophobicContact CB-CD2 4.24Å
99	P	91.3	Very high	94.6	Very high	67 Å²	67	36.5 Å²	36.5	44%	0.435	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.3	-165.9	27.7	-34.9	0	0	0	113.2	R76 K97 N123	R76-P99 HydrophobicContact CB-CG 4.26Å; R76-P99 HydrophobicContact CG-CG 4.47Å; K97-P99 VanDerWaalsContact O-CD 3.28Å; K97-P99 WeakPolarHBondContact O-CD 3.24Å; P99-N123 PolarHBondContact O-ND2 3.21Å
100	S	94.8	Very high	94.6	Very high	41 Å²	41	35.7 Å²	35.7	29%	0.287	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	2.4	-172.6	-55.6	0	0	0	0	113.6	R76 L78 T79 L98 R102	R76-S100 WeakPolarHBondContact O-CB 3.47Å; R76-S100 PolarHBondContact O-OG 3.05Å; L78-S100 CarbonylContact O-C 3.16Å; L78-S100 VanDerWaalsContact O-C 3.22Å; T79-S100 WeakPolarHBondContact CA-O 3.45Å; L98-S100 PolarHBondContact O-N 3.5Å; S100-R102 PolarHBondContact O-N 3.5Å
101	L	97.4	Very high	94.7	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.166	C	C	.	.			trans	-68.5	123.1	-171.3	-166.8	72.2	0	0	0	111.2	L78 L81 L98 L104 L121 N123 L124	L78-L101 HydrophobicContact CD2-CD1 4.42Å; L78-L101 HydrophobicContact CG-CD1 4.26Å; L78-L101 VanDerWaalsContact O-CA 3.32Å; L78-L101 WeakPolarHBondContact O-CA 3.41Å; L78-L101 PolarHBondContact O-N 3.49Å; L81-L101 HydrophobicContact CB-CD1 3.8Å; L98-L101 HydrophobicContact CB-CB 3.82Å; L98-L101 HydrophobicContact CB-CD2 4.38Å; L98-L101 HydrophobicContact CD1-CD1 4.33Å; L98-L101 HydrophobicContact CD1-CD2 3.93Å; L101-L104 HydrophobicContact CD2-CB 4.12Å; L101-L104 HydrophobicContact CD2-CD1 4.35Å; L101-L104 HydrophobicContact CD2-CD2 4.37Å; L101-L121 HydrophobicContact CB-CD2 4.24Å; L101-L121 HydrophobicContact CD2-CD1 4.12Å; L101-L121 HydrophobicContact CD2-CD2 4.07Å; L101-N123 CarbonylContact O-C 3.5Å; L101-N123 VanDerWaalsContact O-C 3.28Å; L101-L124 HydrophobicContact CD2-CD1 4.19Å; L101-L124 HydrophobicContact CG-CD1 4.16Å; L101-L124 PolarHBondContact O-N 2.95Å
102	R	97.7	Very high	94.8	Very high	129 Å²	129	36 Å²	36	49%	0.487	19%	0.186	S	C	.	.			trans	-114.5	-33.6	-179.3	-65.9	-179.7	-178.6	-154	-0.5	112.4	T79 S100 Q125 E126	T79-R102 WeakPolarHBondContact O-CA 3.23Å; T79-R102 PolarHBondContact O-N 2.87Å; S100-R102 PolarHBondContact O-N 3.5Å; R102-Q125 HydrophobicContact CB-CG 4.4Å; R102-Q125 WeakPolarHBondContact O-CA 3.25Å; R102-Q125 PolarHBondContact O-N 2.89Å; R102-E126 PolarHBondContact O-N 3.08Å
103	I	97.6	Very high	94.8	Very high	45 Å²	45	38.5 Å²	38.5	23%	0.231	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.3	-175.5	-56.7	-179.5	0	0	0	108.4	T79 T80 L81 L105 E126	T79-I103 PolarHBondContact O-N 3.34Å; T80-I103 WeakPolarHBondContact CA-O 3.24Å; T80-I103 HydrophobicContact CG2-CB 3.99Å; T80-I103 HydrophobicContact CG2-CG2 3.99Å; L81-I103 PolarHBondContact N-O 2.98Å; I103-L105 HydrophobicContact CG2-CD1 4.21Å; I103-L105 HydrophobicContact CG2-CD2 3.51Å; I103-L105 HydrophobicContact CG2-CG 3.85Å; I103-E126 WeakPolarHBondContact CA-O 3.47Å; I103-E126 HydrophobicContact CB-CB 4.48Å; I103-E126 HydrophobicContact CG1-CB 4.2Å; I103-E126 HydrophobicContact CG2-CB 4.23Å; I103-E126 HydrophobicContact CG2-CG 4.31Å
104	L	97.9	Very high	94.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	113.2	178.4	178.5	59.2	0	0	0	110.6	L81 L95 L101 M106 I118 L121 L124 E126 L127 D128	L81-L104 HydrophobicContact CB-CD1 4.06Å; L81-L104 HydrophobicContact CD2-CD1 3.94Å; L81-L104 HydrophobicContact CG-CD1 4.05Å; L95-L104 HydrophobicContact CD2-CD2 3.79Å; L101-L104 HydrophobicContact CD2-CB 4.12Å; L101-L104 HydrophobicContact CD2-CD1 4.35Å; L101-L104 HydrophobicContact CD2-CD2 4.37Å; L104-M106 HydrophobicContact CD1-CE 4.37Å; L104-M106 HydrophobicContact CD1-CG 3.99Å; L104-M106 HydrophobicContact CD1-SD 3.87Å; L104-M106 HydrophobicContact CD2-CE 3.54Å; L104-M106 HydrophobicContact CD2-SD 3.99Å; L104-M106 HydrophobicContact CG-CE 3.74Å; L104-M106 HydrophobicContact CG-CG 4.11Å; L104-M106 HydrophobicContact CG-SD 3.92Å; L104-I118 HydrophobicContact CD2-CD1 4.44Å; L104-L121 HydrophobicContact CD2-CD1 4.37Å; L104-L124 HydrophobicContact CB-CD1 3.75Å; L104-E126 PolarHBondContact N-O 3.18Å; L104-L127 HydrophobicContact CB-CD1 4.13Å; L104-L127 HydrophobicContact CD2-CD1 3.98Å; L104-L127 HydrophobicContact CG-CD1 4.09Å; L104-L127 WeakPolarHBondContact O-CA 3.36Å; L104-D128 PolarHBondContact O-N 3.26Å
105	L	95.9	Very high	95.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.5	-172.1	-42.8	179.4	0	0	0	109.7	L81 D82 L83 S84 I103 D128 R669	L81-L105 PolarHBondContact O-N 2.94Å; D82-L105 HydrophobicContact CB-CB 4.22Å; D82-L105 HydrophobicContact CB-CD1 3.99Å; D82-L105 HydrophobicContact CB-CG 4.45Å; D82-L105 WeakPolarHBondContact OD1-CB 3.11Å; L83-L105 CarbonylContact C-O 3Å; L83-L105 WeakPolarHBondContact CA-O 3.49Å; L83-L105 PolarHBondContact N-O 3.48Å; S84-L105 PolarHBondContact N-O 3.32Å; I103-L105 HydrophobicContact CG2-CD1 4.21Å; I103-L105 HydrophobicContact CG2-CD2 3.51Å; I103-L105 HydrophobicContact CG2-CG 3.85Å; L105-D128 HydrophobicContact CD2-CB 3.89Å; L105-R669 VanDerWaalsContact CD1-CZ 3.41Å
106	M	96.6	Very high	95	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.			trans	-139.2	27.8	-174.6	-59.6	-176.4	-63.1	0	0	110.8	L83 L91 L104 N109 L111 L114 L127 D128 L129 N132	L83-M106 HydrophobicContact CB-CG 4.21Å; L83-M106 HydrophobicContact CD1-CG 4.38Å; L83-M106 HydrophobicContact CD1-SD 4.42Å; L91-M106 HydrophobicContact CD1-CE 3.62Å; L91-M106 HydrophobicContact CD1-SD 3.48Å; L91-M106 WeakPolarHBondContact CD1-SD 3.46Å; L91-M106 HydrophobicContact CD2-SD 3.74Å; L91-M106 HydrophobicContact CG-SD 4.21Å; L104-M106 HydrophobicContact CD1-CE 4.37Å; L104-M106 HydrophobicContact CD1-CG 3.99Å; L104-M106 HydrophobicContact CD1-SD 3.87Å; L104-M106 HydrophobicContact CD2-CE 3.54Å; L104-M106 HydrophobicContact CD2-SD 3.99Å; L104-M106 HydrophobicContact CG-CE 3.74Å; L104-M106 HydrophobicContact CG-CG 4.11Å; L104-M106 HydrophobicContact CG-SD 3.92Å; M106-N109 PolarHBondContact O-ND2 3Å; M106-N109 VanDerWaalsContact O-ND2 3.12Å; M106-L111 HydrophobicContact CB-CD1 3.94Å; M106-L111 HydrophobicContact CE-CD1 4.15Å; M106-L111 HydrophobicContact SD-CD1 4.1Å; M106-L114 HydrophobicContact CE-CD2 4.25Å; M106-L127 HydrophobicContact CE-CD1 3.94Å; M106-D128 CarbonylContact C-O 3.44Å; M106-D128 WeakPolarHBondContact CA-O 3.19Å; M106-D128 PolarHBondContact N-O 3.28Å; M106-L129 HydrophobicContact CB-CD2 4.36Å; M106-L129 HydrophobicContact CE-CD2 3.44Å; M106-L129 VanDerWaalsContact CE-CD2 3.44Å; M106-N132 PolarHBondContact O-ND2 3.25Å
107	S	90.7	Very high	95.1	Very high	8 Å²	8	39.2 Å²	39.2	6%	0.056	22%	0.219	C	C	.	.			trans	-62.5	154.4	178.7	70.6	0	0	0	0	111.6	S84 F85 N109 D128 S130	S84-S107 CarbonylContact C-O 3.47Å; S84-S107 WeakPolarHBondContact CA-O 3.33Å; S84-S107 VanDerWaalsContact CB-OG 3.27Å; S84-S107 WeakPolarHBondContact CB-OG 3.49Å; S84-S107 PolarHBondContact OG-N 2.85Å; S84-S107 PolarHBondContact OG-OG 3.05Å; F85-S107 PolarHBondContact N-O 3.18Å; S107-N109 PolarHBondContact O-N 2.94Å; S107-N109 PolarHBondContact O-ND2 3.23Å; S107-D128 PolarHBondContact N-O 3Å; S107-S130 CarbonylContact C-O 3.46Å; S107-S130 WeakPolarHBondContact CA-O 3.13Å; S107-S130 VanDerWaalsContact CB-OG 3.25Å; S107-S130 WeakPolarHBondContact CB-OG 3.35Å
108	N	90.3	Very high	95.2	Very high	53 Å²	53	33.5 Å²	33.5	28%	0.283	19%	0.194	S	C	.	.	S	Bend	trans	54.9	53.1	177.8	-77	-86.1	0	0	0	113.4	F85 N86 S130 F131	F85-N108 VanDerWaalsContact CA-O 3.31Å; F85-N108 WeakPolarHBondContact CA-O 3.31Å; F85-N108 HydrophobicContact CB-CB 4.44Å; F85-N108 HydrophobicContact CD1-CB 3.54Å; F85-N108 HydrophobicContact CD2-CB 4.4Å; F85-N108 HydrophobicContact CE1-CB 3.77Å; F85-N108 VanDerWaalsContact CE1-CG 3.45Å; F85-N108 WeakPolarHBondContact CE1-ND2 3.21Å; F85-N108 HydrophobicContact CG-CB 3.88Å; F85-N108 HydrophobicContact CZ-CB 4.28Å; F85-N108 WeakPolarHBondContact CZ-ND2 3.37Å; F85-N108 PolarHBondContact N-O 3.46Å; N86-N108 PolarHBondContact N-O 3.22Å; N108-S130 PolarHBondContact N-O 3.11Å; N108-F131 VanDerWaalsContact CA-O 3.28Å; N108-F131 WeakPolarHBondContact CA-O 3.39Å; N108-F131 HydrophobicContact CB-CB 4.32Å; N108-F131 PolarHBondContact N-O 3.2Å
109	N	93.3	Very high	95.2	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	21%	0.206	C	C	.	.	S	Bend	trans	-124.3	-167	173.7	-85.4	-75.3	0	0	0	110.2	L83 N86 K87 I88 M106 S107 L111 F131 N132	L83-N109 PolarHBondContact O-ND2 3.01Å; N86-N109 VanDerWaalsContact CA-OD1 3.29Å; N86-N109 WeakPolarHBondContact CA-OD1 3.17Å; N86-N109 WeakPolarHBondContact CB-OD1 3.07Å; N86-N109 PolarHBondContact N-OD1 2.68Å; N86-N109 PolarHBondContact O-OD1 3.04Å; K87-N109 PolarHBondContact N-OD1 2.79Å; I88-N109 HydrophobicContact CB-CB 4.41Å; I88-N109 WeakPolarHBondContact CB-OD1 3.25Å; I88-N109 PolarHBondContact N-OD1 3.14Å; M106-N109 PolarHBondContact O-ND2 3Å; M106-N109 VanDerWaalsContact O-ND2 3.12Å; S107-N109 PolarHBondContact O-N 2.94Å; S107-N109 PolarHBondContact O-ND2 3.23Å; N109-L111 HydrophobicContact CB-CG 4.41Å; N109-F131 PolarHBondContact N-O 3.18Å; N109-N132 WeakPolarHBondContact CA-OD1 3.43Å; N109-N132 WeakPolarHBondContact CB-OD1 3.17Å; N109-N132 PolarHBondContact N-OD1 2.96Å; N109-N132 PolarHBondContact O-OD1 3.24Å
110	Y	95.1	Very high	95.4	Very high	86 Å²	86	37 Å²	37	34%	0.337	21%	0.208	S	C	.	.			trans	-112.6	21.9	177.1	-56.2	-47	0	0	0	112.9	K87 I88 S112 N132 R133	K87-Y110 HydrophobicContact CB-CD2 4.21Å; K87-Y110 HydrophobicContact CB-CE2 3.9Å; K87-Y110 HydrophobicContact CD-CD2 4.38Å; K87-Y110 HydrophobicContact CD-CE2 3.36Å; K87-Y110 WeakPolarHBondContact CD-OH 3.44Å; K87-Y110 HydrophobicContact CG-CE2 4.22Å; K87-Y110 PolarHBondContact NZ-OH 2.95Å; K87-Y110 VanDerWaalsContact NZ-OH 3.13Å; I88-Y110 CarbonylContact O-C 3.58Å; I88-Y110 VanDerWaalsContact O-C 3.3Å; I88-Y110 WeakPolarHBondContact O-CA 3.36Å; I88-Y110 PolarHBondContact O-N 3.35Å; Y110-S112 PolarHBondContact O-N 2.81Å; Y110-N132 PolarHBondContact N-OD1 3.06Å; Y110-R133 VanDerWaalsContact CD1-NH2 3.34Å
111	L	96.9	Very high	95.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.195	C	C	.	.			trans	-63.7	133.9	-179.2	-66.1	168.8	0	0	0	110.3	I88 L91 M106 N109 L129 N132 R133 F134	I88-L111 HydrophobicContact CG2-CD2 3.94Å; I88-L111 PolarHBondContact O-N 3.23Å; L91-L111 HydrophobicContact CD2-CD2 4.23Å; L91-L111 HydrophobicContact CG-CD2 3.95Å; M106-L111 HydrophobicContact CB-CD1 3.94Å; M106-L111 HydrophobicContact CE-CD1 4.15Å; M106-L111 HydrophobicContact SD-CD1 4.1Å; N109-L111 HydrophobicContact CB-CG 4.41Å; L111-L129 HydrophobicContact CD1-CD2 4.16Å; L111-N132 HydrophobicContact CB-CB 4.35Å; L111-N132 WeakPolarHBondContact CB-OD1 3.38Å; L111-N132 PolarHBondContact N-OD1 3.47Å; L111-R133 CarbonylContact O-C 3.16Å; L111-R133 WeakPolarHBondContact O-CA 3.38Å; L111-R133 WeakPolarHBondContact O-CB 2.97Å; L111-R133 PolarHBondContact O-N 3.27Å; L111-F134 HydrophobicContact CB-CE2 3.77Å; L111-F134 HydrophobicContact CB-CZ 3.96Å
112	S	95.3	Very high	95.3	Very high	70 Å²	70	39.3 Å²	39.3	49%	0.49	22%	0.215	S	C	.	.			trans	-121.6	-13.5	175.2	56.5	0	0	0	0	113.2	Y110	Y110-S112 PolarHBondContact O-N 2.81Å
113	S	95.8	Very high	95.2	Very high	70 Å²	70	37 Å²	37	49%	0.49	21%	0.212	S	C	.	.			trans	-151.2	165.2	176.2	59.1	0	0	0	0	109.5
114	L	96.5	Very high	95.2	Very high	19 Å²	19	34.9 Å²	34.9	10%	0.099	20%	0.201	C	C	.	.			trans	-117.7	152	169.8	-64.9	175.3	0	0	0	108.7	L91 M106 I118 L129 F134 P138 I141	L91-L114 HydrophobicContact CD1-CD2 3.63Å; M106-L114 HydrophobicContact CE-CD2 4.25Å; L114-I118 HydrophobicContact CB-CG2 4.41Å; L114-I118 HydrophobicContact CD1-CG1 4.33Å; L114-L129 HydrophobicContact CD1-CD1 3.86Å; L114-L129 HydrophobicContact CD2-CD2 4.13Å; L114-F134 HydrophobicContact CD1-CZ 4.42Å; L114-F134 HydrophobicContact CD2-CZ 3.93Å; L114-F134 HydrophobicContact CG-CE1 3.93Å; L114-F134 HydrophobicContact CG-CZ 3.77Å; L114-P138 HydrophobicContact CD1-CB 3.95Å; L114-P138 HydrophobicContact CD1-CG 4.03Å; L114-P138 HydrophobicContact CG-CB 4.29Å; L114-I141 HydrophobicContact CD1-CG2 3.68Å
115	P	95.6	Very high	95.2	Very high	17 Å²	17	37.6 Å²	37.6	11%	0.11	21%	0.214	C	C	.	.			trans	-59.8	145.4	170.9	26.8	-35.4	0	0	0	110.5	L91 N93 C96 S117 I118	L91-P115 HydrophobicContact CB-CG 4.26Å; N93-P115 VanDerWaalsContact OD1-CB 3.28Å; N93-P115 WeakPolarHBondContact OD1-CB 3.38Å; C96-P115 WeakPolarHBondContact SG-CG 3.43Å; P115-S117 PolarHBondContact O-N 2.84Å; P115-I118 VanDerWaalsContact O-CB 3.32Å; P115-I118 WeakPolarHBondContact O-CB 3.23Å; P115-I118 VanDerWaalsContact O-CG2 3.28Å; P115-I118 WeakPolarHBondContact O-CG2 3.19Å; P115-I118 PolarHBondContact O-N 3.33Å
116	A	94.1	Very high	95.3	Very high	75 Å²	75	39.5 Å²	39.5	62%	0.62	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-59.6	-33.9	177.9	0	0	0	0	0	111.6	I118 C119	A116-I118 PolarHBondContact O-N 2.8Å; A116-C119 PolarHBondContact O-SG 3.42Å
117	S	95.6	Very high	95.4	Very high	14 Å²	14	39.5 Å²	39.5	10%	0.098	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.9	-7.1	176.2	56.2	0	0	0	0	114.1	N93 C96 P115 C119 E120	N93-S117 PolarHBondContact OD1-OG 3.2Å; C96-S117 WeakPolarHBondContact CB-O 3.28Å; C96-S117 VanDerWaalsContact SG-C 3.59Å; C96-S117 PolarHBondContact SG-OG 3.33Å; P115-S117 PolarHBondContact O-N 2.84Å; S117-C119 PolarHBondContact O-N 3.36Å; S117-E120 WeakPolarHBondContact CB-OE1 3.36Å; S117-E120 VanDerWaalsContact O-CB 3.25Å; S117-E120 WeakPolarHBondContact O-CB 3.33Å; S117-E120 WeakPolarHBondContact O-CG 3.35Å; S117-E120 PolarHBondContact O-N 3.25Å
118	I	96.9	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-53.4	-26.2	175.2	-162.2	73.6	0	0	0	112	C96 L104 L114 P115 A116 E120 L121 S140 I141 L144	C96-I118 VanDerWaalsContact SG-CA 3.56Å; C96-I118 PolarHBondContact SG-N 3.36Å; C96-I118 VanDerWaalsContact SG-N 3.43Å; L104-I118 HydrophobicContact CD2-CD1 4.44Å; L114-I118 HydrophobicContact CB-CG2 4.41Å; L114-I118 HydrophobicContact CD1-CG1 4.33Å; P115-I118 VanDerWaalsContact O-CB 3.32Å; P115-I118 WeakPolarHBondContact O-CB 3.23Å; P115-I118 VanDerWaalsContact O-CG2 3.28Å; P115-I118 WeakPolarHBondContact O-CG2 3.19Å; P115-I118 PolarHBondContact O-N 3.33Å; A116-I118 PolarHBondContact O-N 2.8Å; I118-E120 PolarHBondContact O-N 3.19Å; I118-L121 HydrophobicContact CD1-CD1 3.58Å; I118-L121 HydrophobicContact CG1-CD1 4.31Å; I118-L121 PolarHBondContact O-N 3.34Å; I118-S140 WeakPolarHBondContact CG2-OG 3.39Å; I118-I141 HydrophobicContact CG1-CG2 4.48Å; I118-I141 HydrophobicContact CG2-CG2 3.96Å; I118-L144 WeakPolarHBondContact O-CD2 3.26Å
119	C	93.6	Very high	96.1	Very high	40 Å²	40	36.7 Å²	36.7	27%	0.27	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-57.7	-20.8	171.7	61.3	0	0	0	0	114.6	A116 S117 L121 Q122 S143	A116-C119 PolarHBondContact O-SG 3.42Å; S117-C119 PolarHBondContact O-N 3.36Å; C119-L121 VanDerWaalsContact C-N 3.26Å; C119-L121 PolarHBondContact O-N 3.07Å; C119-Q122 PolarHBondContact O-NE2 3.33Å; C119-S143 WeakPolarHBondContact CB-OG 3.15Å
120	E	95.4	Very high	96	Very high	104 Å²	104	37.1 Å²	37.1	49%	0.486	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-72.2	-17.9	179.8	-67.2	174.4	-149.8	0	0	112.8	C96 S117 I118 Q122	C96-E120 WeakPolarHBondContact O-CB 3.35Å; S117-E120 WeakPolarHBondContact CB-OE1 3.36Å; S117-E120 VanDerWaalsContact O-CB 3.25Å; S117-E120 WeakPolarHBondContact O-CB 3.33Å; S117-E120 WeakPolarHBondContact O-CG 3.35Å; S117-E120 PolarHBondContact O-N 3.25Å; I118-E120 PolarHBondContact O-N 3.19Å; E120-Q122 PolarHBondContact O-N 3.27Å
121	L	96.7	Very high	95.8	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.016	21%	0.214	C	C	.	.			trans	-75.8	59.5	177.9	-63.6	174	0	0	0	112.3	L95 C96 L98 L101 L104 I118 C119 N123 L124 L144	L95-L121 HydrophobicContact CD2-CD1 4.36Å; C96-L121 VanDerWaalsContact O-CD2 3.3Å; C96-L121 WeakPolarHBondContact O-CD2 3.11Å; L98-L121 HydrophobicContact CB-CD2 4.24Å; L101-L121 HydrophobicContact CB-CD2 4.24Å; L101-L121 HydrophobicContact CD2-CD1 4.12Å; L101-L121 HydrophobicContact CD2-CD2 4.07Å; L104-L121 HydrophobicContact CD2-CD1 4.37Å; I118-L121 HydrophobicContact CD1-CD1 3.58Å; I118-L121 HydrophobicContact CG1-CD1 4.31Å; I118-L121 PolarHBondContact O-N 3.34Å; C119-L121 VanDerWaalsContact C-N 3.26Å; C119-L121 PolarHBondContact O-N 3.07Å; L121-N123 PolarHBondContact O-N 2.74Å; L121-L124 HydrophobicContact CB-CB 4.02Å; L121-L124 HydrophobicContact CD1-CD2 4.34Å; L121-L124 WeakPolarHBondContact O-CB 3.42Å; L121-L124 PolarHBondContact O-N 3.19Å; L121-L144 HydrophobicContact CB-CD2 4.33Å; L121-L144 WeakPolarHBondContact O-CD2 3.28Å
122	Q	93.2	Very high	95.7	Very high	87 Å²	87	38 Å²	38	41%	0.407	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.4	-173.5	-68	-64.4	-40.6	0	0	114.4	C119 E120 S146	C119-Q122 PolarHBondContact O-NE2 3.33Å; E120-Q122 PolarHBondContact O-N 3.27Å; Q122-S146 WeakPolarHBondContact O-CB 3.34Å; Q122-S146 PolarHBondContact O-OG 2.76Å
123	N	96	Very high	95.7	Very high	82 Å²	82	41.1 Å²	41.1	44%	0.439	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.4	176.3	-70.8	-38.7	0	0	0	113.8	P99 L101 L121 Q125	P99-N123 PolarHBondContact O-ND2 3.21Å; L101-N123 CarbonylContact O-C 3.5Å; L101-N123 VanDerWaalsContact O-C 3.28Å; L121-N123 PolarHBondContact O-N 2.74Å; N123-Q125 WeakPolarHBondContact O-CG 3.3Å; N123-Q125 PolarHBondContact O-N 3.3Å
124	L	98.2	Very high	95.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.			trans	-66.6	122.1	-177.2	-160.7	72.5	0	0	0	110.6	L101 L104 L121 L127 L144 S146 L147	L101-L124 HydrophobicContact CD2-CD1 4.19Å; L101-L124 HydrophobicContact CG-CD1 4.16Å; L101-L124 PolarHBondContact O-N 2.95Å; L104-L124 HydrophobicContact CB-CD1 3.75Å; L121-L124 HydrophobicContact CB-CB 4.02Å; L121-L124 HydrophobicContact CD1-CD2 4.34Å; L121-L124 WeakPolarHBondContact O-CB 3.42Å; L121-L124 PolarHBondContact O-N 3.19Å; L124-L127 HydrophobicContact CD2-CB 3.99Å; L124-L127 HydrophobicContact CD2-CD1 4.34Å; L124-L127 HydrophobicContact CD2-CD2 4.25Å; L124-L127 HydrophobicContact CD2-CG 4.43Å; L124-L144 HydrophobicContact CD2-CD1 3.9Å; L124-S146 CarbonylContact O-C 3.55Å; L124-L147 HydrophobicContact CB-CD1 4.49Å; L124-L147 HydrophobicContact CD2-CD1 4.08Å; L124-L147 HydrophobicContact CG-CD1 4.09Å; L124-L147 VanDerWaalsContact O-CA 3.28Å; L124-L147 WeakPolarHBondContact O-CA 3.49Å; L124-L147 PolarHBondContact O-N 2.75Å; L124-L147 VanDerWaalsContact O-N 3.14Å
125	Q	98.1	Very high	95.7	Very high	56 Å²	56	44 Å²	44	26%	0.262	22%	0.221	S	C	.	.			trans	-107.6	-28.4	-179.9	-54.4	-169.1	19.4	0	0	111.9	R102 N123 K148 V149	R102-Q125 HydrophobicContact CB-CG 4.4Å; R102-Q125 WeakPolarHBondContact O-CA 3.25Å; R102-Q125 PolarHBondContact O-N 2.89Å; N123-Q125 WeakPolarHBondContact O-CG 3.3Å; N123-Q125 PolarHBondContact O-N 3.3Å; Q125-K148 HydrophobicContact CB-CD 4.49Å; Q125-K148 WeakPolarHBondContact O-CA 3.44Å; Q125-K148 PolarHBondContact O-N 3.17Å; Q125-V149 PolarHBondContact O-N 2.9Å
126	E	97.9	Very high	95.7	Very high	40 Å²	40	47.7 Å²	47.7	19%	0.187	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128.2	-178.2	-179.8	170	-172.7	0	0	111.2	R102 I103 L104 V149 R669	R102-E126 PolarHBondContact O-N 3.08Å; I103-E126 WeakPolarHBondContact CA-O 3.47Å; I103-E126 HydrophobicContact CB-CB 4.48Å; I103-E126 HydrophobicContact CG1-CB 4.2Å; I103-E126 HydrophobicContact CG2-CB 4.23Å; I103-E126 HydrophobicContact CG2-CG 4.31Å; L104-E126 PolarHBondContact N-O 3.18Å; E126-V149 WeakPolarHBondContact CA-O 3.47Å; E126-V149 HydrophobicContact CB-CB 4.25Å; E126-V149 HydrophobicContact CG-CB 3.95Å; E126-V149 HydrophobicContact CG-CG1 4.09Å; E126-R669 IonicContact OE1-CZ 3.44Å; E126-R669 IonicContact OE1-NH1 2.72Å; E126-R669 PolarHBondContact OE1-NH1 2.89Å; E126-R669 IonicContact OE1-NH2 2.99Å; E126-R669 PolarHBondContact OE1-NH2 2.77Å; E126-R669 IonicContact OE2-NH2 3.02Å; E126-R669 PolarHBondContact OE2-NH2 3.26Å
127	L	98.3	Very high	95.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	116.3	177.9	179.7	55.2	0	0	0	109.7	L104 M106 L124 L129 I141 L147 V149 L150 L151	L104-L127 HydrophobicContact CB-CD1 4.13Å; L104-L127 HydrophobicContact CD2-CD1 3.98Å; L104-L127 HydrophobicContact CG-CD1 4.09Å; L104-L127 WeakPolarHBondContact O-CA 3.36Å; M106-L127 HydrophobicContact CE-CD1 3.94Å; L124-L127 HydrophobicContact CD2-CB 3.99Å; L124-L127 HydrophobicContact CD2-CD1 4.34Å; L124-L127 HydrophobicContact CD2-CD2 4.25Å; L124-L127 HydrophobicContact CD2-CG 4.43Å; L127-L129 HydrophobicContact CD1-CD1 4.28Å; L127-L129 HydrophobicContact CD1-CD2 4.17Å; L127-L129 HydrophobicContact CD1-CG 3.99Å; L127-L129 HydrophobicContact CD2-CD1 3.87Å; L127-L129 HydrophobicContact CD2-CG 4.46Å; L127-L129 HydrophobicContact CG-CD1 3.89Å; L127-L129 HydrophobicContact CG-CG 3.95Å; L127-I141 HydrophobicContact CD2-CG2 3.99Å; L127-L147 HydrophobicContact CB-CD1 3.84Å; L127-V149 PolarHBondContact N-O 3.09Å; L127-L150 HydrophobicContact CB-CD1 4.17Å; L127-L150 HydrophobicContact CD2-CD1 4.12Å; L127-L150 HydrophobicContact CG-CD1 4.15Å; L127-L150 WeakPolarHBondContact O-CA 3.47Å; L127-L151 PolarHBondContact O-N 2.85Å
128	D	97.7	Very high	95.7	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	113.7	176.7	-168.9	-13	0	0	0	111	L104 L105 M106 S107 S130 L151 R669	L104-D128 PolarHBondContact O-N 3.26Å; L105-D128 HydrophobicContact CD2-CB 3.89Å; M106-D128 CarbonylContact C-O 3.44Å; M106-D128 WeakPolarHBondContact CA-O 3.19Å; M106-D128 PolarHBondContact N-O 3.28Å; S107-D128 PolarHBondContact N-O 3Å; D128-S130 WeakPolarHBondContact OD1-CB 3.26Å; D128-S130 PolarHBondContact OD1-N 2.9Å; D128-S130 PolarHBondContact OD1-OG 3.39Å; D128-L151 HydrophobicContact CB-CB 4.33Å; D128-L151 HydrophobicContact CB-CD1 4.19Å; D128-R669 IonicContact OD2-NH1 3.8Å; D128-R669 PolarHBondContact OD2-NH1 3.35Å
129	L	97.7	Very high	95.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.			trans	-122.7	16.4	-179.7	-64.6	168.1	0	0	0	110.9	M106 L111 L114 L127 N132 F134 L151 L152 N155	M106-L129 HydrophobicContact CB-CD2 4.36Å; M106-L129 HydrophobicContact CE-CD2 3.44Å; M106-L129 VanDerWaalsContact CE-CD2 3.44Å; L111-L129 HydrophobicContact CD1-CD2 4.16Å; L114-L129 HydrophobicContact CD1-CD1 3.86Å; L114-L129 HydrophobicContact CD2-CD2 4.13Å; L127-L129 HydrophobicContact CD1-CD1 4.28Å; L127-L129 HydrophobicContact CD1-CD2 4.17Å; L127-L129 HydrophobicContact CD1-CG 3.99Å; L127-L129 HydrophobicContact CD2-CD1 3.87Å; L127-L129 HydrophobicContact CD2-CG 4.46Å; L127-L129 HydrophobicContact CG-CD1 3.89Å; L127-L129 HydrophobicContact CG-CG 3.95Å; L129-N132 WeakPolarHBondContact O-CB 3.33Å; L129-N132 PolarHBondContact O-ND2 2.77Å; L129-F134 HydrophobicContact CB-CE2 4.15Å; L129-F134 HydrophobicContact CD1-CE2 4.33Å; L129-F134 HydrophobicContact CD1-CZ 4.34Å; L129-F134 HydrophobicContact CD2-CE2 4.02Å; L129-F134 HydrophobicContact CD2-CZ 4.2Å; L129-F134 HydrophobicContact CG-CE2 4.4Å; L129-L151 CarbonylContact C-O 3.48Å; L129-L151 WeakPolarHBondContact CA-O 3.33Å; L129-L151 PolarHBondContact N-O 2.94Å; L129-L152 HydrophobicContact CB-CD2 3.73Å; L129-L152 HydrophobicContact CD1-CD2 3.78Å; L129-L152 HydrophobicContact CG-CD2 4.41Å; L129-N155 PolarHBondContact O-ND2 3.41Å
130	S	91	Very high	95.6	Very high	12 Å²	12	47.5 Å²	47.5	8%	0.084	24%	0.239	C	C	.	.			trans	-62.5	152.9	-178.3	59.9	0	0	0	0	112.1	S107 N108 D128 N132 L151 G153	S107-S130 CarbonylContact C-O 3.46Å; S107-S130 WeakPolarHBondContact CA-O 3.13Å; S107-S130 VanDerWaalsContact CB-OG 3.25Å; S107-S130 WeakPolarHBondContact CB-OG 3.35Å; N108-S130 PolarHBondContact N-O 3.11Å; D128-S130 WeakPolarHBondContact OD1-CB 3.26Å; D128-S130 PolarHBondContact OD1-N 2.9Å; D128-S130 PolarHBondContact OD1-OG 3.39Å; S130-N132 PolarHBondContact O-N 3.2Å; S130-N132 PolarHBondContact O-ND2 3.33Å; S130-L151 PolarHBondContact N-O 3.49Å; S130-G153 CarbonylContact C-O 3.19Å; S130-G153 WeakPolarHBondContact CA-O 3.28Å; S130-G153 WeakPolarHBondContact CB-O 3.33Å
131	F	91.4	Very high	95.6	Very high	94 Å²	94	42.6 Å²	42.6	41%	0.412	22%	0.215	S	C	.	.	S	Bend	trans	55.7	46.6	-179.7	-57.1	-92	0	0	0	113.4	N108 N109 G153 C154	N108-F131 VanDerWaalsContact CA-O 3.28Å; N108-F131 WeakPolarHBondContact CA-O 3.39Å; N108-F131 HydrophobicContact CB-CB 4.32Å; N108-F131 PolarHBondContact N-O 3.2Å; N109-F131 PolarHBondContact N-O 3.18Å; F131-G153 PolarHBondContact N-O 3.28Å; F131-C154 WeakPolarHBondContact CA-O 3.44Å; F131-C154 HydrophobicContact CB-CB 4.49Å; F131-C154 HydrophobicContact CD1-CB 3.5Å; F131-C154 VanDerWaalsContact CD1-CB 3.5Å; F131-C154 HydrophobicContact CD2-CB 4.29Å; F131-C154 HydrophobicContact CE1-CB 3.63Å; F131-C154 WeakPolarHBondContact CE1-SG 3.42Å; F131-C154 HydrophobicContact CE2-CB 4.39Å; F131-C154 HydrophobicContact CG-CB 3.84Å; F131-C154 HydrophobicContact CZ-CB 4.08Å; F131-C154 VanDerWaalsContact CZ-SG 3.57Å; F131-C154 PolarHBondContact N-O 3.31Å
132	N	94.6	Very high	95.6	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.07	22%	0.217	C	C	.	.	S	Bend	trans	-116.4	-155.5	173.7	-84.8	-77.9	0	0	0	110.1	M106 N109 Y110 L111 L129 S130 F134 N155	M106-N132 PolarHBondContact O-ND2 3.25Å; N109-N132 WeakPolarHBondContact CA-OD1 3.43Å; N109-N132 WeakPolarHBondContact CB-OD1 3.17Å; N109-N132 PolarHBondContact N-OD1 2.96Å; N109-N132 PolarHBondContact O-OD1 3.24Å; Y110-N132 PolarHBondContact N-OD1 3.06Å; L111-N132 HydrophobicContact CB-CB 4.35Å; L111-N132 WeakPolarHBondContact CB-OD1 3.38Å; L111-N132 PolarHBondContact N-OD1 3.47Å; L129-N132 WeakPolarHBondContact O-CB 3.33Å; L129-N132 PolarHBondContact O-ND2 2.77Å; S130-N132 PolarHBondContact O-N 3.2Å; S130-N132 PolarHBondContact O-ND2 3.33Å; N132-F134 HydrophobicContact CB-CD2 3.82Å; N132-F134 HydrophobicContact CB-CE2 3.97Å; N132-N155 VanDerWaalsContact CA-OD1 3.3Å; N132-N155 WeakPolarHBondContact CA-OD1 3.16Å; N132-N155 VanDerWaalsContact CB-OD1 3.25Å; N132-N155 WeakPolarHBondContact CB-OD1 3.38Å; N132-N155 PolarHBondContact N-OD1 3Å; N132-N155 PolarHBondContact O-OD1 3.31Å
133	R	95.3	Very high	95.6	Very high	135 Å²	135	41 Å²	41	51%	0.509	22%	0.215	S	C	.	.			trans	-126.7	28.5	-175.5	-59.5	-178.5	175.9	179	-0.4	112.6	Y110 L111 K135 N155	Y110-R133 VanDerWaalsContact CD1-NH2 3.34Å; L111-R133 CarbonylContact O-C 3.16Å; L111-R133 WeakPolarHBondContact O-CA 3.38Å; L111-R133 WeakPolarHBondContact O-CB 2.97Å; L111-R133 PolarHBondContact O-N 3.27Å; R133-K135 PolarHBondContact O-N 2.94Å; R133-K135 VanDerWaalsContact O-N 3.14Å; R133-N155 PolarHBondContact N-OD1 3.38Å
134	F	97.3	Very high	95.7	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	19%	0.194	C	C	.	.			trans	-67	111.5	178.1	-74.2	-86.8	0	0	0	110.5	L111 L114 L129 N132 P138 N155 L156 I157	L111-F134 HydrophobicContact CB-CE2 3.77Å; L111-F134 HydrophobicContact CB-CZ 3.96Å; L114-F134 HydrophobicContact CD1-CZ 4.42Å; L114-F134 HydrophobicContact CD2-CZ 3.93Å; L114-F134 HydrophobicContact CG-CE1 3.93Å; L114-F134 HydrophobicContact CG-CZ 3.77Å; L129-F134 HydrophobicContact CB-CE2 4.15Å; L129-F134 HydrophobicContact CD1-CE2 4.33Å; L129-F134 HydrophobicContact CD1-CZ 4.34Å; L129-F134 HydrophobicContact CD2-CE2 4.02Å; L129-F134 HydrophobicContact CD2-CZ 4.2Å; L129-F134 HydrophobicContact CG-CE2 4.4Å; N132-F134 HydrophobicContact CB-CD2 3.82Å; N132-F134 HydrophobicContact CB-CE2 3.97Å; F134-P138 HydrophobicContact CD1-CB 4.4Å; F134-P138 HydrophobicContact CD1-CG 4.31Å; F134-P138 HydrophobicContact CE1-CB 4.1Å; F134-P138 HydrophobicContact CE1-CG 4.16Å; F134-N155 HydrophobicContact CB-CB 4.26Å; F134-N155 WeakPolarHBondContact CD2-OD1 3.33Å; F134-N155 PolarHBondContact N-OD1 3.31Å; F134-L156 CarbonylContact O-C 3.43Å; F134-L156 VanDerWaalsContact O-CA 3.24Å; F134-L156 WeakPolarHBondContact O-CA 3.4Å; F134-L156 WeakPolarHBondContact O-CB 3.46Å; F134-L156 PolarHBondContact O-N 3.19Å; F134-I157 HydrophobicContact CB-CD1 4.2Å; F134-I157 HydrophobicContact CB-CG1 4.01Å; F134-I157 WeakPolarHBondContact O-CG1 3.39Å; F134-I157 PolarHBondContact O-N 3.22Å
135	K	94.9	Very high	95.4	Very high	148 Å²	148	42 Å²	42	64%	0.643	22%	0.216	S	C	*	.	S	Bend	trans	-82.4	-27.3	171.5	-66.3	-176.9	178.8	-178.5	0	112.7	R133 L156	R133-K135 PolarHBondContact O-N 2.94Å; R133-K135 VanDerWaalsContact O-N 3.14Å; K135-L156 CarbonylContact C-O 3.47Å; K135-L156 WeakPolarHBondContact CA-O 3.26Å; K135-L156 HydrophobicContact CG-CB 4.17Å; K135-L156 HydrophobicContact CG-CD1 4.11Å
136	C	94.9	Very high	95.3	Very high	95 Å²	95	41.2 Å²	41.2	64%	0.642	22%	0.217	S	C	*	.	S	Bend	trans	-124.4	145.8	178.2	-60.9	0	0	0	0	108.3
137	F	96.6	Very high	95.3	Very high	13 Å²	13	39.3 Å²	39.3	6%	0.057	21%	0.208	C	C	.	.			trans	-62.3	131.3	171.4	-175.7	-77.7	0	0	0	109.2	S139 I141 L150 L152 I157 L160 P161 I164 L167	F137-S139 PolarHBondContact O-N 2.88Å; F137-I141 HydrophobicContact CE1-CD1 3.91Å; F137-I141 HydrophobicContact CE1-CG1 3.83Å; F137-I141 HydrophobicContact CZ-CD1 3.73Å; F137-I141 HydrophobicContact CZ-CG1 4.06Å; F137-L150 HydrophobicContact CE2-CD2 4.14Å; F137-L150 HydrophobicContact CZ-CD2 3.95Å; F137-L152 HydrophobicContact CD2-CD1 3.78Å; F137-L152 HydrophobicContact CE2-CD1 3.5Å; F137-L152 HydrophobicContact CZ-CD1 4.34Å; F137-I157 HydrophobicContact CB-CG2 3.99Å; F137-L160 HydrophobicContact CD2-CG 4.11Å; F137-P161 HydrophobicContact CD1-CG 3.57Å; F137-P161 HydrophobicContact CE1-CG 4Å; F137-P161 VanDerWaalsContact CG-CD 3.48Å; F137-P161 HydrophobicContact CG-CG 4.28Å; F137-I164 HydrophobicContact CE2-CD1 3.97Å; F137-I164 HydrophobicContact CZ-CD1 3.96Å; F137-I164 HydrophobicContact CZ-CG1 4.18Å; F137-L167 HydrophobicContact CZ-CD1 4.48Å
138	P	94.1	Very high	95.2	Very high	13 Å²	13	43.3 Å²	43.3	8%	0.084	23%	0.226	C	C	.	.			trans	-76.2	88.1	-177.1	30.6	-34.4	0	0	0	110.9	L114 F134 S140 I141	L114-P138 HydrophobicContact CD1-CB 3.95Å; L114-P138 HydrophobicContact CD1-CG 4.03Å; L114-P138 HydrophobicContact CG-CB 4.29Å; F134-P138 HydrophobicContact CD1-CB 4.4Å; F134-P138 HydrophobicContact CD1-CG 4.31Å; F134-P138 HydrophobicContact CE1-CB 4.1Å; F134-P138 HydrophobicContact CE1-CG 4.16Å; P138-S140 PolarHBondContact O-N 3.13Å; P138-I141 HydrophobicContact CB-CG2 4.41Å; P138-I141 HydrophobicContact CG-CD1 3.97Å; P138-I141 HydrophobicContact CG-CG1 4.46Å; P138-I141 HydrophobicContact CG-CG2 4.22Å; P138-I141 VanDerWaalsContact O-CG1 3.28Å; P138-I141 WeakPolarHBondContact O-CG1 3.3Å; P138-I141 PolarHBondContact O-N 3.26Å
139	S	93.7	Very high	95.2	Very high	70 Å²	70	44.5 Å²	44.5	49%	0.49	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-56.8	-22.6	-173.2	54.9	0	0	0	0	115.1	F137 I141 C142	F137-S139 PolarHBondContact O-N 2.88Å; S139-I141 PolarHBondContact O-N 3.49Å; S139-C142 WeakPolarHBondContact O-CB 3.41Å; S139-C142 PolarHBondContact O-N 3.4Å; S139-C142 PolarHBondContact O-SG 3.25Å; S139-C142 VanDerWaalsContact O-SG 3.38Å
140	S	94.2	Very high	95.2	Very high	29 Å²	29	44.5 Å²	44.5	20%	0.203	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-61.2	-21.8	174.5	52.8	0	0	0	0	113.8	I118 P138 C142 S143	I118-S140 WeakPolarHBondContact CG2-OG 3.39Å; P138-S140 PolarHBondContact O-N 3.13Å; S140-C142 VanDerWaalsContact C-N 3.26Å; S140-C142 PolarHBondContact O-N 3.15Å; S140-S143 PolarHBondContact O-OG 2.9Å; S140-S143 VanDerWaalsContact O-OG 3.13Å
141	I	96.4	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-75	-17.7	174.6	77.3	-177.8	0	0	0	112.3	L114 I118 L127 F137 P138 S139 S143 L144 L150 L167	L114-I141 HydrophobicContact CD1-CG2 3.68Å; I118-I141 HydrophobicContact CG1-CG2 4.48Å; I118-I141 HydrophobicContact CG2-CG2 3.96Å; L127-I141 HydrophobicContact CD2-CG2 3.99Å; F137-I141 HydrophobicContact CE1-CD1 3.91Å; F137-I141 HydrophobicContact CE1-CG1 3.83Å; F137-I141 HydrophobicContact CZ-CD1 3.73Å; F137-I141 HydrophobicContact CZ-CG1 4.06Å; P138-I141 HydrophobicContact CB-CG2 4.41Å; P138-I141 HydrophobicContact CG-CD1 3.97Å; P138-I141 HydrophobicContact CG-CG1 4.46Å; P138-I141 HydrophobicContact CG-CG2 4.22Å; P138-I141 VanDerWaalsContact O-CG1 3.28Å; P138-I141 WeakPolarHBondContact O-CG1 3.3Å; P138-I141 PolarHBondContact O-N 3.26Å; S139-I141 PolarHBondContact O-N 3.49Å; I141-S143 PolarHBondContact O-N 2.81Å; I141-L144 HydrophobicContact CB-CD1 3.99Å; I141-L144 HydrophobicContact CG2-CD1 4.38Å; I141-L144 VanDerWaalsContact O-CB 3.26Å; I141-L144 WeakPolarHBondContact O-CB 3.28Å; I141-L144 WeakPolarHBondContact O-CG 3.28Å; I141-L144 PolarHBondContact O-N 3.39Å; I141-L150 HydrophobicContact CD1-CD1 3.72Å; I141-L150 HydrophobicContact CD1-CD2 3.44Å; I141-L150 VanDerWaalsContact CD1-CD2 3.44Å; I141-L150 HydrophobicContact CD1-CG 4.24Å; I141-L167 WeakPolarHBondContact O-CD2 3.41Å
142	C	95.6	Very high	95.8	Very high	7 Å²	7	40.5 Å²	40.5	5%	0.047	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-62.1	-17.6	-176.5	-66.9	0	0	0	0	113.8	S139 S140 D163 G166 L167	S139-C142 WeakPolarHBondContact O-CB 3.41Å; S139-C142 PolarHBondContact O-N 3.4Å; S139-C142 PolarHBondContact O-SG 3.25Å; S139-C142 VanDerWaalsContact O-SG 3.38Å; S140-C142 VanDerWaalsContact C-N 3.26Å; S140-C142 PolarHBondContact O-N 3.15Å; C142-D163 HydrophobicContact CB-CB 4.1Å; C142-D163 VanDerWaalsContact CB-O 3.32Å; C142-D163 WeakPolarHBondContact CB-O 3.12Å; C142-G166 CarbonylContact O-C 3.23Å; C142-G166 WeakPolarHBondContact O-CA 3.25Å; C142-L167 PolarHBondContact O-N 3.16Å
143	S	94.7	Very high	95.6	Very high	51 Å²	51	39.9 Å²	39.9	36%	0.357	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-87.6	-0.9	174.7	58.8	0	0	0	0	114.2	C119 S140 I141 Q145	C119-S143 WeakPolarHBondContact CB-OG 3.15Å; S140-S143 PolarHBondContact O-OG 2.9Å; S140-S143 VanDerWaalsContact O-OG 3.13Å; I141-S143 PolarHBondContact O-N 2.81Å; S143-Q145 PolarHBondContact O-N 2.89Å; S143-Q145 VanDerWaalsContact O-N 3.08Å
144	L	96.3	Very high	95.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.			trans	-79.4	86.7	179	-63.2	179.5	0	0	0	110.8	I118 L121 L124 I141 S146 L147 L167	I118-L144 WeakPolarHBondContact O-CD2 3.26Å; L121-L144 HydrophobicContact CB-CD2 4.33Å; L121-L144 WeakPolarHBondContact O-CD2 3.28Å; L124-L144 HydrophobicContact CD2-CD1 3.9Å; I141-L144 HydrophobicContact CB-CD1 3.99Å; I141-L144 HydrophobicContact CG2-CD1 4.38Å; I141-L144 VanDerWaalsContact O-CB 3.26Å; I141-L144 WeakPolarHBondContact O-CB 3.28Å; I141-L144 WeakPolarHBondContact O-CG 3.28Å; I141-L144 PolarHBondContact O-N 3.39Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.44Å; L144-L147 HydrophobicContact CB-CB 4Å; L144-L147 WeakPolarHBondContact O-CB 3.32Å; L144-L147 PolarHBondContact O-N 2.92Å; L144-L167 HydrophobicContact CB-CD2 4.32Å
145	Q	92.5	Very high	95.3	Very high	102 Å²	102	35.4 Å²	35.4	48%	0.477	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.2	-172.2	-60.4	-176	8	0	0	113.8	S143 L147 C169	S143-Q145 PolarHBondContact O-N 2.89Å; S143-Q145 VanDerWaalsContact O-N 3.08Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; Q145-C169 VanDerWaalsContact O-CB 3.3Å; Q145-C169 WeakPolarHBondContact O-CB 3.48Å; Q145-C169 PolarHBondContact O-SG 2.91Å
146	S	95.8	Very high	95.4	Very high	40 Å²	40	33 Å²	33	28%	0.28	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-6.4	178.8	-59.7	0	0	0	0	113.9	Q122 L124 L144 K148	Q122-S146 WeakPolarHBondContact O-CB 3.34Å; Q122-S146 PolarHBondContact O-OG 2.76Å; L124-S146 CarbonylContact O-C 3.55Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.44Å; S146-K148 PolarHBondContact O-N 2.84Å
147	L	97.9	Very high	95.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.163	C	C	.	.			trans	-69.3	123.2	-173.7	-163.2	73.6	0	0	0	110.4	L124 L127 L144 Q145 L150 L167 C169 L170	L124-L147 HydrophobicContact CB-CD1 4.49Å; L124-L147 HydrophobicContact CD2-CD1 4.08Å; L124-L147 HydrophobicContact CG-CD1 4.09Å; L124-L147 VanDerWaalsContact O-CA 3.28Å; L124-L147 WeakPolarHBondContact O-CA 3.49Å; L124-L147 PolarHBondContact O-N 2.75Å; L124-L147 VanDerWaalsContact O-N 3.14Å; L127-L147 HydrophobicContact CB-CD1 3.84Å; L144-L147 HydrophobicContact CB-CB 4Å; L144-L147 WeakPolarHBondContact O-CB 3.32Å; L144-L147 PolarHBondContact O-N 2.92Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; L147-L150 HydrophobicContact CD2-CB 4.05Å; L147-L150 HydrophobicContact CD2-CD1 4.36Å; L147-L150 HydrophobicContact CD2-CD2 4.4Å; L147-L167 HydrophobicContact CB-CD2 4.28Å; L147-L167 HydrophobicContact CD2-CD2 3.9Å; L147-C169 CarbonylContact O-C 3.43Å; L147-L170 HydrophobicContact CB-CD1 4.44Å; L147-L170 HydrophobicContact CD2-CD1 4.05Å; L147-L170 HydrophobicContact CG-CD1 4.03Å; L147-L170 VanDerWaalsContact O-CA 3.26Å; L147-L170 WeakPolarHBondContact O-CA 3.48Å; L147-L170 PolarHBondContact O-N 3.03Å; L147-L170 VanDerWaalsContact O-N 3.15Å
148	K	97.5	Very high	95.4	Very high	84 Å²	84	32.8 Å²	32.8	37%	0.365	18%	0.183	S	C	.	.			trans	-107.8	-34.7	-179.3	-65.3	173.1	-173.6	164.8	0	112.2	Q125 S146 K171 I172	Q125-K148 HydrophobicContact CB-CD 4.49Å; Q125-K148 WeakPolarHBondContact O-CA 3.44Å; Q125-K148 PolarHBondContact O-N 3.17Å; S146-K148 PolarHBondContact O-N 2.84Å; K148-K171 WeakPolarHBondContact O-CA 3.42Å; K148-K171 PolarHBondContact O-N 2.89Å; K148-I172 PolarHBondContact O-N 3.35Å
149	V	97.4	Very high	95.4	Very high	27 Å²	27	39 Å²	39	16%	0.164	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.5	-176.5	-179.8	0	0	0	0	109.1	Q125 E126 L127 L151 I172	Q125-V149 PolarHBondContact O-N 2.9Å; E126-V149 WeakPolarHBondContact CA-O 3.47Å; E126-V149 HydrophobicContact CB-CB 4.25Å; E126-V149 HydrophobicContact CG-CB 3.95Å; E126-V149 HydrophobicContact CG-CG1 4.09Å; L127-V149 PolarHBondContact N-O 3.09Å; V149-L151 HydrophobicContact CG1-CD1 4.49Å; V149-L151 HydrophobicContact CG1-CD2 3.9Å; V149-L151 HydrophobicContact CG1-CG 4Å; V149-I172 HydrophobicContact CG1-CB 4.27Å; V149-I172 HydrophobicContact CG1-CG2 4.47Å; V149-I172 HydrophobicContact CG2-CB 4.27Å; V149-I172 HydrophobicContact CG2-CD1 4.17Å; V149-I172 HydrophobicContact CG2-CG1 4.39Å
150	L	98.2	Very high	95.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	114	175.9	176.5	58.2	0	0	0	109.2	L127 F137 I141 L147 L152 L167 L170 I172 L173 D174	L127-L150 HydrophobicContact CB-CD1 4.17Å; L127-L150 HydrophobicContact CD2-CD1 4.12Å; L127-L150 HydrophobicContact CG-CD1 4.15Å; L127-L150 WeakPolarHBondContact O-CA 3.47Å; F137-L150 HydrophobicContact CE2-CD2 4.14Å; F137-L150 HydrophobicContact CZ-CD2 3.95Å; I141-L150 HydrophobicContact CD1-CD1 3.72Å; I141-L150 HydrophobicContact CD1-CD2 3.44Å; I141-L150 VanDerWaalsContact CD1-CD2 3.44Å; I141-L150 HydrophobicContact CD1-CG 4.24Å; L147-L150 HydrophobicContact CD2-CB 4.05Å; L147-L150 HydrophobicContact CD2-CD1 4.36Å; L147-L150 HydrophobicContact CD2-CD2 4.4Å; L150-L152 HydrophobicContact CD1-CD1 4.08Å; L150-L152 HydrophobicContact CD1-CG 4.05Å; L150-L152 HydrophobicContact CD2-CD1 3.87Å; L150-L152 HydrophobicContact CG-CD1 3.91Å; L150-L152 HydrophobicContact CG-CG 4.18Å; L150-L167 HydrophobicContact CD2-CD1 3.98Å; L150-L170 HydrophobicContact CB-CD1 3.72Å; L150-L170 HydrophobicContact CB-CD2 4.36Å; L150-I172 PolarHBondContact N-O 3.17Å; L150-L173 HydrophobicContact CB-CD1 4.25Å; L150-L173 HydrophobicContact CD2-CD1 3.85Å; L150-L173 HydrophobicContact CG-CD1 4.05Å; L150-D174 PolarHBondContact O-N 2.94Å
151	L	96.4	Very high	95.7	Very high	22 Å²	22	36.2 Å²	36.2	12%	0.115	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.7	179.2	-49.3	178.7	0	0	0	109.5	L127 D128 L129 S130 V149 I172 D174	L127-L151 PolarHBondContact O-N 2.85Å; D128-L151 HydrophobicContact CB-CB 4.33Å; D128-L151 HydrophobicContact CB-CD1 4.19Å; L129-L151 CarbonylContact C-O 3.48Å; L129-L151 WeakPolarHBondContact CA-O 3.33Å; L129-L151 PolarHBondContact N-O 2.94Å; S130-L151 PolarHBondContact N-O 3.49Å; V149-L151 HydrophobicContact CG1-CD1 4.49Å; V149-L151 HydrophobicContact CG1-CD2 3.9Å; V149-L151 HydrophobicContact CG1-CG 4Å; L151-I172 HydrophobicContact CD2-CG2 4.34Å; L151-D174 HydrophobicContact CD2-CB 3.62Å
152	L	97.2	Very high	95.6	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.			trans	-125.7	13.5	-179.3	-77.6	165.3	0	0	0	111.9	L129 F137 L150 N155 I157 D174 L175 N178	L129-L152 HydrophobicContact CB-CD2 3.73Å; L129-L152 HydrophobicContact CD1-CD2 3.78Å; L129-L152 HydrophobicContact CG-CD2 4.41Å; F137-L152 HydrophobicContact CD2-CD1 3.78Å; F137-L152 HydrophobicContact CE2-CD1 3.5Å; F137-L152 HydrophobicContact CZ-CD1 4.34Å; L150-L152 HydrophobicContact CD1-CD1 4.08Å; L150-L152 HydrophobicContact CD1-CG 4.05Å; L150-L152 HydrophobicContact CD2-CD1 3.87Å; L150-L152 HydrophobicContact CG-CD1 3.91Å; L150-L152 HydrophobicContact CG-CG 4.18Å; L152-N155 PolarHBondContact O-ND2 2.9Å; L152-I157 HydrophobicContact CB-CD1 4.11Å; L152-I157 HydrophobicContact CD1-CD1 4.02Å; L152-I157 HydrophobicContact CD2-CD1 3.9Å; L152-I157 HydrophobicContact CG-CD1 4.25Å; L152-D174 CarbonylContact C-O 3.48Å; L152-D174 WeakPolarHBondContact CA-O 3.31Å; L152-D174 WeakPolarHBondContact CB-O 3.43Å; L152-D174 PolarHBondContact N-O 3.34Å; L152-L175 HydrophobicContact CB-CD2 3.8Å; L152-L175 HydrophobicContact CD1-CD2 4.06Å; L152-N178 PolarHBondContact O-ND2 3.44Å
153	G	91.5	Very high	95.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.			trans	-57.4	153.6	-179.4	0	0	0	0	0	113.6	S130 F131 N155 D174 H176	S130-G153 CarbonylContact C-O 3.19Å; S130-G153 WeakPolarHBondContact CA-O 3.28Å; S130-G153 WeakPolarHBondContact CB-O 3.33Å; F131-G153 PolarHBondContact N-O 3.28Å; G153-N155 PolarHBondContact O-N 2.79Å; G153-N155 PolarHBondContact O-ND2 2.84Å; G153-D174 PolarHBondContact N-O 2.83Å; G153-H176 CarbonylContact C-O 3.59Å; G153-H176 WeakPolarHBondContact CA-O 3.39Å
154	C	92.2	Very high	95.6	Very high	35 Å²	35	42.4 Å²	42.4	24%	0.236	21%	0.214	C	C	.	.	S	Bend	trans	54	49.2	-179.6	-63.1	0	0	0	0	113.4	F131 H176 S177	F131-C154 WeakPolarHBondContact CA-O 3.44Å; F131-C154 HydrophobicContact CB-CB 4.49Å; F131-C154 HydrophobicContact CD1-CB 3.5Å; F131-C154 VanDerWaalsContact CD1-CB 3.5Å; F131-C154 HydrophobicContact CD2-CB 4.29Å; F131-C154 HydrophobicContact CE1-CB 3.63Å; F131-C154 WeakPolarHBondContact CE1-SG 3.42Å; F131-C154 HydrophobicContact CE2-CB 4.39Å; F131-C154 HydrophobicContact CG-CB 3.84Å; F131-C154 HydrophobicContact CZ-CB 4.08Å; F131-C154 VanDerWaalsContact CZ-SG 3.57Å; F131-C154 PolarHBondContact N-O 3.31Å; C154-H176 PolarHBondContact N-O 2.76Å; C154-H176 PolarHBondContact SG-NE2 2.76Å; C154-H176 VanDerWaalsContact SG-NE2 3.4Å; C154-S177 WeakPolarHBondContact CA-O 3.45Å
155	N	94.2	Very high	95.5	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.043	23%	0.228	C	C	.	.	S	Bend	trans	-119.1	-162.4	171.3	-84.4	-79.7	0	0	0	109.9	L129 N132 R133 F134 L152 G153 I157 S177 N178	L129-N155 PolarHBondContact O-ND2 3.41Å; N132-N155 VanDerWaalsContact CA-OD1 3.3Å; N132-N155 WeakPolarHBondContact CA-OD1 3.16Å; N132-N155 VanDerWaalsContact CB-OD1 3.25Å; N132-N155 WeakPolarHBondContact CB-OD1 3.38Å; N132-N155 PolarHBondContact N-OD1 3Å; N132-N155 PolarHBondContact O-OD1 3.31Å; R133-N155 PolarHBondContact N-OD1 3.38Å; F134-N155 HydrophobicContact CB-CB 4.26Å; F134-N155 WeakPolarHBondContact CD2-OD1 3.33Å; F134-N155 PolarHBondContact N-OD1 3.31Å; L152-N155 PolarHBondContact O-ND2 2.9Å; G153-N155 PolarHBondContact O-N 2.79Å; G153-N155 PolarHBondContact O-ND2 2.84Å; N155-I157 HydrophobicContact CB-CD1 4.43Å; N155-I157 HydrophobicContact CB-CG1 4.25Å; N155-S177 PolarHBondContact N-O 2.78Å; N155-N178 WeakPolarHBondContact CA-OD1 3.36Å; N155-N178 WeakPolarHBondContact CB-OD1 3.35Å; N155-N178 PolarHBondContact N-OD1 3.49Å; N155-N178 PolarHBondContact O-OD1 3.41Å
156	L	95.2	Very high	95.6	Very high	96 Å²	96	41 Å²	41	50%	0.503	22%	0.217	S	C	.	.			trans	-119.3	26.5	-179.7	-59	173.3	0	0	0	111.5	F134 K135 E158 N178	F134-L156 CarbonylContact O-C 3.43Å; F134-L156 VanDerWaalsContact O-CA 3.24Å; F134-L156 WeakPolarHBondContact O-CA 3.4Å; F134-L156 WeakPolarHBondContact O-CB 3.46Å; F134-L156 PolarHBondContact O-N 3.19Å; K135-L156 CarbonylContact C-O 3.47Å; K135-L156 WeakPolarHBondContact CA-O 3.26Å; K135-L156 HydrophobicContact CG-CB 4.17Å; K135-L156 HydrophobicContact CG-CD1 4.11Å; L156-E158 PolarHBondContact O-N 3Å; L156-N178 PolarHBondContact N-OD1 3.32Å
157	I	97.5	Very high	95.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.			trans	-73.6	118.7	-172.8	-62.3	173.2	0	0	0	109.6	F134 F137 L152 N155 L175 N178 G179 V180	F134-I157 HydrophobicContact CB-CD1 4.2Å; F134-I157 HydrophobicContact CB-CG1 4.01Å; F134-I157 WeakPolarHBondContact O-CG1 3.39Å; F134-I157 PolarHBondContact O-N 3.22Å; F137-I157 HydrophobicContact CB-CG2 3.99Å; L152-I157 HydrophobicContact CB-CD1 4.11Å; L152-I157 HydrophobicContact CD1-CD1 4.02Å; L152-I157 HydrophobicContact CD2-CD1 3.9Å; L152-I157 HydrophobicContact CG-CD1 4.25Å; N155-I157 HydrophobicContact CB-CD1 4.43Å; N155-I157 HydrophobicContact CB-CG1 4.25Å; I157-L175 HydrophobicContact CD1-CD2 4.36Å; I157-N178 WeakPolarHBondContact CB-OD1 3.49Å; I157-N178 PolarHBondContact N-OD1 3.22Å; I157-G179 CarbonylContact O-C 3.25Å; I157-G179 VanDerWaalsContact O-C 3.23Å; I157-G179 VanDerWaalsContact O-CA 3.28Å; I157-G179 WeakPolarHBondContact O-CA 3.4Å; I157-G179 PolarHBondContact O-N 3.27Å; I157-V180 WeakPolarHBondContact O-CG2 3.25Å; I157-V180 PolarHBondContact O-N 3.38Å; I157-V180 VanDerWaalsContact O-N 3.15Å
158	E	95.4	Very high	95.2	Very high	104 Å²	104	45.9 Å²	45.9	49%	0.486	23%	0.229	S	C	.	.			trans	-93.6	-29.1	178.8	-64.6	-171.6	-173.3	0	0	114.2	L156 G179 V180	L156-E158 PolarHBondContact O-N 3Å; E158-G179 WeakPolarHBondContact CA-O 3.39Å; E158-V180 WeakPolarHBondContact O-CA 3.37Å
159	K	94.5	Very high	95	Very high	143 Å²	143	44.4 Å²	44.4	62%	0.622	23%	0.229	S	C	*	.			trans	-143.6	140.9	-174.3	-64.1	-177.1	-178.2	178.3	0	110.3
160	L	96.5	Very high	95	Very high	14 Å²	14	43.1 Å²	43.1	7%	0.073	22%	0.222	C	C	.	.			trans	-97.9	146.1	169.7	-62.7	70.7	0	0	0	108.6	F137 I164 L173 L175 V180 L183 P184 I187	F137-L160 HydrophobicContact CD2-CG 4.11Å; L160-I164 HydrophobicContact CB-CD1 4.33Å; L160-I164 HydrophobicContact CD2-CD1 3.4Å; L160-I164 HydrophobicContact CG-CD1 4.32Å; L160-L173 HydrophobicContact CD2-CD2 4.25Å; L160-L175 HydrophobicContact CD1-CD1 4.06Å; L160-L175 HydrophobicContact CD2-CD1 3.51Å; L160-L175 HydrophobicContact CG-CD1 4.14Å; L160-V180 HydrophobicContact CD1-CG1 3.81Å; L160-V180 HydrophobicContact CD1-CG2 3.79Å; L160-L183 HydrophobicContact CD1-CD2 4.41Å; L160-P184 HydrophobicContact CB-CG 3.84Å; L160-I187 HydrophobicContact CD2-CD1 4.45Å
161	P	96.1	Very high	94.9	Very high	27 Å²	27	46.9 Å²	46.9	18%	0.175	24%	0.238	C	C	.	.			trans	-74.2	154.7	177.3	32.3	-36.7	0	0	0	111.2	F137 D163 I164	F137-P161 HydrophobicContact CD1-CG 3.57Å; F137-P161 HydrophobicContact CE1-CG 4Å; F137-P161 VanDerWaalsContact CG-CD 3.48Å; F137-P161 HydrophobicContact CG-CG 4.28Å; P161-D163 HydrophobicContact CB-CB 4.48Å; P161-D163 PolarHBondContact O-N 2.97Å; P161-I164 WeakPolarHBondContact O-CB 3.14Å; P161-I164 VanDerWaalsContact O-CG2 3.28Å; P161-I164 WeakPolarHBondContact O-CG2 3.16Å; P161-I164 PolarHBondContact O-N 3.02Å
162	E	94.3	Very high	94.8	Very high	81 Å²	81	48 Å²	48	38%	0.379	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-65.5	-22.2	171.5	-70	-63.7	164.3	0	0	112.3	I164 P184 L185 N186	E162-I164 PolarHBondContact O-N 2.86Å; E162-P184 VanDerWaalsContact CD-CB 3.42Å; E162-P184 HydrophobicContact CG-CB 4.29Å; E162-P184 WeakPolarHBondContact OE1-CA 3.34Å; E162-P184 VanDerWaalsContact OE1-CB 3.31Å; E162-P184 WeakPolarHBondContact OE1-CB 3.14Å; E162-P184 WeakPolarHBondContact OE2-CB 3.29Å; E162-L185 PolarHBondContact OE1-N 3.13Å; E162-L185 VanDerWaalsContact OE1-N 3.08Å; E162-L185 PolarHBondContact OE2-N 3.02Å; E162-N186 VanDerWaalsContact O-CB 3.31Å; E162-N186 WeakPolarHBondContact O-CB 3.3Å; E162-N186 PolarHBondContact O-ND2 3.3Å; E162-N186 WeakPolarHBondContact OE2-CB 3.47Å; E162-N186 PolarHBondContact OE2-N 3.13Å; E162-N186 PolarHBondContact OE2-ND2 3.02Å
163	D	95.2	Very high	94.8	Very high	107 Å²	107	48 Å²	48	57%	0.572	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-70	-7.2	176	-58.6	-40.9	0	0	0	113.4	C142 P161 V165 G166	C142-D163 HydrophobicContact CB-CB 4.1Å; C142-D163 VanDerWaalsContact CB-O 3.32Å; C142-D163 WeakPolarHBondContact CB-O 3.12Å; P161-D163 HydrophobicContact CB-CB 4.48Å; P161-D163 PolarHBondContact O-N 2.97Å; D163-V165 PolarHBondContact O-N 3.03Å; D163-G166 PolarHBondContact O-N 3.14Å
164	I	96.1	Very high	94.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-55.8	-24	178.1	-162.3	169.5	0	0	0	113.1	F137 L160 P161 E162 G166 L167 L173 P184 I187 M190	F137-I164 HydrophobicContact CE2-CD1 3.97Å; F137-I164 HydrophobicContact CZ-CD1 3.96Å; F137-I164 HydrophobicContact CZ-CG1 4.18Å; L160-I164 HydrophobicContact CB-CD1 4.33Å; L160-I164 HydrophobicContact CD2-CD1 3.4Å; L160-I164 HydrophobicContact CG-CD1 4.32Å; P161-I164 WeakPolarHBondContact O-CB 3.14Å; P161-I164 VanDerWaalsContact O-CG2 3.28Å; P161-I164 WeakPolarHBondContact O-CG2 3.16Å; P161-I164 PolarHBondContact O-N 3.02Å; E162-I164 PolarHBondContact O-N 2.86Å; I164-G166 PolarHBondContact O-N 3.4Å; I164-G166 VanDerWaalsContact O-N 3.14Å; I164-L167 HydrophobicContact CG1-CD1 3.97Å; I164-L167 WeakPolarHBondContact O-CB 3.03Å; I164-L167 PolarHBondContact O-N 2.89Å; I164-L167 VanDerWaalsContact O-N 3.07Å; I164-L173 HydrophobicContact CD1-CD2 3.88Å; I164-P184 HydrophobicContact CG2-CG 3.96Å; I164-I187 HydrophobicContact CG2-CB 4.46Å; I164-M190 HydrophobicContact CD1-SD 4.38Å; I164-M190 HydrophobicContact CG1-CE 4.38Å; I164-M190 HydrophobicContact CG1-SD 3.95Å; I164-M190 HydrophobicContact CG2-SD 4.14Å
165	V	93.8	Very high	95	Very high	48 Å²	48	46.8 Å²	46.8	29%	0.291	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-58.4	-21	172	67.6	0	0	0	0	113.7	D163 L167 N186 F189	D163-V165 PolarHBondContact O-N 3.03Å; V165-L167 PolarHBondContact O-N 3.36Å; V165-N186 HydrophobicContact CB-CB 4.15Å; V165-N186 HydrophobicContact CG1-CB 4.31Å; V165-F189 HydrophobicContact CG2-CB 3.66Å
166	G	94	Very high	94.9	Very high	25 Å²	25	48.5 Å²	48.5	26%	0.258	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-64	-21.7	174.2	0	0	0	0	0	113.8	C142 D163 I164 R168	C142-G166 CarbonylContact O-C 3.23Å; C142-G166 WeakPolarHBondContact O-CA 3.25Å; D163-G166 PolarHBondContact O-N 3.14Å; I164-G166 PolarHBondContact O-N 3.4Å; I164-G166 VanDerWaalsContact O-N 3.14Å; G166-R168 PolarHBondContact O-N 3.49Å
167	L	95.9	Very high	94.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.227	C	C	.	.			trans	-75.7	63.2	174.1	-61.7	177	0	0	0	111.3	F137 I141 C142 L144 L147 L150 I164 V165 C169 L170 M190	F137-L167 HydrophobicContact CZ-CD1 4.48Å; I141-L167 WeakPolarHBondContact O-CD2 3.41Å; C142-L167 PolarHBondContact O-N 3.16Å; L144-L167 HydrophobicContact CB-CD2 4.32Å; L147-L167 HydrophobicContact CB-CD2 4.28Å; L147-L167 HydrophobicContact CD2-CD2 3.9Å; L150-L167 HydrophobicContact CD2-CD1 3.98Å; I164-L167 HydrophobicContact CG1-CD1 3.97Å; I164-L167 WeakPolarHBondContact O-CB 3.03Å; I164-L167 PolarHBondContact O-N 2.89Å; I164-L167 VanDerWaalsContact O-N 3.07Å; V165-L167 PolarHBondContact O-N 3.36Å; L167-C169 VanDerWaalsContact C-N 3.28Å; L167-C169 PolarHBondContact O-N 3.03Å; L167-L170 HydrophobicContact CB-CB 3.95Å; L167-L170 HydrophobicContact CB-CD2 4.41Å; L167-L170 HydrophobicContact CD1-CD2 3.96Å; L167-L170 WeakPolarHBondContact O-CB 3.15Å; L167-L170 PolarHBondContact O-N 3.15Å; L167-L170 VanDerWaalsContact O-N 3.12Å; L167-M190 HydrophobicContact CB-CE 3.99Å
168	R	90	Very high	94.4	Very high	141 Å²	141	45.8 Å²	45.8	53%	0.532	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-31.2	-167.9	-69	-178.6	177.7	179.2	-0.2	114.7	G166 C192	G166-R168 PolarHBondContact O-N 3.49Å; R168-C192 PolarHBondContact O-SG 3.14Å; R168-C192 VanDerWaalsContact O-SG 3.37Å
169	C	93.9	Very high	94.3	Very high	53 Å²	53	41.6 Å²	41.6	36%	0.358	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	7.4	-178.5	-61.1	0	0	0	0	113.8	Q145 L147 L167 K171	Q145-C169 VanDerWaalsContact O-CB 3.3Å; Q145-C169 WeakPolarHBondContact O-CB 3.48Å; Q145-C169 PolarHBondContact O-SG 2.91Å; L147-C169 CarbonylContact O-C 3.43Å; L167-C169 VanDerWaalsContact C-N 3.28Å; L167-C169 PolarHBondContact O-N 3.03Å; C169-K171 PolarHBondContact O-N 2.8Å
170	L	97.2	Very high	94.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.186	C	C	.	.			trans	-69.2	122.8	-173.3	-162.2	77	0	0	0	110.9	L147 L150 L167 L173 M190 C192 L193	L147-L170 HydrophobicContact CB-CD1 4.44Å; L147-L170 HydrophobicContact CD2-CD1 4.05Å; L147-L170 HydrophobicContact CG-CD1 4.03Å; L147-L170 VanDerWaalsContact O-CA 3.26Å; L147-L170 WeakPolarHBondContact O-CA 3.48Å; L147-L170 PolarHBondContact O-N 3.03Å; L147-L170 VanDerWaalsContact O-N 3.15Å; L150-L170 HydrophobicContact CB-CD1 3.72Å; L150-L170 HydrophobicContact CB-CD2 4.36Å; L167-L170 HydrophobicContact CB-CB 3.95Å; L167-L170 HydrophobicContact CB-CD2 4.41Å; L167-L170 HydrophobicContact CD1-CD2 3.96Å; L167-L170 WeakPolarHBondContact O-CB 3.15Å; L167-L170 PolarHBondContact O-N 3.15Å; L167-L170 VanDerWaalsContact O-N 3.12Å; L170-L173 HydrophobicContact CD2-CB 3.86Å; L170-L173 HydrophobicContact CD2-CD1 4.32Å; L170-L173 HydrophobicContact CD2-CD2 4.43Å; L170-L173 HydrophobicContact CD2-CG 4.44Å; L170-M190 HydrophobicContact CB-CE 3.72Å; L170-M190 HydrophobicContact CD2-CE 3.49Å; L170-M190 VanDerWaalsContact CD2-CE 3.49Å; L170-M190 HydrophobicContact CG-CE 4.21Å; L170-C192 CarbonylContact O-C 3.28Å; L170-C192 WeakPolarHBondContact O-CB 3.49Å; L170-L193 HydrophobicContact CD2-CD1 4.22Å; L170-L193 HydrophobicContact CG-CD1 4.41Å; L170-L193 WeakPolarHBondContact O-CA 3.45Å; L170-L193 PolarHBondContact O-N 3.09Å
171	K	94.9	Very high	94.2	Very high	78 Å²	78	39.6 Å²	39.6	34%	0.339	21%	0.206	S	C	.	.			trans	-102.2	-40.5	178.6	-68	174	170.3	-108.4	0	112.2	K148 C169 C192 E194 K195	K148-K171 WeakPolarHBondContact O-CA 3.42Å; K148-K171 PolarHBondContact O-N 2.89Å; C169-K171 PolarHBondContact O-N 2.8Å; K171-C192 WeakPolarHBondContact CA-O 3.5Å; K171-E194 HydrophobicContact CB-CG 4.47Å; K171-E194 IonicContact NZ-OE1 2.84Å; K171-E194 PolarHBondContact NZ-OE1 2.99Å; K171-E194 WeakPolarHBondContact O-CA 3.48Å; K171-E194 PolarHBondContact O-N 3.3Å; K171-K195 PolarHBondContact O-N 3.02Å
172	I	94.7	Very high	94	Very high	45 Å²	45	43.7 Å²	43.7	23%	0.231	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118.8	-176.5	-55.7	-179.2	0	0	0	108.6	K148 V149 L150 L151 K195	K148-I172 PolarHBondContact O-N 3.35Å; V149-I172 HydrophobicContact CG1-CB 4.27Å; V149-I172 HydrophobicContact CG1-CG2 4.47Å; V149-I172 HydrophobicContact CG2-CB 4.27Å; V149-I172 HydrophobicContact CG2-CD1 4.17Å; V149-I172 HydrophobicContact CG2-CG1 4.39Å; L150-I172 PolarHBondContact N-O 3.17Å; L151-I172 HydrophobicContact CD2-CG2 4.34Å; I172-K195 HydrophobicContact CB-CB 4.5Å; I172-K195 HydrophobicContact CG1-CB 4.19Å; I172-K195 HydrophobicContact CG2-CB 4.29Å; I172-K195 HydrophobicContact CG2-CD 4.25Å; I172-K195 HydrophobicContact CG2-CG 4.45Å
173	L	96.8	Very high	94	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	112.3	169.6	178.7	54.2	0	0	0	108.9	L150 L160 I164 L170 L175 I187 L193 K195 L196 S197	L150-L173 HydrophobicContact CB-CD1 4.25Å; L150-L173 HydrophobicContact CD2-CD1 3.85Å; L150-L173 HydrophobicContact CG-CD1 4.05Å; L160-L173 HydrophobicContact CD2-CD2 4.25Å; I164-L173 HydrophobicContact CD1-CD2 3.88Å; L170-L173 HydrophobicContact CD2-CB 3.86Å; L170-L173 HydrophobicContact CD2-CD1 4.32Å; L170-L173 HydrophobicContact CD2-CD2 4.43Å; L170-L173 HydrophobicContact CD2-CG 4.44Å; L173-L175 HydrophobicContact CD1-CD1 4.08Å; L173-L175 HydrophobicContact CD1-CG 4.02Å; L173-L175 HydrophobicContact CD2-CD1 3.85Å; L173-L175 HydrophobicContact CG-CD1 3.82Å; L173-L175 HydrophobicContact CG-CG 4.11Å; L173-I187 HydrophobicContact CD2-CD1 4.39Å; L173-L193 HydrophobicContact CB-CD1 3.82Å; L173-K195 PolarHBondContact N-O 3.42Å; L173-L196 HydrophobicContact CB-CD1 4.07Å; L173-L196 HydrophobicContact CD2-CD1 3.88Å; L173-L196 HydrophobicContact CG-CD1 3.93Å; L173-L196 WeakPolarHBondContact O-CA 3.36Å; L173-S197 PolarHBondContact O-N 3.5Å
174	D	94.7	Very high	93.9	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.053	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.2	175.4	-169.4	-7	0	0	0	111	L150 L151 L152 G153 H176 S197	L150-D174 PolarHBondContact O-N 2.94Å; L151-D174 HydrophobicContact CD2-CB 3.62Å; L152-D174 CarbonylContact C-O 3.48Å; L152-D174 WeakPolarHBondContact CA-O 3.31Å; L152-D174 WeakPolarHBondContact CB-O 3.43Å; L152-D174 PolarHBondContact N-O 3.34Å; G153-D174 PolarHBondContact N-O 2.83Å; D174-H176 IonicContact OD1-CE1 3.43Å; D174-H176 IonicContact OD1-CG 2.69Å; D174-H176 PolarHBondContact OD1-N 3.07Å; D174-H176 IonicContact OD1-ND1 3.6Å; D174-H176 PolarHBondContact OD1-ND1 2.82Å; D174-H176 IonicContact OD2-CE1 2.67Å; D174-H176 PolarHBondContact OD2-CE1 2.88Å; D174-H176 IonicContact OD2-ND1 3.46Å; D174-H176 PolarHBondContact OD2-ND1 2.61Å; D174-S197 VanDerWaalsContact OD1-CB 3.26Å; D174-S197 WeakPolarHBondContact OD1-CB 3.16Å
175	L	95.1	Very high	93.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.			trans	-125.6	20.8	178.5	-71	161.6	0	0	0	111.5	L152 I157 L160 L173 N178 S197 L198 N201	L152-L175 HydrophobicContact CB-CD2 3.8Å; L152-L175 HydrophobicContact CD1-CD2 4.06Å; I157-L175 HydrophobicContact CD1-CD2 4.36Å; L160-L175 HydrophobicContact CD1-CD1 4.06Å; L160-L175 HydrophobicContact CD2-CD1 3.51Å; L160-L175 HydrophobicContact CG-CD1 4.14Å; L173-L175 HydrophobicContact CD1-CD1 4.08Å; L173-L175 HydrophobicContact CD1-CG 4.02Å; L173-L175 HydrophobicContact CD2-CD1 3.85Å; L173-L175 HydrophobicContact CG-CD1 3.82Å; L173-L175 HydrophobicContact CG-CG 4.11Å; L175-N178 WeakPolarHBondContact O-CB 3.38Å; L175-N178 PolarHBondContact O-ND2 2.95Å; L175-N178 VanDerWaalsContact O-ND2 3.15Å; L175-S197 CarbonylContact C-O 3.54Å; L175-S197 WeakPolarHBondContact CA-O 3.44Å; L175-S197 WeakPolarHBondContact CB-O 3.33Å; L175-S197 PolarHBondContact N-O 3.01Å; L175-L198 HydrophobicContact CB-CD2 4.02Å; L175-L198 HydrophobicContact CD1-CD2 4.1Å; L175-N201 PolarHBondContact O-ND2 2.92Å
176	H	90.3	Very high	93.8	Very high	45 Å²	45	37.5 Å²	37.5	21%	0.208	19%	0.191	C	C	.	.			trans	-56.2	151.3	-179.6	73.2	-93.6	0	0	0	112.2	G153 C154 D174 N178 E199	G153-H176 CarbonylContact C-O 3.59Å; G153-H176 WeakPolarHBondContact CA-O 3.39Å; C154-H176 PolarHBondContact N-O 2.76Å; C154-H176 PolarHBondContact SG-NE2 2.76Å; C154-H176 VanDerWaalsContact SG-NE2 3.4Å; D174-H176 IonicContact OD1-CE1 3.43Å; D174-H176 IonicContact OD1-CG 2.69Å; D174-H176 PolarHBondContact OD1-N 3.07Å; D174-H176 IonicContact OD1-ND1 3.6Å; D174-H176 PolarHBondContact OD1-ND1 2.82Å; D174-H176 IonicContact OD2-CE1 2.67Å; D174-H176 PolarHBondContact OD2-CE1 2.88Å; D174-H176 IonicContact OD2-ND1 3.46Å; D174-H176 PolarHBondContact OD2-ND1 2.61Å; H176-N178 PolarHBondContact O-N 2.85Å; H176-N178 PolarHBondContact O-ND2 3.39Å; H176-E199 CarbonylContact C-O 3.1Å; H176-E199 VanDerWaalsContact CA-O 3.23Å; H176-E199 WeakPolarHBondContact CA-O 3.3Å; H176-E199 HydrophobicContact CB-CB 4.35Å
177	S	89.1	Confident	93.8	Very high	27 Å²	27	36.3 Å²	36.3	19%	0.189	18%	0.178	C	C	.	.	S	Bend	trans	50.8	53.1	176.4	-45.5	0	0	0	0	113	C154 N155 E199 E200	C154-S177 WeakPolarHBondContact CA-O 3.45Å; N155-S177 PolarHBondContact N-O 2.78Å; S177-E199 PolarHBondContact N-O 2.8Å; S177-E200 WeakPolarHBondContact CA-O 3.26Å; S177-E200 WeakPolarHBondContact OG-CB 3.29Å; S177-E200 PolarHBondContact OG-OE2 3.22Å
178	N	93.3	Very high	93.6	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.064	19%	0.185	C	C	.	.	S	Bend	trans	-122.1	-170.1	174.5	-88	-85.9	0	0	0	110.5	L152 N155 L156 I157 L175 H176 V180 N201 P202	L152-N178 PolarHBondContact O-ND2 3.44Å; N155-N178 WeakPolarHBondContact CA-OD1 3.36Å; N155-N178 WeakPolarHBondContact CB-OD1 3.35Å; N155-N178 PolarHBondContact N-OD1 3.49Å; N155-N178 PolarHBondContact O-OD1 3.41Å; L156-N178 PolarHBondContact N-OD1 3.32Å; I157-N178 WeakPolarHBondContact CB-OD1 3.49Å; I157-N178 PolarHBondContact N-OD1 3.22Å; L175-N178 WeakPolarHBondContact O-CB 3.38Å; L175-N178 PolarHBondContact O-ND2 2.95Å; L175-N178 VanDerWaalsContact O-ND2 3.15Å; H176-N178 PolarHBondContact O-N 2.85Å; H176-N178 PolarHBondContact O-ND2 3.39Å; N178-V180 HydrophobicContact CB-CG2 4.2Å; N178-N201 VanDerWaalsContact CA-OD1 3.28Å; N178-N201 WeakPolarHBondContact CA-OD1 3.32Å; N178-N201 WeakPolarHBondContact CB-OD1 3.46Å; N178-N201 PolarHBondContact N-OD1 3.33Å; N178-N201 PolarHBondContact O-OD1 3.4Å; N178-N201 VanDerWaalsContact O-OD1 3.13Å; N178-P202 WeakPolarHBondContact O-CD 3.09Å
179	G	93.7	Very high	93.7	Very high	16 Å²	16	35.7 Å²	35.7	17%	0.165	18%	0.179	C	C	.	.			trans	-98.9	16.1	177.8	0	0	0	0	0	114.6	I157 E158 K181 N201	I157-G179 CarbonylContact O-C 3.25Å; I157-G179 VanDerWaalsContact O-C 3.23Å; I157-G179 VanDerWaalsContact O-CA 3.28Å; I157-G179 WeakPolarHBondContact O-CA 3.4Å; I157-G179 PolarHBondContact O-N 3.27Å; E158-G179 WeakPolarHBondContact CA-O 3.39Å; G179-K181 PolarHBondContact O-N 3.36Å; G179-N201 PolarHBondContact N-OD1 3.19Å
180	V	95.7	Very high	93.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.			trans	-66.8	118.3	-169.8	-177.2	0	0	0	0	110.7	I157 E158 L160 N178 Q182 L183 N201 P202 L203	I157-V180 WeakPolarHBondContact O-CG2 3.25Å; I157-V180 PolarHBondContact O-N 3.38Å; I157-V180 VanDerWaalsContact O-N 3.15Å; E158-V180 WeakPolarHBondContact O-CA 3.37Å; L160-V180 HydrophobicContact CD1-CG1 3.81Å; L160-V180 HydrophobicContact CD1-CG2 3.79Å; N178-V180 HydrophobicContact CB-CG2 4.2Å; V180-Q182 WeakPolarHBondContact CG1-O 3.34Å; V180-L183 HydrophobicContact CG1-CD2 4.23Å; V180-N201 HydrophobicContact CB-CB 4.24Å; V180-N201 VanDerWaalsContact CB-OD1 3.25Å; V180-N201 WeakPolarHBondContact CB-OD1 3.27Å; V180-N201 WeakPolarHBondContact CG2-OD1 3.14Å; V180-N201 PolarHBondContact N-OD1 2.9Å; V180-N201 WeakPolarHBondContact O-CB 3.41Å; V180-P202 CarbonylContact O-C 3.45Å; V180-L203 HydrophobicContact CG1-CD2 4.4Å; V180-L203 WeakPolarHBondContact O-CD2 3.15Å
181	K	92.6	Very high	93	Very high	115 Å²	115	42.9 Å²	42.9	50%	0.5	20%	0.199	S	C	.	.			trans	-95	-37.4	177.5	-64.7	177	-177.1	168.7	0	112.9	G179 P202 S204	G179-K181 PolarHBondContact O-N 3.36Å; K181-P202 WeakPolarHBondContact CA-O 3.19Å; K181-P202 HydrophobicContact CG-CG 4.13Å; K181-S204 PolarHBondContact O-N 3.29Å; K181-S204 PolarHBondContact O-OG 2.99Å
182	Q	91.9	Very high	92.8	Very high	113 Å²	113	40.5 Å²	40.5	53%	0.528	19%	0.192	S	C	.	.			trans	-143.6	155.2	-176.4	66.6	-175.1	31.7	0	0	109.8	V180	V180-Q182 WeakPolarHBondContact CG1-O 3.34Å
183	L	94.4	Very high	92.7	Very high	9 Å²	9	39 Å²	39	5%	0.047	18%	0.184	C	C	.	.			trans	-98.1	145.6	173	-63.2	171.7	0	0	0	110.3	L160 V180 I187 L196 L198 L207 I218 L222	L160-L183 HydrophobicContact CD1-CD2 4.41Å; V180-L183 HydrophobicContact CG1-CD2 4.23Å; L183-I187 HydrophobicContact CB-CG2 4.15Å; L183-I187 HydrophobicContact CD1-CD1 4.47Å; L183-I187 HydrophobicContact CD2-CD1 4.11Å; L183-L196 HydrophobicContact CD1-CD2 4.3Å; L183-L198 HydrophobicContact CD1-CD1 3.86Å; L183-L198 HydrophobicContact CD2-CD1 4.11Å; L183-L198 HydrophobicContact CD2-CD2 4.05Å; L183-L198 HydrophobicContact CG-CD1 4.39Å; L183-L207 HydrophobicContact CD1-CD1 4.38Å; L183-L207 HydrophobicContact CD1-CD2 4.24Å; L183-L207 HydrophobicContact CG-CD2 4.04Å; L183-I218 HydrophobicContact CD1-CG2 3.68Å; L183-L222 HydrophobicContact CB-CD1 4.42Å
184	P	94.6	Very high	92.4	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.052	21%	0.213	C	C	.	.			trans	-64.2	147.9	173.7	26.4	-32.7	0	0	0	110	L160 E162 I164 N186 I187	L160-P184 HydrophobicContact CB-CG 3.84Å; E162-P184 VanDerWaalsContact CD-CB 3.42Å; E162-P184 HydrophobicContact CG-CB 4.29Å; E162-P184 WeakPolarHBondContact OE1-CA 3.34Å; E162-P184 VanDerWaalsContact OE1-CB 3.31Å; E162-P184 WeakPolarHBondContact OE1-CB 3.14Å; E162-P184 WeakPolarHBondContact OE2-CB 3.29Å; I164-P184 HydrophobicContact CG2-CG 3.96Å; P184-N186 PolarHBondContact O-N 3.38Å; P184-I187 HydrophobicContact CG-CB 4.33Å; P184-I187 WeakPolarHBondContact O-CG2 3.46Å; P184-I187 PolarHBondContact O-N 3.03Å
185	L	92.3	Very high	92.2	Very high	40 Å²	40	48 Å²	48	21%	0.209	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-61.3	-37.1	-177.7	-73	176.1	0	0	0	110.2	E162 I187 R188 L222 Q225	E162-L185 PolarHBondContact OE1-N 3.13Å; E162-L185 VanDerWaalsContact OE1-N 3.08Å; E162-L185 PolarHBondContact OE2-N 3.02Å; L185-I187 PolarHBondContact O-N 3.13Å; L185-R188 VanDerWaalsContact O-CD 3.22Å; L185-R188 WeakPolarHBondContact O-CD 3.22Å; L185-R188 WeakPolarHBondContact O-CG 3.33Å; L185-R188 PolarHBondContact O-N 3.32Å; L185-R188 PolarHBondContact O-NH1 3Å; L185-L222 HydrophobicContact CD2-CD2 4.35Å; L185-Q225 HydrophobicContact CD2-CB 4.32Å; L185-Q225 HydrophobicContact CD2-CG 4.3Å
186	N	93.9	Very high	92.1	Very high	48 Å²	48	49 Å²	49	26%	0.257	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-68.5	-12.9	-175.4	-69.6	-11.5	0	0	0	114.7	E162 V165 P184 R188 F189	E162-N186 VanDerWaalsContact O-CB 3.31Å; E162-N186 WeakPolarHBondContact O-CB 3.3Å; E162-N186 PolarHBondContact O-ND2 3.3Å; E162-N186 WeakPolarHBondContact OE2-CB 3.47Å; E162-N186 PolarHBondContact OE2-N 3.13Å; E162-N186 PolarHBondContact OE2-ND2 3.02Å; V165-N186 HydrophobicContact CB-CB 4.15Å; V165-N186 HydrophobicContact CG1-CB 4.31Å; P184-N186 PolarHBondContact O-N 3.38Å; N186-R188 PolarHBondContact O-N 3.46Å; N186-R188 VanDerWaalsContact O-N 3.13Å; N186-F189 HydrophobicContact CB-CD2 4.25Å; N186-F189 WeakPolarHBondContact O-CB 3.27Å; N186-F189 PolarHBondContact O-N 3.06Å
187	I	94.7	Very high	92.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-59.8	-26	174.1	-156.5	175.7	0	0	0	111.8	L160 I164 L173 L183 P184 L185 F189 M190 L196 F219 L222	L160-I187 HydrophobicContact CD2-CD1 4.45Å; I164-I187 HydrophobicContact CG2-CB 4.46Å; L173-I187 HydrophobicContact CD2-CD1 4.39Å; L183-I187 HydrophobicContact CB-CG2 4.15Å; L183-I187 HydrophobicContact CD1-CD1 4.47Å; L183-I187 HydrophobicContact CD2-CD1 4.11Å; P184-I187 HydrophobicContact CG-CB 4.33Å; P184-I187 WeakPolarHBondContact O-CG2 3.46Å; P184-I187 PolarHBondContact O-N 3.03Å; L185-I187 PolarHBondContact O-N 3.13Å; I187-F189 PolarHBondContact O-N 3.4Å; I187-F189 VanDerWaalsContact O-N 3.13Å; I187-M190 HydrophobicContact CG1-CG 4.44Å; I187-M190 HydrophobicContact CG1-SD 3.69Å; I187-M190 WeakPolarHBondContact O-CB 3.49Å; I187-M190 PolarHBondContact O-N 3.2Å; I187-L196 HydrophobicContact CD1-CD2 4.22Å; I187-F219 HydrophobicContact CG2-CE1 4.43Å; I187-F219 WeakPolarHBondContact O-CE1 3.47Å; I187-F219 VanDerWaalsContact O-CZ 3.29Å; I187-F219 WeakPolarHBondContact O-CZ 3.49Å; I187-L222 HydrophobicContact CG2-CD1 3.24Å
188	R	91.8	Very high	92.2	Very high	39 Å²	39	46 Å²	46	15%	0.147	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.4	-16.7	176.9	80	-161.7	-173.2	-85.4	10.6	113.8	L185 N186 F219 L222 N223 S226	L185-R188 VanDerWaalsContact O-CD 3.22Å; L185-R188 WeakPolarHBondContact O-CD 3.22Å; L185-R188 WeakPolarHBondContact O-CG 3.33Å; L185-R188 PolarHBondContact O-N 3.32Å; L185-R188 PolarHBondContact O-NH1 3Å; N186-R188 PolarHBondContact O-N 3.46Å; N186-R188 VanDerWaalsContact O-N 3.13Å; R188-F219 HydrophobicContact CB-CB 4.4Å; R188-F219 HydrophobicContact CB-CD1 4.24Å; R188-F219 HydrophobicContact CB-CG 4.27Å; R188-L222 HydrophobicContact CB-CB 4.2Å; R188-L222 HydrophobicContact CB-CD1 4.42Å; R188-N223 WeakPolarHBondContact CD-OD1 3.4Å; R188-N223 PolarHBondContact NE-OD1 3.19Å; R188-S226 PolarHBondContact NH2-OG 3.43Å
189	F	91.5	Very high	91.8	Very high	91 Å²	91	50.6 Å²	50.6	40%	0.399	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-91.9	1.7	176.4	-58.4	-54.4	0	0	0	113	V165 N186 I187 W191	V165-F189 HydrophobicContact CG2-CB 3.66Å; N186-F189 HydrophobicContact CB-CD2 4.25Å; N186-F189 WeakPolarHBondContact O-CB 3.27Å; N186-F189 PolarHBondContact O-N 3.06Å; I187-F189 PolarHBondContact O-N 3.4Å; I187-F189 VanDerWaalsContact O-N 3.13Å; F189-W191 VanDerWaalsContact C-N 3.29Å; F189-W191 PolarHBondContact O-N 3.12Å
190	M	92.4	Very high	91.4	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.03	25%	0.249	C	C	.	.			trans	-81.8	74.8	174.9	-61.6	-176.6	69.5	0	0	110.6	I164 L167 L170 I187 C192 L193	I164-M190 HydrophobicContact CD1-SD 4.38Å; I164-M190 HydrophobicContact CG1-CE 4.38Å; I164-M190 HydrophobicContact CG1-SD 3.95Å; I164-M190 HydrophobicContact CG2-SD 4.14Å; L167-M190 HydrophobicContact CB-CE 3.99Å; L170-M190 HydrophobicContact CB-CE 3.72Å; L170-M190 HydrophobicContact CD2-CE 3.49Å; L170-M190 VanDerWaalsContact CD2-CE 3.49Å; L170-M190 HydrophobicContact CG-CE 4.21Å; I187-M190 HydrophobicContact CG1-CG 4.44Å; I187-M190 HydrophobicContact CG1-SD 3.69Å; I187-M190 WeakPolarHBondContact O-CB 3.49Å; I187-M190 PolarHBondContact O-N 3.2Å; M190-C192 VanDerWaalsContact C-N 3.27Å; M190-C192 PolarHBondContact O-N 3.07Å; M190-L193 HydrophobicContact CB-CB 4.16Å; M190-L193 HydrophobicContact CE-CD1 4.5Å; M190-L193 VanDerWaalsContact O-CB 3.23Å; M190-L193 WeakPolarHBondContact O-CB 3.43Å; M190-L193 PolarHBondContact O-N 3.24Å; M190-L193 VanDerWaalsContact O-N 3.09Å
191	W	84.5	Confident	91.1	Very high	199 Å²	199	55.1 Å²	55.1	75%	0.754	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-22.4	-173.9	50.4	-87.3	0	0	0	114.6	F189 L193	F189-W191 VanDerWaalsContact C-N 3.29Å; F189-W191 PolarHBondContact O-N 3.12Å; W191-L193 VanDerWaalsContact C-N 3.3Å
192	C	92	Very high	91.1	Very high	28 Å²	28	53.1 Å²	53.1	19%	0.189	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.7	173.3	-74.2	0	0	0	0	114	R168 L170 K171 M190 E194	R168-C192 PolarHBondContact O-SG 3.14Å; R168-C192 VanDerWaalsContact O-SG 3.37Å; L170-C192 CarbonylContact O-C 3.28Å; L170-C192 WeakPolarHBondContact O-CB 3.49Å; K171-C192 WeakPolarHBondContact CA-O 3.5Å; M190-C192 VanDerWaalsContact C-N 3.27Å; M190-C192 PolarHBondContact O-N 3.07Å; C192-E194 PolarHBondContact O-N 2.84Å; C192-E194 VanDerWaalsContact O-N 3.09Å
193	L	91.7	Very high	91	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.068	23%	0.229	C	C	.	.			trans	-70.9	109.7	-171.5	-163	70.5	0	0	0	110.6	L170 L173 M190 W191 L196 I215 F219	L170-L193 HydrophobicContact CD2-CD1 4.22Å; L170-L193 HydrophobicContact CG-CD1 4.41Å; L170-L193 WeakPolarHBondContact O-CA 3.45Å; L170-L193 PolarHBondContact O-N 3.09Å; L173-L193 HydrophobicContact CB-CD1 3.82Å; M190-L193 HydrophobicContact CB-CB 4.16Å; M190-L193 HydrophobicContact CE-CD1 4.5Å; M190-L193 VanDerWaalsContact O-CB 3.23Å; M190-L193 WeakPolarHBondContact O-CB 3.43Å; M190-L193 PolarHBondContact O-N 3.24Å; M190-L193 VanDerWaalsContact O-N 3.09Å; W191-L193 VanDerWaalsContact C-N 3.3Å; L193-L196 HydrophobicContact CD2-CB 4.05Å; L193-L196 HydrophobicContact CD2-CD2 4.24Å; L193-I215 HydrophobicContact CB-CD1 4.39Å; L193-I215 HydrophobicContact CD2-CD1 4.18Å; L193-I215 HydrophobicContact CG-CD1 3.95Å; L193-I215 WeakPolarHBondContact O-CD1 3.27Å; L193-F219 HydrophobicContact CD2-CZ 4.33Å
194	E	91.3	Very high	90.7	Very high	131 Å²	131	50.6 Å²	50.6	61%	0.612	25%	0.245	S	C	*	.			trans	-94.3	-30.7	180	-69.3	169.3	-161.9	0	0	111.2	K171 C192	K171-E194 HydrophobicContact CB-CG 4.47Å; K171-E194 IonicContact NZ-OE1 2.84Å; K171-E194 PolarHBondContact NZ-OE1 2.99Å; K171-E194 WeakPolarHBondContact O-CA 3.48Å; K171-E194 PolarHBondContact O-N 3.3Å; C192-E194 PolarHBondContact O-N 2.84Å; C192-E194 VanDerWaalsContact O-N 3.09Å
195	K	88.8	Confident	90.1	Very high	67 Å²	67	55.1 Å²	55.1	29%	0.291	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	130.4	-178.1	-174.6	172.9	178.9	176.9	0	112.2	K171 I172 L173 N667	K171-K195 PolarHBondContact O-N 3.02Å; I172-K195 HydrophobicContact CB-CB 4.5Å; I172-K195 HydrophobicContact CG1-CB 4.19Å; I172-K195 HydrophobicContact CG2-CB 4.29Å; I172-K195 HydrophobicContact CG2-CD 4.25Å; I172-K195 HydrophobicContact CG2-CG 4.45Å; L173-K195 PolarHBondContact N-O 3.42Å; K195-N667 VanDerWaalsContact NZ-CB 3.34Å; K195-N667 PolarHBondContact NZ-ND2 3.08Å; K195-N667 VanDerWaalsContact NZ-ND2 3.11Å; K195-N667 PolarHBondContact NZ-OD1 3.01Å
196	L	93.7	Very high	89.7	Confident	21 Å²	21	54.8 Å²	54.8	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	108.4	176	178	55.6	0	0	0	109	L173 L183 I187 L193 L198 I215 I218	L173-L196 HydrophobicContact CB-CD1 4.07Å; L173-L196 HydrophobicContact CD2-CD1 3.88Å; L173-L196 HydrophobicContact CG-CD1 3.93Å; L173-L196 WeakPolarHBondContact O-CA 3.36Å; L183-L196 HydrophobicContact CD1-CD2 4.3Å; I187-L196 HydrophobicContact CD1-CD2 4.22Å; L193-L196 HydrophobicContact CD2-CB 4.05Å; L193-L196 HydrophobicContact CD2-CD2 4.24Å; L196-L198 HydrophobicContact CD1-CD1 4.27Å; L196-L198 HydrophobicContact CD1-CD2 4.32Å; L196-L198 HydrophobicContact CD1-CG 4.04Å; L196-L198 HydrophobicContact CD2-CD1 3.85Å; L196-L198 HydrophobicContact CD2-CG 4.49Å; L196-L198 HydrophobicContact CG-CD1 3.83Å; L196-L198 HydrophobicContact CG-CG 3.96Å; L196-I215 HydrophobicContact CB-CD1 3.98Å; L196-I215 HydrophobicContact CB-CG1 3.89Å; L196-I218 HydrophobicContact CD2-CD1 4.01Å
197	S	90	Very high	89.2	Confident	7 Å²	7	52.7 Å²	52.7	5%	0.049	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.7	176.8	-82.4	0	0	0	0	109.8	L173 D174 L175 E199	L173-S197 PolarHBondContact O-N 3.5Å; D174-S197 VanDerWaalsContact OD1-CB 3.26Å; D174-S197 WeakPolarHBondContact OD1-CB 3.16Å; L175-S197 CarbonylContact C-O 3.54Å; L175-S197 WeakPolarHBondContact CA-O 3.44Å; L175-S197 WeakPolarHBondContact CB-O 3.33Å; L175-S197 PolarHBondContact N-O 3.01Å; S197-E199 VanDerWaalsContact CA-OE2 3.24Å; S197-E199 WeakPolarHBondContact CA-OE2 3.17Å; S197-E199 WeakPolarHBondContact CB-OE2 3.41Å; S197-E199 PolarHBondContact OG-OE2 2.95Å
198	L	90.9	Very high	88.8	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.016	29%	0.287	C	S	.	.			trans	-134	15.8	-176.6	-69.9	168.8	0	0	0	111.5	L175 L183 L196 N201 L203 V211	L175-L198 HydrophobicContact CB-CD2 4.02Å; L175-L198 HydrophobicContact CD1-CD2 4.1Å; L183-L198 HydrophobicContact CD1-CD1 3.86Å; L183-L198 HydrophobicContact CD2-CD1 4.11Å; L183-L198 HydrophobicContact CD2-CD2 4.05Å; L183-L198 HydrophobicContact CG-CD1 4.39Å; L196-L198 HydrophobicContact CD1-CD1 4.27Å; L196-L198 HydrophobicContact CD1-CD2 4.32Å; L196-L198 HydrophobicContact CD1-CG 4.04Å; L196-L198 HydrophobicContact CD2-CD1 3.85Å; L196-L198 HydrophobicContact CD2-CG 4.49Å; L196-L198 HydrophobicContact CG-CD1 3.83Å; L196-L198 HydrophobicContact CG-CG 3.96Å; L198-N201 PolarHBondContact O-ND2 2.88Å; L198-L203 HydrophobicContact CB-CD1 4.27Å; L198-V211 HydrophobicContact CB-CG1 4.03Å; L198-V211 HydrophobicContact CD1-CG1 4.32Å; L198-V211 HydrophobicContact CD1-CG2 3.84Å
199	E	85.7	Confident	88.3	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	149.8	177.4	-59.6	84.8	172.9	0	0	110.4	H176 S177 S197 N201	H176-E199 CarbonylContact C-O 3.1Å; H176-E199 VanDerWaalsContact CA-O 3.23Å; H176-E199 WeakPolarHBondContact CA-O 3.3Å; H176-E199 HydrophobicContact CB-CB 4.35Å; S177-E199 PolarHBondContact N-O 2.8Å; S197-E199 VanDerWaalsContact CA-OE2 3.24Å; S197-E199 WeakPolarHBondContact CA-OE2 3.17Å; S197-E199 WeakPolarHBondContact CB-OE2 3.41Å; S197-E199 PolarHBondContact OG-OE2 2.95Å; E199-N201 PolarHBondContact O-N 2.98Å; E199-N201 VanDerWaalsContact O-N 3.16Å; E199-N201 PolarHBondContact O-ND2 3.45Å
200	E	84.4	Confident	87.9	Confident	98 Å²	98	54.5 Å²	54.5	46%	0.458	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	31.7	178.3	-56.4	-172.8	179.3	0	0	115.1	S177	S177-E200 WeakPolarHBondContact CA-O 3.26Å; S177-E200 WeakPolarHBondContact OG-CB 3.29Å; S177-E200 PolarHBondContact OG-OE2 3.22Å
201	N	90.8	Very high	87.4	Confident	14 Å²	14	55.6 Å²	55.6	8%	0.075	29%	0.29	C	S	.	.	S	Bend	trans	-107.3	146.6	169	-78	-92.3	0	0	0	111.1	L175 N178 G179 V180 L198 E199 L203	L175-N201 PolarHBondContact O-ND2 2.92Å; N178-N201 VanDerWaalsContact CA-OD1 3.28Å; N178-N201 WeakPolarHBondContact CA-OD1 3.32Å; N178-N201 WeakPolarHBondContact CB-OD1 3.46Å; N178-N201 PolarHBondContact N-OD1 3.33Å; N178-N201 PolarHBondContact O-OD1 3.4Å; N178-N201 VanDerWaalsContact O-OD1 3.13Å; G179-N201 PolarHBondContact N-OD1 3.19Å; V180-N201 HydrophobicContact CB-CB 4.24Å; V180-N201 VanDerWaalsContact CB-OD1 3.25Å; V180-N201 WeakPolarHBondContact CB-OD1 3.27Å; V180-N201 WeakPolarHBondContact CG2-OD1 3.14Å; V180-N201 PolarHBondContact N-OD1 2.9Å; V180-N201 WeakPolarHBondContact O-CB 3.41Å; L198-N201 PolarHBondContact O-ND2 2.88Å; E199-N201 PolarHBondContact O-N 2.98Å; E199-N201 VanDerWaalsContact O-N 3.16Å; E199-N201 PolarHBondContact O-ND2 3.45Å; N201-L203 HydrophobicContact CB-CD2 4.25Å; N201-L203 HydrophobicContact CB-CG 4.03Å; N201-L203 PolarHBondContact O-N 3.3Å
202	P	91.7	Very high	87.1	Confident	72 Å²	72	50.7 Å²	50.7	47%	0.468	29%	0.291	S	S	.	.			trans	-75.8	56.4	176.7	34.4	-37.4	0	0	0	111.9	N178 V180 K181 S204	N178-P202 WeakPolarHBondContact O-CD 3.09Å; V180-P202 CarbonylContact O-C 3.45Å; K181-P202 WeakPolarHBondContact CA-O 3.19Å; K181-P202 HydrophobicContact CG-CG 4.13Å; P202-S204 PolarHBondContact O-N 2.96Å
203	L	90.2	Very high	86.5	Confident	13 Å²	13	52.9 Å²	52.9	7%	0.068	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-63	131.9	-178.8	-62.1	170.4	0	0	0	110.6	V180 L198 N201 L207 L208 V211	V180-L203 HydrophobicContact CG1-CD2 4.4Å; V180-L203 WeakPolarHBondContact O-CD2 3.15Å; L198-L203 HydrophobicContact CB-CD1 4.27Å; N201-L203 HydrophobicContact CB-CD2 4.25Å; N201-L203 HydrophobicContact CB-CG 4.03Å; N201-L203 PolarHBondContact O-N 3.3Å; L203-L207 HydrophobicContact CD2-CD2 4.06Å; L203-L208 HydrophobicContact CB-CB 4.15Å; L203-L208 HydrophobicContact CB-CD1 4.3Å; L203-L208 HydrophobicContact CD1-CD1 4.46Å; L203-V211 HydrophobicContact CD1-CB 4.29Å; L203-V211 HydrophobicContact CD1-CG1 4.46Å; L203-V211 HydrophobicContact CD1-CG2 3.85Å
204	S	87.2	Confident	86.1	Confident	57 Å²	57	53.6 Å²	53.6	40%	0.399	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-73.6	135.4	174.5	56.2	0	0	0	0	110.9	K181 P202 L207 L208	K181-S204 PolarHBondContact O-N 3.29Å; K181-S204 PolarHBondContact O-OG 2.99Å; P202-S204 PolarHBondContact O-N 2.96Å; S204-L207 WeakPolarHBondContact O-CB 3.39Å; S204-L207 PolarHBondContact O-N 2.78Å; S204-L208 PolarHBondContact O-N 2.81Å
205	P	82.8	Confident	86	Confident	103 Å²	103	48.5 Å²	48.5	67%	0.669	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	143	164	-23.7	34	0	0	0	110.9
206	P	83.6	Confident	85.8	Confident	32 Å²	32	48.8 Å²	48.8	21%	0.208	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86.7	-3	4.9	36.2	-37.6	0	0	0	114.2	L208 T209 I210 F221 H239 T243	P206-L208 PolarHBondContact O-N 3.01Å; P206-T209 PolarHBondContact O-N 3.32Å; P206-T209 PolarHBondContact O-OG1 3.25Å; P206-I210 HydrophobicContact CB-CD1 4.09Å; P206-I210 HydrophobicContact CG-CD1 4.2Å; P206-I210 WeakPolarHBondContact O-CG1 3.06Å; P206-I210 PolarHBondContact O-N 3.29Å; P206-F221 HydrophobicContact CG-CD2 4.28Å; P206-F221 HydrophobicContact CG-CE2 3.49Å; P206-F221 VanDerWaalsContact CG-CE2 3.49Å; P206-F221 HydrophobicContact CG-CZ 4.08Å; P206-H239 HydrophobicContact CB-CB 4.49Å; P206-H239 HydrophobicContact CG-CB 4.24Å; P206-T243 HydrophobicContact CB-CG2 4.27Å
207	L	84	Confident	85.5	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-38.4	-176.4	-176.5	61.7	0	0	0	112	L183 L203 S204 T209 I210 V211 I218 F221	L183-L207 HydrophobicContact CD1-CD1 4.38Å; L183-L207 HydrophobicContact CD1-CD2 4.24Å; L183-L207 HydrophobicContact CG-CD2 4.04Å; L203-L207 HydrophobicContact CD2-CD2 4.06Å; S204-L207 WeakPolarHBondContact O-CB 3.39Å; S204-L207 PolarHBondContact O-N 2.78Å; L207-T209 VanDerWaalsContact C-N 3.27Å; L207-T209 PolarHBondContact O-N 3.44Å; L207-I210 PolarHBondContact O-N 2.99Å; L207-V211 HydrophobicContact CD1-CG2 3.97Å; L207-V211 HydrophobicContact CG-CG2 4.04Å; L207-V211 WeakPolarHBondContact O-CG2 3.29Å; L207-V211 PolarHBondContact O-N 2.72Å; L207-I218 HydrophobicContact CD1-CG2 4.32Å; L207-F221 HydrophobicContact CB-CE1 4.41Å; L207-F221 HydrophobicContact CD1-CD1 4.08Å; L207-F221 HydrophobicContact CD1-CE1 4.17Å
208	L	85	Confident	85.4	Confident	93 Å²	93	49.6 Å²	49.6	49%	0.487	29%	0.293	S	S	.	.	H	α-helix	trans	-50	-45	174.4	179.2	62.7	0	0	0	112.9	L203 S204 P206	L203-L208 HydrophobicContact CB-CB 4.15Å; L203-L208 HydrophobicContact CB-CD1 4.3Å; L203-L208 HydrophobicContact CD1-CD1 4.46Å; S204-L208 PolarHBondContact O-N 2.81Å; P206-L208 PolarHBondContact O-N 3.01Å
209	T	82.2	Confident	85.5	Confident	75 Å²	75	50.9 Å²	50.9	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-76.9	-25.4	179.5	47.8	0	0	0	0	113.4	P206 L207 T243	P206-T209 PolarHBondContact O-N 3.32Å; P206-T209 PolarHBondContact O-OG1 3.25Å; L207-T209 VanDerWaalsContact C-N 3.27Å; L207-T209 PolarHBondContact O-N 3.44Å; T209-T243 VanDerWaalsContact OG1-CG2 3.26Å; T209-T243 WeakPolarHBondContact OG1-CG2 3.31Å
210	I	82.6	Confident	85.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-82.5	-35.7	-176.1	-66.1	167	0	0	0	110.9	P206 L207 A212 R213 I218 F221 L242 T243	P206-I210 HydrophobicContact CB-CD1 4.09Å; P206-I210 HydrophobicContact CG-CD1 4.2Å; P206-I210 WeakPolarHBondContact O-CG1 3.06Å; P206-I210 PolarHBondContact O-N 3.29Å; L207-I210 PolarHBondContact O-N 2.99Å; I210-A212 VanDerWaalsContact C-N 3.27Å; I210-A212 PolarHBondContact O-N 3.49Å; I210-R213 WeakPolarHBondContact O-CB 3.39Å; I210-R213 PolarHBondContact O-N 3.38Å; I210-I218 HydrophobicContact CG2-CG1 4.18Å; I210-F221 HydrophobicContact CD1-CB 3.86Å; I210-F221 HydrophobicContact CD1-CD1 4.45Å; I210-F221 HydrophobicContact CD1-CD2 3.4Å; I210-F221 HydrophobicContact CD1-CE2 4.05Å; I210-F221 HydrophobicContact CD1-CG 3.64Å; I210-F221 HydrophobicContact CG2-CB 4.24Å; I210-L242 HydrophobicContact CD1-CB 4.49Å; I210-L242 HydrophobicContact CD1-CD1 4.27Å; I210-T243 HydrophobicContact CG1-CG2 4.31Å
211	V	81.9	Confident	85.7	Confident	29 Å²	29	42.7 Å²	42.7	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-39.4	-178.7	165.4	0	0	0	0	112.2	L198 L203 L207 R213 G214 I218	L198-V211 HydrophobicContact CB-CG1 4.03Å; L198-V211 HydrophobicContact CD1-CG1 4.32Å; L198-V211 HydrophobicContact CD1-CG2 3.84Å; L203-V211 HydrophobicContact CD1-CB 4.29Å; L203-V211 HydrophobicContact CD1-CG1 4.46Å; L203-V211 HydrophobicContact CD1-CG2 3.85Å; L207-V211 HydrophobicContact CD1-CG2 3.97Å; L207-V211 HydrophobicContact CG-CG2 4.04Å; L207-V211 WeakPolarHBondContact O-CG2 3.29Å; L207-V211 PolarHBondContact O-N 2.72Å; V211-R213 PolarHBondContact O-N 3.42Å; V211-G214 PolarHBondContact O-N 3.4Å; V211-I218 HydrophobicContact CB-CD1 4.42Å; V211-I218 HydrophobicContact CG2-CD1 3.94Å; V211-I218 HydrophobicContact CG2-CG1 4.24Å
212	A	79.1	Confident	85.7	Confident	96 Å²	96	42 Å²	42	79%	0.793	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.8	177.6	0	0	0	0	0	114	I210	I210-A212 VanDerWaalsContact C-N 3.27Å; I210-A212 PolarHBondContact O-N 3.49Å
213	R	79	Confident	85.6	Confident	75 Å²	75	42.2 Å²	42.2	28%	0.283	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-8.6	179	-54.4	179.5	68.1	104.5	-2.4	113.2	I210 V211 Y217 S245	I210-R213 WeakPolarHBondContact O-CB 3.39Å; I210-R213 PolarHBondContact O-N 3.38Å; V211-R213 PolarHBondContact O-N 3.42Å; R213-Y217 HydrophobicContact CB-CD1 4.36Å; R213-Y217 HydrophobicContact CB-CD2 3.63Å; R213-Y217 HydrophobicContact CB-CE2 4.18Å; R213-Y217 HydrophobicContact CB-CG 3.73Å; R213-Y217 VanDerWaalsContact NE-CE1 3.3Å; R213-Y217 PolarHBondContact NH2-OH 3.15Å; R213-Y217 WeakPolarHBondContact O-CD2 3.08Å; R213-S245 VanDerWaalsContact CZ-O 3.27Å; R213-S245 PolarHBondContact NH1-O 2.87Å; R213-S245 PolarHBondContact NH2-O 3.46Å
214	G	83	Confident	85.4	Confident	28 Å²	28	42.9 Å²	42.9	29%	0.289	26%	0.259	S	S	.	.			trans	92.4	176	176.3	0	0	0	0	0	115.5	V211 Y217 I218	V211-G214 PolarHBondContact O-N 3.4Å; G214-Y217 PolarHBondContact O-N 2.88Å; G214-I218 PolarHBondContact O-N 3.36Å
215	I	88.6	Confident	85.4	Confident	24 Å²	24	43 Å²	43	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-53.6	-44.9	-169.8	-62.6	173.1	0	0	0	114.1	L193 L196 Y217 I218 F219	L193-I215 HydrophobicContact CB-CD1 4.39Å; L193-I215 HydrophobicContact CD2-CD1 4.18Å; L193-I215 HydrophobicContact CG-CD1 3.95Å; L193-I215 WeakPolarHBondContact O-CD1 3.27Å; L196-I215 HydrophobicContact CB-CD1 3.98Å; L196-I215 HydrophobicContact CB-CG1 3.89Å; I215-Y217 PolarHBondContact O-N 3.4Å; I215-I218 WeakPolarHBondContact O-CB 3.2Å; I215-I218 PolarHBondContact O-N 3.1Å; I215-I218 VanDerWaalsContact O-N 3.11Å; I215-F219 HydrophobicContact CG2-CD1 4Å; I215-F219 HydrophobicContact CG2-CD2 3.88Å; I215-F219 HydrophobicContact CG2-CE1 3.68Å; I215-F219 HydrophobicContact CG2-CE2 3.55Å; I215-F219 HydrophobicContact CG2-CG 4.11Å; I215-F219 HydrophobicContact CG2-CZ 3.45Å; I215-F219 VanDerWaalsContact CG2-CZ 3.45Å; I215-F219 PolarHBondContact O-N 3.02Å
216	P	85.2	Confident	85.6	Confident	72 Å²	72	39.7 Å²	39.7	47%	0.468	23%	0.233	S	C	.	.	H	α-helix	trans	-57.7	-37.3	-178.5	-26.7	35.9	0	0	0	113.4	A220	P216-A220 WeakPolarHBondContact O-CB 3.27Å; P216-A220 PolarHBondContact O-N 3.48Å
217	Y	87.7	Confident	85.5	Confident	43 Å²	43	43.4 Å²	43.4	17%	0.169	25%	0.251	C	S	.	.	H	α-helix	trans	-75.2	-37.2	178.3	-71.5	-92.1	0	0	0	112.1	R213 G214 I215 F219 A220 F221 L242 A248 V250	R213-Y217 HydrophobicContact CB-CD1 4.36Å; R213-Y217 HydrophobicContact CB-CD2 3.63Å; R213-Y217 HydrophobicContact CB-CE2 4.18Å; R213-Y217 HydrophobicContact CB-CG 3.73Å; R213-Y217 VanDerWaalsContact NE-CE1 3.3Å; R213-Y217 PolarHBondContact NH2-OH 3.15Å; R213-Y217 WeakPolarHBondContact O-CD2 3.08Å; G214-Y217 PolarHBondContact O-N 2.88Å; I215-Y217 PolarHBondContact O-N 3.4Å; Y217-F219 VanDerWaalsContact C-N 3.31Å; Y217-F219 PolarHBondContact O-N 3.1Å; Y217-A220 PolarHBondContact O-N 3.4Å; Y217-F221 WeakPolarHBondContact O-CB 3.09Å; Y217-F221 PolarHBondContact O-N 3.08Å; Y217-L242 HydrophobicContact CD1-CD2 4.2Å; Y217-A248 PolarHBondContact OH-O 3.18Å; Y217-V250 HydrophobicContact CD1-CG2 3.93Å; Y217-V250 HydrophobicContact CD2-CG2 4.49Å; Y217-V250 HydrophobicContact CE1-CG2 3.69Å; Y217-V250 HydrophobicContact CE2-CG2 4.27Å; Y217-V250 HydrophobicContact CG-CG2 4.34Å
218	I	88.7	Confident	85.4	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-46.3	172.6	-61.6	170.6	0	0	0	109.6	L183 L196 L207 I210 V211 G214 I215 F221 L222	L183-I218 HydrophobicContact CD1-CG2 3.68Å; L196-I218 HydrophobicContact CD2-CD1 4.01Å; L207-I218 HydrophobicContact CD1-CG2 4.32Å; I210-I218 HydrophobicContact CG2-CG1 4.18Å; V211-I218 HydrophobicContact CB-CD1 4.42Å; V211-I218 HydrophobicContact CG2-CD1 3.94Å; V211-I218 HydrophobicContact CG2-CG1 4.24Å; G214-I218 PolarHBondContact O-N 3.36Å; I215-I218 WeakPolarHBondContact O-CB 3.2Å; I215-I218 PolarHBondContact O-N 3.1Å; I215-I218 VanDerWaalsContact O-N 3.11Å; I218-F221 WeakPolarHBondContact O-CB 3.46Å; I218-F221 PolarHBondContact O-N 3.19Å; I218-L222 HydrophobicContact CG2-CD1 4.06Å; I218-L222 HydrophobicContact CG2-CG 4.49Å; I218-L222 WeakPolarHBondContact O-CG 3.41Å; I218-L222 PolarHBondContact O-N 2.81Å
219	F	92	Very high	85.2	Confident	30 Å²	30	43.7 Å²	43.7	13%	0.132	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-38.8	-179.7	-70.6	2.8	0	0	0	112.1	I187 R188 L193 I215 Y217 F221 L222 N223	I187-F219 HydrophobicContact CG2-CE1 4.43Å; I187-F219 WeakPolarHBondContact O-CE1 3.47Å; I187-F219 VanDerWaalsContact O-CZ 3.29Å; I187-F219 WeakPolarHBondContact O-CZ 3.49Å; R188-F219 HydrophobicContact CB-CB 4.4Å; R188-F219 HydrophobicContact CB-CD1 4.24Å; R188-F219 HydrophobicContact CB-CG 4.27Å; L193-F219 HydrophobicContact CD2-CZ 4.33Å; I215-F219 HydrophobicContact CG2-CD1 4Å; I215-F219 HydrophobicContact CG2-CD2 3.88Å; I215-F219 HydrophobicContact CG2-CE1 3.68Å; I215-F219 HydrophobicContact CG2-CE2 3.55Å; I215-F219 HydrophobicContact CG2-CG 4.11Å; I215-F219 HydrophobicContact CG2-CZ 3.45Å; I215-F219 VanDerWaalsContact CG2-CZ 3.45Å; I215-F219 PolarHBondContact O-N 3.02Å; Y217-F219 VanDerWaalsContact C-N 3.31Å; Y217-F219 PolarHBondContact O-N 3.1Å; F219-F221 VanDerWaalsContact C-N 3.34Å; F219-F221 PolarHBondContact O-N 3.18Å; F219-L222 PolarHBondContact O-N 2.71Å; F219-N223 WeakPolarHBondContact O-CB 3.2Å; F219-N223 PolarHBondContact O-N 3.42Å; F219-N223 PolarHBondContact O-ND2 2.94Å
220	A	86.7	Confident	85	Confident	21 Å²	21	44 Å²	44	17%	0.174	26%	0.259	C	S	.	.	H	α-helix	trans	-59.6	-44	172.9	0	0	0	0	0	111.9	P216 Y217 N223 Q224 L242	P216-A220 WeakPolarHBondContact O-CB 3.27Å; P216-A220 PolarHBondContact O-N 3.48Å; Y217-A220 PolarHBondContact O-N 3.4Å; A220-N223 PolarHBondContact O-N 3.08Å; A220-Q224 WeakPolarHBondContact O-CB 3.23Å; A220-Q224 PolarHBondContact O-N 3.13Å; A220-L242 HydrophobicContact CB-CD2 4.31Å
221	F	88.4	Confident	84.7	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.053	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-49.7	174.2	168.6	-102.7	0	0	0	112.3	P206 L207 I210 Y217 I218 F219 N223 Q224 Q225 H239 L242	P206-F221 HydrophobicContact CG-CD2 4.28Å; P206-F221 HydrophobicContact CG-CE2 3.49Å; P206-F221 VanDerWaalsContact CG-CE2 3.49Å; P206-F221 HydrophobicContact CG-CZ 4.08Å; L207-F221 HydrophobicContact CB-CE1 4.41Å; L207-F221 HydrophobicContact CD1-CD1 4.08Å; L207-F221 HydrophobicContact CD1-CE1 4.17Å; I210-F221 HydrophobicContact CD1-CB 3.86Å; I210-F221 HydrophobicContact CD1-CD1 4.45Å; I210-F221 HydrophobicContact CD1-CD2 3.4Å; I210-F221 HydrophobicContact CD1-CE2 4.05Å; I210-F221 HydrophobicContact CD1-CG 3.64Å; I210-F221 HydrophobicContact CG2-CB 4.24Å; Y217-F221 WeakPolarHBondContact O-CB 3.09Å; Y217-F221 PolarHBondContact O-N 3.08Å; I218-F221 WeakPolarHBondContact O-CB 3.46Å; I218-F221 PolarHBondContact O-N 3.19Å; F219-F221 VanDerWaalsContact C-N 3.34Å; F219-F221 PolarHBondContact O-N 3.18Å; F221-N223 PolarHBondContact O-N 3.23Å; F221-Q224 PolarHBondContact O-N 3.37Å; F221-Q225 WeakPolarHBondContact O-CB 3.4Å; F221-Q225 PolarHBondContact O-N 3.27Å; F221-H239 AromaticContact CD2-CE1 3.52Å; F221-H239 AromaticContact CD2-ND1 3.58Å; F221-H239 AromaticContact CE2-CE1 3.19Å; F221-H239 WeakPolarHBondContact CE2-CE1 3.46Å; F221-H239 AromaticContact CE2-ND1 3.56Å; F221-H239 AromaticContact CE2-NE2 3.82Å; F221-L242 HydrophobicContact CB-CD1 3.8Å; F221-L242 HydrophobicContact CD2-CD1 4.35Å
222	L	91.2	Very high	84.2	Confident	1 Å²	1	55 Å²	55	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-67.9	-36.1	-178.6	-66.4	174.8	0	0	0	112.7	L183 L185 I187 R188 I218 F219 Q224 Q225 S226	L183-L222 HydrophobicContact CB-CD1 4.42Å; L185-L222 HydrophobicContact CD2-CD2 4.35Å; I187-L222 HydrophobicContact CG2-CD1 3.24Å; R188-L222 HydrophobicContact CB-CB 4.2Å; R188-L222 HydrophobicContact CB-CD1 4.42Å; I218-L222 HydrophobicContact CG2-CD1 4.06Å; I218-L222 HydrophobicContact CG2-CG 4.49Å; I218-L222 WeakPolarHBondContact O-CG 3.41Å; I218-L222 PolarHBondContact O-N 2.81Å; F219-L222 PolarHBondContact O-N 2.71Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 3.15Å; L222-Q225 PolarHBondContact O-N 3.07Å; L222-S226 WeakPolarHBondContact O-CB 3.07Å; L222-S226 PolarHBondContact O-N 3.03Å
223	N	88.8	Confident	83.9	Confident	75 Å²	75	54 Å²	54	40%	0.401	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-43.9	172	-82.7	-32.5	0	0	0	111.1	R188 F219 A220 F221 S226 L227	R188-N223 WeakPolarHBondContact CD-OD1 3.4Å; R188-N223 PolarHBondContact NE-OD1 3.19Å; F219-N223 WeakPolarHBondContact O-CB 3.2Å; F219-N223 PolarHBondContact O-N 3.42Å; F219-N223 PolarHBondContact O-ND2 2.94Å; A220-N223 PolarHBondContact O-N 3.08Å; F221-N223 PolarHBondContact O-N 3.23Å; N223-S226 WeakPolarHBondContact O-CB 3.03Å; N223-S226 PolarHBondContact O-N 3.32Å; N223-L227 PolarHBondContact O-N 3.27Å; N223-L227 VanDerWaalsContact O-N 3.12Å
224	Q	86.6	Confident	83.4	Confident	27 Å²	27	54.8 Å²	54.8	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-70.1	-41.2	179.3	-164.6	-127.7	-23	0	0	112.1	A220 F221 L222 S226 L227 C228 C235 F238 H239	A220-Q224 WeakPolarHBondContact O-CB 3.23Å; A220-Q224 PolarHBondContact O-N 3.13Å; F221-Q224 PolarHBondContact O-N 3.37Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 3.15Å; Q224-S226 VanDerWaalsContact C-N 3.3Å; Q224-S226 PolarHBondContact O-N 3.28Å; Q224-L227 WeakPolarHBondContact O-CB 3.34Å; Q224-L227 PolarHBondContact O-N 2.97Å; Q224-L227 VanDerWaalsContact O-N 3.09Å; Q224-C228 PolarHBondContact O-N 3Å; Q224-C228 PolarHBondContact O-SG 3.09Å; Q224-C235 PolarHBondContact NE2-O 2.76Å; Q224-F238 HydrophobicContact CB-CD1 4.14Å; Q224-F238 HydrophobicContact CB-CE1 3.99Å; Q224-F238 HydrophobicContact CG-CB 4.27Å; Q224-F238 HydrophobicContact CG-CD1 3.69Å; Q224-F238 HydrophobicContact CG-CD2 4.22Å; Q224-F238 HydrophobicContact CG-CE1 3.9Å; Q224-F238 HydrophobicContact CG-CE2 4.46Å; Q224-F238 HydrophobicContact CG-CG 3.82Å; Q224-F238 HydrophobicContact CG-CZ 4.3Å; Q224-F238 VanDerWaalsContact OE1-CG 3.29Å; Q224-H239 PolarHBondContact OE1-CE1 3.48Å; Q224-H239 PolarHBondContact OE1-ND1 3.09Å
225	Q	86.9	Confident	82.6	Confident	60 Å²	60	54.3 Å²	54.3	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-57.5	-43.5	172.8	-171.6	178.6	12	0	0	111.3	L185 F221 L222 L227 C228 N229	L185-Q225 HydrophobicContact CD2-CB 4.32Å; L185-Q225 HydrophobicContact CD2-CG 4.3Å; F221-Q225 WeakPolarHBondContact O-CB 3.4Å; F221-Q225 PolarHBondContact O-N 3.27Å; L222-Q225 PolarHBondContact O-N 3.07Å; Q225-L227 VanDerWaalsContact C-N 3.31Å; Q225-L227 PolarHBondContact O-N 3.26Å; Q225-C228 PolarHBondContact O-N 2.98Å; Q225-N229 WeakPolarHBondContact O-CB 3.3Å; Q225-N229 PolarHBondContact O-N 2.94Å; Q225-N229 PolarHBondContact O-OD1 2.89Å
226	S	85.8	Confident	81.5	Confident	33 Å²	33	59.9 Å²	59.9	23%	0.231	34%	0.335	C	S	.	.	H	α-helix	trans	-59.2	-40.2	174.3	-175.9	0	0	0	0	112.4	R188 L222 N223 Q224 S230	R188-S226 PolarHBondContact NH2-OG 3.43Å; L222-S226 WeakPolarHBondContact O-CB 3.07Å; L222-S226 PolarHBondContact O-N 3.03Å; N223-S226 WeakPolarHBondContact O-CB 3.03Å; N223-S226 PolarHBondContact O-N 3.32Å; Q224-S226 VanDerWaalsContact C-N 3.3Å; Q224-S226 PolarHBondContact O-N 3.28Å; S226-S230 PolarHBondContact O-N 2.96Å
227	L	83	Confident	80.4	Confident	110 Å²	110	65.7 Å²	65.7	58%	0.576	35%	0.353	S	S	*	.	H	α-helix	trans	-72	-38.8	-179.7	-136	77.9	0	0	0	112.4	N223 Q224 Q225 N229 S230 N231	N223-L227 PolarHBondContact O-N 3.27Å; N223-L227 VanDerWaalsContact O-N 3.12Å; Q224-L227 WeakPolarHBondContact O-CB 3.34Å; Q224-L227 PolarHBondContact O-N 2.97Å; Q224-L227 VanDerWaalsContact O-N 3.09Å; Q225-L227 VanDerWaalsContact C-N 3.31Å; Q225-L227 PolarHBondContact O-N 3.26Å; L227-N229 VanDerWaalsContact C-N 3.34Å; L227-S230 PolarHBondContact O-N 3.32Å; L227-S230 PolarHBondContact O-OG 3.02Å; L227-N231 WeakPolarHBondContact O-CB 3.4Å; L227-N231 PolarHBondContact O-N 2.8Å; L227-N231 VanDerWaalsContact O-N 3.12Å
228	C	81.7	Confident	79.2	Confident	10 Å²	10	68 Å²	68	7%	0.068	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-41.2	174.4	-63.7	0	0	0	0	111.6	Q224 Q225 S230 N231 N232 T233 C235	Q224-C228 PolarHBondContact O-N 3Å; Q224-C228 PolarHBondContact O-SG 3.09Å; Q225-C228 PolarHBondContact O-N 2.98Å; C228-S230 VanDerWaalsContact C-N 3.31Å; C228-S230 PolarHBondContact O-N 2.8Å; C228-N231 PolarHBondContact O-N 2.81Å; C228-N232 WeakPolarHBondContact O-CA 3.49Å; C228-N232 PolarHBondContact O-N 3Å; C228-T233 VanDerWaalsContact CB-O 3.29Å; C228-T233 WeakPolarHBondContact CB-O 3.11Å; C228-T233 PolarHBondContact O-N 2.66Å; C228-C235 HydrophobicContact CB-CB 4.27Å; C228-C235 WeakPolarHBondContact CB-SG 3.43Å; C228-C235 WeakPolarHBondContact SG-CA 3.41Å; C228-C235 WeakPolarHBondContact SG-CB 3.25Å; C228-C235 CovalentContact SG-SG 2.02Å; C228-C235 PolarHBondContact SG-SG 2.82Å
229	N	81	Confident	78.2	Confident	94 Å²	94	69.3 Å²	69.3	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-36.2	178.1	-71.2	-4.3	0	0	0	111.8	Q225 L227	Q225-N229 WeakPolarHBondContact O-CB 3.3Å; Q225-N229 PolarHBondContact O-N 2.94Å; Q225-N229 PolarHBondContact O-OD1 2.89Å; L227-N229 VanDerWaalsContact C-N 3.34Å
230	S	77.2	Confident	76.9	Confident	82 Å²	82	71.7 Å²	71.7	57%	0.573	38%	0.384	S	S	*	.	H	α-helix	trans	-73.9	-34	176.6	64.1	0	0	0	0	112.9	S226 L227 C228	S226-S230 PolarHBondContact O-N 2.96Å; L227-S230 PolarHBondContact O-N 3.32Å; L227-S230 PolarHBondContact O-OG 3.02Å; C228-S230 VanDerWaalsContact C-N 3.31Å; C228-S230 PolarHBondContact O-N 2.8Å
231	N	76.2	Confident	76	Confident	101 Å²	101	73.6 Å²	73.6	54%	0.54	40%	0.396	S	S	.	.	H	α-helix	trans	-94.5	-2.2	-174.4	-63.5	-8.6	0	0	0	113.5	L227 C228 T233	L227-N231 WeakPolarHBondContact O-CB 3.4Å; L227-N231 PolarHBondContact O-N 2.8Å; L227-N231 VanDerWaalsContact O-N 3.12Å; C228-N231 PolarHBondContact O-N 2.81Å; N231-T233 HydrophobicContact CB-CG2 3.87Å; N231-T233 PolarHBondContact O-N 3.49Å
232	N	72	Confident	74.8	Confident	157 Å²	157	73.4 Å²	73.4	84%	0.84	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	34.6	-169.8	-70.6	-26.4	0	0	0	113.1	C228	C228-N232 WeakPolarHBondContact O-CA 3.49Å; C228-N232 PolarHBondContact O-N 3Å
233	T	72.1	Confident	73.5	Confident	77 Å²	77	75.7 Å²	75.7	47%	0.472	41%	0.41	S	S	.	.			trans	-104.2	144.9	-178.6	53.9	0	0	0	0	111.7	C228 N231	C228-T233 VanDerWaalsContact CB-O 3.29Å; C228-T233 WeakPolarHBondContact CB-O 3.11Å; C228-T233 PolarHBondContact O-N 2.66Å; N231-T233 HydrophobicContact CB-CG2 3.87Å; N231-T233 PolarHBondContact O-N 3.49Å
234	S	69.3	Low	72	Confident	90 Å²	90	78.9 Å²	78.9	63%	0.629	42%	0.423	S	S	*	.			trans	-65.9	130.8	174.3	176.8	0	0	0	0	111.9	E236	S234-E236 WeakPolarHBondContact OG-CG 3.49Å; S234-E236 PolarHBondContact OG-N 3.28Å
235	C	65.9	Low	70.2	Confident	19 Å²	19	78.9 Å²	78.9	13%	0.128	43%	0.425	C	S	.	.			trans	-84	-6.3	177.5	-67.6	0	0	0	0	114.7	Q224 C228 K237 F238 H239	Q224-C235 PolarHBondContact NE2-O 2.76Å; C228-C235 HydrophobicContact CB-CB 4.27Å; C228-C235 WeakPolarHBondContact CB-SG 3.43Å; C228-C235 WeakPolarHBondContact SG-CA 3.41Å; C228-C235 WeakPolarHBondContact SG-CB 3.25Å; C228-C235 CovalentContact SG-SG 2.02Å; C228-C235 PolarHBondContact SG-SG 2.82Å; C235-K237 VanDerWaalsContact C-N 3.34Å; C235-K237 PolarHBondContact O-N 3.46Å; C235-K237 VanDerWaalsContact O-N 3.16Å; C235-F238 PolarHBondContact O-N 3.11Å; C235-F238 VanDerWaalsContact O-N 3.1Å; C235-H239 WeakPolarHBondContact CB-NE2 3.44Å; C235-H239 PolarHBondContact O-N 3.5Å
236	E	64.9	Low	68.1	Low	141 Å²	141	81.9 Å²	81.9	66%	0.659	45%	0.453	S	S	*	.	H	α-helix	trans	-51.8	-46.5	-164.6	-74.6	175.7	165.8	0	0	113.4	S234 F238 H239 D240	S234-E236 WeakPolarHBondContact OG-CG 3.49Å; S234-E236 PolarHBondContact OG-N 3.28Å; E236-F238 VanDerWaalsContact C-N 3.26Å; E236-F238 PolarHBondContact O-N 3.41Å; E236-F238 VanDerWaalsContact O-N 3.16Å; E236-H239 PolarHBondContact O-N 2.94Å; E236-D240 PolarHBondContact O-N 3.48Å
237	K	61.8	Low	65.7	Low	193 Å²	193	84.5 Å²	84.5	84%	0.839	47%	0.471	S	S	*	.	H	α-helix	trans	-60.6	-29.1	-176.4	-69.9	-174.6	178.6	179.1	0	114.7	C235	C235-K237 VanDerWaalsContact C-N 3.34Å; C235-K237 PolarHBondContact O-N 3.46Å; C235-K237 VanDerWaalsContact O-N 3.16Å
238	F	63.9	Low	63.4	Low	91 Å²	91	80.4 Å²	80.4	40%	0.399	45%	0.454	S	S	.	.	H	α-helix	trans	-89.9	-30.4	-178.6	-168.7	-83.3	0	0	0	111.7	Q224 C235 E236 D240 S241 L242	Q224-F238 HydrophobicContact CB-CD1 4.14Å; Q224-F238 HydrophobicContact CB-CE1 3.99Å; Q224-F238 HydrophobicContact CG-CB 4.27Å; Q224-F238 HydrophobicContact CG-CD1 3.69Å; Q224-F238 HydrophobicContact CG-CD2 4.22Å; Q224-F238 HydrophobicContact CG-CE1 3.9Å; Q224-F238 HydrophobicContact CG-CE2 4.46Å; Q224-F238 HydrophobicContact CG-CG 3.82Å; Q224-F238 HydrophobicContact CG-CZ 4.3Å; Q224-F238 VanDerWaalsContact OE1-CG 3.29Å; C235-F238 PolarHBondContact O-N 3.11Å; C235-F238 VanDerWaalsContact O-N 3.1Å; E236-F238 VanDerWaalsContact C-N 3.26Å; E236-F238 PolarHBondContact O-N 3.41Å; E236-F238 VanDerWaalsContact O-N 3.16Å; F238-D240 PolarHBondContact O-N 3.12Å; F238-S241 WeakPolarHBondContact O-CA 3.34Å; F238-S241 WeakPolarHBondContact O-CB 3.49Å; F238-S241 PolarHBondContact O-N 2.82Å; F238-L242 HydrophobicContact CD1-CD1 3.74Å; F238-L242 HydrophobicContact CD1-CG 3.78Å; F238-L242 HydrophobicContact CE1-CD1 3.63Å; F238-L242 HydrophobicContact CE1-CD2 3.97Å; F238-L242 HydrophobicContact CE1-CG 3.64Å; F238-L242 PolarHBondContact O-N 3.4Å
239	H	67.6	Low	61.3	Low	32 Å²	32	88.6 Å²	88.6	15%	0.148	49%	0.49	C	S	.	.	H	α-helix	trans	-58.9	-38.1	173.1	-65.2	-26.1	0	0	0	110.5	P206 F221 Q224 C235 E236 S241 L242 T243	P206-H239 HydrophobicContact CB-CB 4.49Å; P206-H239 HydrophobicContact CG-CB 4.24Å; F221-H239 AromaticContact CD2-CE1 3.52Å; F221-H239 AromaticContact CD2-ND1 3.58Å; F221-H239 AromaticContact CE2-CE1 3.19Å; F221-H239 WeakPolarHBondContact CE2-CE1 3.46Å; F221-H239 AromaticContact CE2-ND1 3.56Å; F221-H239 AromaticContact CE2-NE2 3.82Å; Q224-H239 PolarHBondContact OE1-CE1 3.48Å; Q224-H239 PolarHBondContact OE1-ND1 3.09Å; C235-H239 WeakPolarHBondContact CB-NE2 3.44Å; C235-H239 PolarHBondContact O-N 3.5Å; E236-H239 PolarHBondContact O-N 2.94Å; H239-S241 PolarHBondContact O-N 3.45Å; H239-L242 PolarHBondContact O-N 3.32Å; H239-T243 WeakPolarHBondContact O-CB 3.38Å; H239-T243 VanDerWaalsContact O-CG2 3.27Å; H239-T243 WeakPolarHBondContact O-CG2 3.18Å; H239-T243 PolarHBondContact O-N 2.89Å; H239-T243 PolarHBondContact O-OG1 3.24Å
240	D	64.5	Low	59.2	Low	79 Å²	79	86.5 Å²	86.5	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-57.2	-45.4	169.3	-73.2	-23.7	0	0	0	112.1	E236 F238 L242 T243 Q244	E236-D240 PolarHBondContact O-N 3.48Å; F238-D240 PolarHBondContact O-N 3.12Å; D240-L242 PolarHBondContact O-N 3.46Å; D240-T243 WeakPolarHBondContact CA-OG1 3.36Å; D240-T243 PolarHBondContact O-N 3.2Å; D240-T243 PolarHBondContact O-OG1 2.89Å; D240-Q244 WeakPolarHBondContact O-CB 3.43Å; D240-Q244 WeakPolarHBondContact O-CG 3.41Å; D240-Q244 PolarHBondContact O-N 2.94Å; D240-Q244 PolarHBondContact OD1-NE2 2.63Å
241	S	66.3	Low	57.1	Low	61 Å²	61	89.3 Å²	89.3	43%	0.427	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-38.2	178.6	-171.4	0	0	0	0	113.4	F238 H239 S245	F238-S241 WeakPolarHBondContact O-CA 3.34Å; F238-S241 WeakPolarHBondContact O-CB 3.49Å; F238-S241 PolarHBondContact O-N 2.82Å; H239-S241 PolarHBondContact O-N 3.45Å; S241-S245 PolarHBondContact O-OG 3.38Å
242	L	63.5	Low	55	Low	8 Å²	8	91 Å²	91	4%	0.042	50%	0.497	C	S	.	.	H	α-helix	trans	-72.9	-28.2	177.7	-71.8	176.7	0	0	0	112.7	I210 Y217 A220 F221 F238 H239 D240	I210-L242 HydrophobicContact CD1-CB 4.49Å; I210-L242 HydrophobicContact CD1-CD1 4.27Å; Y217-L242 HydrophobicContact CD1-CD2 4.2Å; A220-L242 HydrophobicContact CB-CD2 4.31Å; F221-L242 HydrophobicContact CB-CD1 3.8Å; F221-L242 HydrophobicContact CD2-CD1 4.35Å; F238-L242 HydrophobicContact CD1-CD1 3.74Å; F238-L242 HydrophobicContact CD1-CG 3.78Å; F238-L242 HydrophobicContact CE1-CD1 3.63Å; F238-L242 HydrophobicContact CE1-CD2 3.97Å; F238-L242 HydrophobicContact CE1-CG 3.64Å; F238-L242 PolarHBondContact O-N 3.4Å; H239-L242 PolarHBondContact O-N 3.32Å; D240-L242 PolarHBondContact O-N 3.46Å
243	T	63.5	Low	52.9	Low	50 Å²	50	88 Å²	88	31%	0.307	48%	0.484	S	S	.	.	H	α-helix	trans	-94.2	-33.9	-177	55.6	0	0	0	0	113.3	P206 T209 I210 H239 D240	P206-T243 HydrophobicContact CB-CG2 4.27Å; T209-T243 VanDerWaalsContact OG1-CG2 3.26Å; T209-T243 WeakPolarHBondContact OG1-CG2 3.31Å; I210-T243 HydrophobicContact CG1-CG2 4.31Å; H239-T243 WeakPolarHBondContact O-CB 3.38Å; H239-T243 VanDerWaalsContact O-CG2 3.27Å; H239-T243 WeakPolarHBondContact O-CG2 3.18Å; H239-T243 PolarHBondContact O-N 2.89Å; H239-T243 PolarHBondContact O-OG1 3.24Å; D240-T243 WeakPolarHBondContact CA-OG1 3.36Å; D240-T243 PolarHBondContact O-N 3.2Å; D240-T243 PolarHBondContact O-OG1 2.89Å
244	Q	59	Low	50.7	Low	142 Å²	142	88.7 Å²	88.7	66%	0.664	49%	0.492	S	S	*	.	H	α-helix	trans	-92.6	-23.8	-170.5	-63.1	176	14.8	0	0	114.6	D240	D240-Q244 WeakPolarHBondContact O-CB 3.43Å; D240-Q244 WeakPolarHBondContact O-CG 3.41Å; D240-Q244 PolarHBondContact O-N 2.94Å; D240-Q244 PolarHBondContact OD1-NE2 2.63Å
245	S	47.6	Very low	48.8	Very low	26 Å²	26	90.1 Å²	90.1	18%	0.182	49%	0.493	C	S	.	.			trans	-91.7	124.6	-173.4	69.4	0	0	0	0	112.5	R213 S241 S247 A248	R213-S245 VanDerWaalsContact CZ-O 3.27Å; R213-S245 PolarHBondContact NH1-O 2.87Å; R213-S245 PolarHBondContact NH2-O 3.46Å; S241-S245 PolarHBondContact O-OG 3.38Å; S245-S247 PolarHBondContact O-N 3.18Å; S245-A248 WeakPolarHBondContact OG-CB 3.28Å; S245-A248 PolarHBondContact OG-N 3.49Å
246	S	43.7	Very low	47.1	Very low	124 Å²	124	97.8 Å²	97.8	87%	0.867	53%	0.527	S	S	*	.	S	Bend	trans	-70.4	-7.9	165.3	45.6	0	0	0	0	112.5
247	S	35.2	Very low	45.3	Very low	87 Å²	87	99.8 Å²	99.8	61%	0.608	54%	0.536	S	S	*	.			trans	-137.5	12.7	-167.7	64.3	0	0	0	0	116.3	S245 H249	S245-S247 PolarHBondContact O-N 3.18Å; S247-H249 PolarHBondContact O-N 3.31Å
248	A	34.2	Very low	43.6	Very low	25 Å²	25	96.8 Å²	96.8	21%	0.207	53%	0.53	C	S	.	.			trans	-59.2	101.9	172.1	0	0	0	0	0	109.7	Y217 S245 V250	Y217-A248 PolarHBondContact OH-O 3.18Å; S245-A248 WeakPolarHBondContact OG-CB 3.28Å; S245-A248 PolarHBondContact OG-N 3.49Å; A248-V250 PolarHBondContact O-N 2.94Å
249	H	36.8	Very low	41.7	Very low	181 Å²	181	97.3 Å²	97.3	84%	0.838	55%	0.55	S	S	*	*			trans	-62.4	101.5	165.9	-80.3	-54.2	0	0	0	107	S247 I251	S247-H249 PolarHBondContact O-N 3.31Å; H249-I251 VanDerWaalsContact C-N 3.34Å; H249-I251 PolarHBondContact O-N 3.41Å
250	V	37.5	Very low	39.6	Very low	51 Å²	51	103.8 Å²	103.8	31%	0.309	58%	0.583	S	S	.	*			trans	-63.1	102.9	165	179.9	0	0	0	0	105.6	Y217 A248 N252	Y217-V250 HydrophobicContact CD1-CG2 3.93Å; Y217-V250 HydrophobicContact CD2-CG2 4.49Å; Y217-V250 HydrophobicContact CE1-CG2 3.69Å; Y217-V250 HydrophobicContact CE2-CG2 4.27Å; Y217-V250 HydrophobicContact CG-CG2 4.34Å; A248-V250 PolarHBondContact O-N 2.94Å; V250-N252 VanDerWaalsContact C-N 3.27Å; V250-N252 PolarHBondContact O-N 3.34Å
251	I	34.4	Very low	37.8	Very low	141 Å²	141	108 Å²	108	72%	0.723	60%	0.597	S	S	*	*			trans	-63.6	102.2	165.4	-58.4	173.9	0	0	0	104	H249 T253	H249-I251 VanDerWaalsContact C-N 3.34Å; H249-I251 PolarHBondContact O-N 3.41Å; I251-T253 HydrophobicContact CG2-CG2 4.07Å; I251-T253 PolarHBondContact O-N 2.96Å
252	N	31.5	Very low	35.9	Very low	136 Å²	136	111.8 Å²	111.8	73%	0.727	61%	0.612	S	S	*	*			trans	-67.4	85.5	173.1	-150.1	10.8	0	0	0	105.3	V250 S254	V250-N252 VanDerWaalsContact C-N 3.27Å; V250-N252 PolarHBondContact O-N 3.34Å; N252-S254 PolarHBondContact O-N 3.12Å
253	T	27.1	Very low	34	Very low	93 Å²	93	117.1 Å²	117.1	57%	0.571	65%	0.647	S	S	*	*			trans	-66.8	89	170	52	0	0	0	0	105.1	I251 N255	I251-T253 HydrophobicContact CG2-CG2 4.07Å; I251-T253 PolarHBondContact O-N 2.96Å; T253-N255 PolarHBondContact O-N 3.24Å
254	S	26.7	Very low	32.2	Very low	92 Å²	92	121.8 Å²	121.8	64%	0.643	67%	0.666	S	S	*	*			trans	-60.6	85.4	165.1	55.8	0	0	0	0	106.5	N252 Q256	N252-S254 PolarHBondContact O-N 3.12Å; S254-Q256 PolarHBondContact O-N 3.13Å
255	N	29.1	Very low	30.6	Very low	120 Å²	120	119.5 Å²	119.5	64%	0.642	67%	0.665	S	S	*	*			trans	-70.7	70.4	171.5	-81.1	-13.5	0	0	0	107.8	T253 Q257	T253-N255 PolarHBondContact O-N 3.24Å; N255-Q257 PolarHBondContact O-N 3.15Å
256	Q	29.9	Very low	29.5	Very low	181 Å²	181	127 Å²	127	85%	0.846	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-7.3	170.9	-77.1	-169.2	-12.9	0	0	112.1	S254	S254-Q256 PolarHBondContact O-N 3.13Å
257	Q	27.3	Very low	28.5	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-3.7	-172.8	-73.9	-173.1	-14.8	0	0	116.6	N255	N255-Q257 PolarHBondContact O-N 3.15Å
258	N	26.4	Very low	28	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	70%	0.701	S	S	*	*			trans	-111.9	70	174.5	-71.8	-10.6	0	0	0	110.7	M260	N258-M260 PolarHBondContact O-N 3.39Å
259	A	24.4	Very low	27.4	Very low	101 Å²	101	137.4 Å²	137.4	84%	0.835	73%	0.727	S	S	*	*			trans	-64.4	85.8	156	0	0	0	0	0	107.4	K261	A259-K261 PolarHBondContact O-N 2.78Å
260	M	23.8	Very low	26.9	Very low	168 Å²	168	134.1 Å²	134.1	83%	0.828	72%	0.724	S	S	*	*			trans	-66.5	99.3	175.3	-151.8	170.3	-169.1	0	0	106.8	N258 L262	N258-M260 PolarHBondContact O-N 3.39Å; M260-L262 PolarHBondContact O-N 3.15Å
261	K	25.1	Very low	26.3	Very low	167 Å²	167	139.8 Å²	139.8	73%	0.726	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-51.8	119.2	165.1	-116.3	-171.4	174	-154.9	0	106.3	A259 E264	A259-K261 PolarHBondContact O-N 2.78Å; K261-E264 IonicContact NZ-OE1 2.66Å; K261-E264 PolarHBondContact NZ-OE1 3.47Å
262	L	26.5	Very low	25.9	Very low	141 Å²	141	138.3 Å²	138.3	74%	0.738	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-54.6	144.9	168.3	-108.9	88	0	0	0	108.2	M260 E264	M260-L262 PolarHBondContact O-N 3.15Å; L262-E264 PolarHBondContact O-N 2.71Å; L262-E264 VanDerWaalsContact O-N 3.09Å
263	P	25.1	Very low	25.8	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-58	121.2	173.9	-10.7	24.1	0	0	0	107.8	S265	P263-S265 PolarHBondContact O-N 3.01Å
264	E	25.5	Very low	25.6	Very low	149 Å²	149	138.4 Å²	138.4	70%	0.696	77%	0.77	S	S	*	*			trans	-55.5	104.4	175.5	-75.6	164	-170.8	0	0	107.4	K261 L262 Q266	K261-E264 IonicContact NZ-OE1 2.66Å; K261-E264 PolarHBondContact NZ-OE1 3.47Å; L262-E264 PolarHBondContact O-N 2.71Å; L262-E264 VanDerWaalsContact O-N 3.09Å; E264-Q266 PolarHBondContact O-N 2.66Å
265	S	25.4	Very low	25.7	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	78%	0.777	S	S	*	*			trans	-61.3	119.7	165.6	45.2	0	0	0	0	106.1	P263 Y267	P263-S265 PolarHBondContact O-N 3.01Å; S265-Y267 PolarHBondContact O-N 3.47Å
266	Q	23.3	Very low	25.5	Very low	185 Å²	185	141.8 Å²	141.8	86%	0.864	79%	0.785	S	S	*	*			trans	-62.3	82.5	177.4	-70.2	174.4	-34.8	0	0	109.5	E264	E264-Q266 PolarHBondContact O-N 2.66Å
267	Y	23.7	Very low	25.2	Very low	212 Å²	212	142.5 Å²	142.5	83%	0.831	79%	0.785	S	S	*	*			trans	-94.4	95.1	156.9	-83.6	-81.6	0	0	0	107	S265 T269	S265-Y267 PolarHBondContact O-N 3.47Å; Y267-T269 PolarHBondContact O-N 3.41Å
268	V	23.6	Very low	25.1	Very low	119 Å²	119	142.2 Å²	142.2	72%	0.721	78%	0.784	S	S	*	*			trans	-68.2	115.1	171	172.8	0	0	0	0	108.2
269	T	23	Very low	25	Very low	122 Å²	122	145.2 Å²	145.2	75%	0.748	79%	0.791	S	S	*	*			trans	59.4	118	149.8	64.3	0	0	0	0	119.3	Y267	Y267-T269 PolarHBondContact O-N 3.41Å
270	S	25.8	Very low	25	Very low	112 Å²	112	146 Å²	146	78%	0.783	79%	0.785	S	S	*	*				-165.5	123.8	103.7	55.2	0	0	0	0	109.8	S272	S270-S272 PolarHBondContact O-N 3.37Å
271	D	24.3	Very low	24.9	Very low	170 Å²	170	146.4 Å²	146.4	91%	0.909	79%	0.785	S	S	*	*			trans	-51.5	124.8	174.9	-64	-53.4	0	0	0	112.1
272	S	27.6	Very low	24.9	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	79%	0.785	S	S	*	*			trans	-141	104.1	152.4	64.8	0	0	0	0	107.8	S270 S274	S270-S272 PolarHBondContact O-N 3.37Å; S272-S274 PolarHBondContact O-N 3Å
273	S	27.7	Very low	24.7	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	79%	0.788	S	S	*	*			trans	-29.8	111.4	172.5	50.1	0	0	0	0	113.7	Q275	S273-Q275 PolarHBondContact O-N 2.89Å; S273-Q275 VanDerWaalsContact O-N 3.1Å
274	S	24.7	Very low	24.7	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	79%	0.787	S	S	*	*			trans	-62.9	100.4	161.2	49.8	0	0	0	0	109.4	S272 S276	S272-S274 PolarHBondContact O-N 3Å; S274-S276 PolarHBondContact O-N 3.28Å
275	Q	27.5	Very low	24.5	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	79%	0.79	S	S	*	*			trans	-73.6	115.3	154.6	-83.3	-178.1	-14.1	0	0	107.5	S273 F277	S273-Q275 PolarHBondContact O-N 2.89Å; S273-Q275 VanDerWaalsContact O-N 3.1Å; Q275-F277 PolarHBondContact O-N 3.22Å
276	S	24.9	Very low	24.5	Very low	113 Å²	113	151 Å²	151	79%	0.79	80%	0.799	S	S	*	*			trans	-51.5	102	172.7	47.7	0	0	0	0	110.6	S274 E278	S274-S276 PolarHBondContact O-N 3.28Å; S276-E278 PolarHBondContact O-N 3.35Å
277	F	23.4	Very low	24.5	Very low	197 Å²	197	147.3 Å²	147.3	86%	0.864	78%	0.784	S	S	*	*			trans	-71	109.5	158.1	-86.6	-87.8	0	0	0	107.4	Q275 K279	Q275-F277 PolarHBondContact O-N 3.22Å; F277-K279 PolarHBondContact O-N 3.21Å; F277-K279 VanDerWaalsContact O-N 3.15Å
278	E	26.4	Very low	24.5	Very low	176 Å²	176	145 Å²	145	82%	0.822	78%	0.781	S	S	*	*			trans	-49.3	119.7	167.6	-81	178.4	144	0	0	108.8	S276 T280	S276-E278 PolarHBondContact O-N 3.35Å; E278-T280 VanDerWaalsContact C-N 3.28Å; E278-T280 PolarHBondContact O-N 2.82Å
279	K	24.6	Very low	24.4	Very low	193 Å²	193	148.9 Å²	148.9	84%	0.839	78%	0.783	S	S	*	*			trans	-61.7	95.6	165.9	-72.7	176.3	176.8	177.1	0	107.2	F277 E281	F277-K279 PolarHBondContact O-N 3.21Å; F277-K279 VanDerWaalsContact O-N 3.15Å; K279-E281 PolarHBondContact O-N 3.25Å
280	T	22.9	Very low	24.5	Very low	117 Å²	117	152.8 Å²	152.8	72%	0.718	79%	0.785	S	S	*	*			trans	-65.8	92.3	155	44.6	0	0	0	0	106.7	E278 I282	E278-T280 VanDerWaalsContact C-N 3.28Å; E278-T280 PolarHBondContact O-N 2.82Å; T280-I282 PolarHBondContact O-N 2.7Å
281	E	23.4	Very low	24.4	Very low	178 Å²	178	154.9 Å²	154.9	83%	0.832	79%	0.786	S	S	*	*			trans	-58.5	91.7	161.1	-76.1	-178.2	161.6	0	0	107.3	K279 N283	K279-E281 PolarHBondContact O-N 3.25Å; E281-N283 PolarHBondContact O-N 3.07Å
282	I	23.6	Very low	24.4	Very low	140 Å²	140	151.6 Å²	151.6	72%	0.718	78%	0.777	S	S	*	*			trans	-68.7	105.5	166.5	-62.9	174.2	0	0	0	105.4	T280 T284	T280-I282 PolarHBondContact O-N 2.7Å; I282-T284 VanDerWaalsContact C-N 3.3Å; I282-T284 PolarHBondContact O-N 3.14Å
283	N	23.5	Very low	24.3	Very low	150 Å²	150	156.3 Å²	156.3	80%	0.802	78%	0.783	S	S	*	*			trans	-44.9	91.3	166.1	-109.8	-21.6	0	0	0	109.8	E281 D285	E281-N283 PolarHBondContact O-N 3.07Å; N283-D285 PolarHBondContact O-N 2.93Å
284	T	23.8	Very low	24.2	Very low	123 Å²	123	155.3 Å²	155.3	76%	0.755	78%	0.776	S	S	*	*			trans	-87	80.2	159.5	56.3	0	0	0	0	106.8	I282 Y286	I282-T284 VanDerWaalsContact C-N 3.3Å; I282-T284 PolarHBondContact O-N 3.14Å; T284-Y286 VanDerWaalsContact C-N 3.28Å; T284-Y286 PolarHBondContact O-N 3.34Å
285	D	22.2	Very low	24.2	Very low	144 Å²	144	158.5 Å²	158.5	77%	0.77	78%	0.778	S	S	*	*			trans	-67.3	89.9	167.4	-144.1	1.7	0	0	0	107.1	N283	N283-D285 PolarHBondContact O-N 2.93Å
286	Y	24.5	Very low	24	Very low	210 Å²	210	158 Å²	158	82%	0.824	78%	0.779	S	S	*	*			trans	-138.3	89.7	167.6	-101.6	-75.5	0	0	0	109.4	T284 Q288	T284-Y286 VanDerWaalsContact C-N 3.28Å; T284-Y286 PolarHBondContact O-N 3.34Å; Y286-Q288 PolarHBondContact O-N 2.72Å
287	D	24.1	Very low	23.9	Very low	106 Å²	106	158.5 Å²	158.5	57%	0.567	78%	0.778	S	S	*	*			trans	47	69.8	149.3	-82.6	-53	0	0	0	116.3	R289	D287-R289 PolarHBondContact O-N 3.16Å; D287-R289 VanDerWaalsContact O-N 3.11Å; D287-R289 IonicContact OD1-CZ 3.53Å; D287-R289 IonicContact OD1-NE 2.83Å; D287-R289 PolarHBondContact OD1-NE 2.91Å; D287-R289 VanDerWaalsContact OD1-NE 3.08Å; D287-R289 IonicContact OD1-NH2 3.08Å
288	Q	22.6	Very low	23.9	Very low	164 Å²	164	156.2 Å²	156.2	77%	0.766	77%	0.774	S	S	*	*			trans	-75.7	71.4	146.3	-72.1	-162.9	2	0	0	109.7	Y286 Y290	Y286-Q288 PolarHBondContact O-N 2.72Å; Q288-Y290 VanDerWaalsContact C-N 3.27Å; Q288-Y290 PolarHBondContact O-N 3.17Å
289	R	22.8	Very low	23.7	Very low	201 Å²	201	153.5 Å²	153.5	76%	0.758	77%	0.772	S	S	*	*			trans	-76	92.3	160.2	-71.7	-171.8	-148.4	179.6	6.2	108.2	D287 I291	D287-R289 PolarHBondContact O-N 3.16Å; D287-R289 VanDerWaalsContact O-N 3.11Å; D287-R289 IonicContact OD1-CZ 3.53Å; D287-R289 IonicContact OD1-NE 2.83Å; D287-R289 PolarHBondContact OD1-NE 2.91Å; D287-R289 VanDerWaalsContact OD1-NE 3.08Å; D287-R289 IonicContact OD1-NH2 3.08Å; R289-I291 PolarHBondContact O-N 3.39Å
290	Y	24.3	Very low	23.6	Very low	203 Å²	203	149.5 Å²	149.5	80%	0.796	77%	0.768	S	S	*	*			trans	-39	102.4	157.8	-82.2	-98	0	0	0	110	Q288 S292	Q288-Y290 VanDerWaalsContact C-N 3.27Å; Q288-Y290 PolarHBondContact O-N 3.17Å; Y290-S292 PolarHBondContact O-N 3.12Å
291	I	23.3	Very low	23.7	Very low	157 Å²	157	151.2 Å²	151.2	81%	0.805	77%	0.773	S	S	*	*			trans	-75.3	109.9	156.6	-63.5	176.3	0	0	0	104.8	R289 K293	R289-I291 PolarHBondContact O-N 3.39Å; I291-K293 PolarHBondContact O-N 3.27Å
292	S	24.1	Very low	23.8	Very low	101 Å²	101	149.7 Å²	149.7	71%	0.706	77%	0.768	S	S	*	*			trans	-46.4	124.9	177.7	36.8	0	0	0	0	110.9	Y290 S294	Y290-S292 PolarHBondContact O-N 3.12Å; S292-S294 PolarHBondContact O-N 3.04Å
293	K	26.3	Very low	23.8	Very low	209 Å²	209	150.2 Å²	150.2	91%	0.909	77%	0.771	S	S	*	*			trans	-57.8	99.6	169.4	-71.7	175	177	176.6	0	108.2	I291 E295	I291-K293 PolarHBondContact O-N 3.27Å; K293-E295 PolarHBondContact O-N 3.24Å; K293-E295 VanDerWaalsContact O-N 3.16Å
294	S	24.6	Very low	23.8	Very low	92 Å²	92	151.4 Å²	151.4	64%	0.643	77%	0.772	S	S	*	*			trans	-70.9	106	165.1	41.6	0	0	0	0	107.9	S292 I296	S292-S294 PolarHBondContact O-N 3.04Å; S294-I296 PolarHBondContact O-N 3.45Å; S294-I296 VanDerWaalsContact O-N 3.09Å
295	E	25.2	Very low	23.8	Very low	184 Å²	184	152.6 Å²	152.6	86%	0.86	77%	0.774	S	S	*	*			trans	22.7	78.7	144.6	-63.7	176	168	0	0	115.4	K293 T297	K293-E295 PolarHBondContact O-N 3.24Å; K293-E295 VanDerWaalsContact O-N 3.16Å; E295-T297 PolarHBondContact O-N 2.77Å
296	I	24.3	Very low	23.9	Very low	160 Å²	160	150.7 Å²	150.7	82%	0.821	77%	0.771	S	S	*	*			trans	-88.5	96.8	150.5	-59.9	176.8	0	0	0	104.8	S294 N298	S294-I296 PolarHBondContact O-N 3.45Å; S294-I296 VanDerWaalsContact O-N 3.09Å; I296-N298 PolarHBondContact O-N 3.32Å; I296-N298 VanDerWaalsContact O-N 3.08Å
297	T	22.2	Very low	23.7	Very low	124 Å²	124	146.7 Å²	146.7	76%	0.761	77%	0.769	S	S	*	*			trans	-51.7	109.4	168.9	31.2	0	0	0	0	109.1	E295 P299	E295-T297 PolarHBondContact O-N 2.77Å; T297-P299 WeakPolarHBondContact O-CD 3.32Å
298	N	23	Very low	23.5	Very low	148 Å²	148	151.7 Å²	151.7	79%	0.791	78%	0.782	S	S	*	*			trans	-55.4	119.9	167.8	-94.2	-30.5	0	0	0	108.5	I296 S300	I296-N298 PolarHBondContact O-N 3.32Å; I296-N298 VanDerWaalsContact O-N 3.08Å; N298-S300 PolarHBondContact O-N 2.98Å
299	P	23.1	Very low	23.4	Very low	119 Å²	119	149.5 Å²	149.5	77%	0.773	78%	0.784	S	S	*	*			trans	-71.3	104.2	164.3	14.5	-2	0	0	0	106.9	T297 L301	T297-P299 WeakPolarHBondContact O-CD 3.32Å; P299-L301 PolarHBondContact O-N 3.29Å
300	S	22.2	Very low	23.3	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	79%	0.787	S	S	*	*			trans	-52.9	122.7	160.8	23.3	0	0	0	0	109.7	N298	N298-S300 PolarHBondContact O-N 2.98Å
301	L	25.2	Very low	23.3	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	79%	0.786	S	S	*	*			trans	-162.5	98.8	154.1	-103.5	156.5	0	0	0	110.9	P299	P299-L301 PolarHBondContact O-N 3.29Å
302	I	24.6	Very low	23.2	Very low	145 Å²	145	142.4 Å²	142.4	74%	0.744	79%	0.787	S	S	*	*			trans	37.2	93.9	138.3	-50.6	175.3	0	0	0	116	Q304	I302-Q304 PolarHBondContact O-N 2.75Å
303	I	23.6	Very low	23.3	Very low	151 Å²	151	145.6 Å²	145.6	77%	0.774	80%	0.796	S	S	*	*			trans	-67.2	109.2	160.4	-62.8	169	0	0	0	107.5	N305	I303-N305 PolarHBondContact O-N 3.14Å
304	Q	23.7	Very low	23.3	Very low	176 Å²	176	145.4 Å²	145.4	82%	0.822	80%	0.795	S	S	*	*			trans	-76.4	114.3	159.8	-83.5	-166.3	-19.8	0	0	108.6	I302 S306	I302-Q304 PolarHBondContact O-N 2.75Å; Q304-S306 PolarHBondContact O-N 2.93Å
305	N	24.1	Very low	23.2	Very low	148 Å²	148	150.9 Å²	150.9	79%	0.791	81%	0.807	S	S	*	*			trans	-48.2	113.3	176.2	-65.2	-34.3	0	0	0	111.9	I303	I303-N305 PolarHBondContact O-N 3.14Å
306	S	23.3	Very low	23.2	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	81%	0.805	S	S	*	*			trans	-105.5	107.5	149.3	48.2	0	0	0	0	107.4	Q304 Y308	Q304-S306 PolarHBondContact O-N 2.93Å; S306-Y308 PolarHBondContact O-N 3.33Å
307	T	21	Very low	23.1	Very low	127 Å²	127	151.9 Å²	151.9	78%	0.779	81%	0.808	S	S	*	*			trans	-61.8	112.7	-179.6	45.3	0	0	0	0	110.6
308	Y	20.1	Very low	23.2	Very low	211 Å²	211	155 Å²	155	83%	0.827	81%	0.812	S	S	*	*			trans	-117.5	108.6	152.9	-82.1	-80.2	0	0	0	108.3	S306 T310	S306-Y308 PolarHBondContact O-N 3.33Å; Y308-T310 PolarHBondContact O-N 3.43Å
309	S	19.8	Very low	23.3	Very low	117 Å²	117	155 Å²	155	82%	0.818	81%	0.812	S	S	*	*			trans	-66.6	110.8	174.3	50.4	0	0	0	0	110
310	T	22.3	Very low	23.3	Very low	134 Å²	134	159.1 Å²	159.1	82%	0.822	82%	0.818	S	S	*	*			trans	-120.6	111.5	158.7	47.6	0	0	0	0	108.4	Y308	Y308-T310 PolarHBondContact O-N 3.43Å
311	T	22.6	Very low	23.3	Very low	126 Å²	126	158.2 Å²	158.2	77%	0.773	81%	0.811	S	S	*	*			trans	-60.2	129.2	178.2	40.6	0	0	0	0	112.6
312	N	22.4	Very low	23.3	Very low	152 Å²	152	158 Å²	158	81%	0.813	81%	0.81	S	S	*	*			trans	37.9	93.3	141.2	-63.9	-18.9	0	0	0	118
313	N	25	Very low	23.3	Very low	168 Å²	168	157.2 Å²	157.2	90%	0.898	81%	0.812	S	S	*	*			trans	-119.7	121.2	145.1	-84.3	-29.7	0	0	0	108.7
314	K	26.3	Very low	23.2	Very low	205 Å²	205	159.9 Å²	159.9	89%	0.891	82%	0.818	S	S	*	*			trans	-60.1	131.5	-172.5	-72.3	173.7	174.7	175.9	0	110.6	E316	K314-E316 PolarHBondContact O-N 2.75Å
315	K	23.4	Very low	23.2	Very low	208 Å²	208	158.9 Å²	158.9	90%	0.904	82%	0.818	S	S	*	*			trans	-66.4	110.2	167.8	-74.3	176.7	172.6	176.1	0	108.9
316	E	24.6	Very low	23.2	Very low	175 Å²	175	160 Å²	160	82%	0.818	82%	0.818	S	S	*	*			trans	-85.3	119.1	157.8	-76.9	-177.4	168.7	0	0	108.5	K314 F318	K314-E316 PolarHBondContact O-N 2.75Å; E316-F318 PolarHBondContact O-N 2.88Å
317	Q	22.7	Very low	23	Very low	189 Å²	189	163.4 Å²	163.4	88%	0.883	83%	0.827	S	S	*	*			trans	-91.3	98	-173.4	-164.2	171.2	10.4	0	0	107.2	D319	Q317-D319 PolarHBondContact O-N 2.79Å
318	F	24.6	Very low	23.1	Very low	190 Å²	190	162.7 Å²	162.7	83%	0.833	82%	0.823	S	S	*	*			trans	-81.8	105.2	175.1	-108.7	-88.7	0	0	0	109.8	E316 K320	E316-F318 PolarHBondContact O-N 2.88Å; F318-K320 PolarHBondContact O-N 3.36Å
319	D	25.5	Very low	23.1	Very low	148 Å²	148	159.9 Å²	159.9	79%	0.791	82%	0.822	S	S	*	*			trans	-73.2	114.9	178.5	-133.2	-16	0	0	0	109.9	Q317	Q317-D319 PolarHBondContact O-N 2.79Å
320	K	23.1	Very low	23.2	Very low	206 Å²	206	165.1 Å²	165.1	90%	0.896	83%	0.826	S	S	*	*			trans	-96.7	93.7	176.2	-77.3	-177.2	176.8	-179.5	0	108.9	F318	F318-K320 PolarHBondContact O-N 3.36Å
321	S	22.3	Very low	23.1	Very low	89 Å²	89	166 Å²	166	62%	0.622	83%	0.825	S	S	*	*			trans	-146.5	133.3	159.4	61.2	0	0	0	0	112
322	N	24.3	Very low	23.1	Very low	149 Å²	149	165.5 Å²	165.5	80%	0.797	83%	0.826	S	S	*	*			trans	76.1	87.6	158.4	-57	-22.9	0	0	0	119.5
323	V	25	Very low	23	Very low	129 Å²	129	164.2 Å²	164.2	78%	0.782	82%	0.824	S	S	*	*			trans	-137.3	98.2	133.6	-174.2	0	0	0	0	109.2	L325	V323-L325 HydrophobicContact CG1-CD1 3.74Å; V323-L325 HydrophobicContact CG1-CG 3.99Å
324	K	21.6	Very low	22.7	Very low	207 Å²	207	164.4 Å²	164.4	90%	0.9	82%	0.819	S	S	*	*			trans	-78.2	124.5	157.7	-100.4	176.3	171	177.7	0	106.7
325	L	23.7	Very low	22.5	Very low	155 Å²	155	161.2 Å²	161.2	81%	0.812	81%	0.812	S	S	*	*			trans	-130.2	124	164.7	-90.3	162.5	0	0	0	109.8	V323	V323-L325 HydrophobicContact CG1-CD1 3.74Å; V323-L325 HydrophobicContact CG1-CG 3.99Å
326	H	23.2	Very low	22.5	Very low	172 Å²	172	161.5 Å²	161.5	80%	0.796	81%	0.813	S	S	*	*			trans	-63.7	128.1	-179	-97.9	-104	0	0	0	111.4
327	L	20.2	Very low	22.4	Very low	174 Å²	174	157.8 Å²	157.8	91%	0.911	81%	0.807	S	S	*	*			trans	-84.9	122.1	162.4	-74.5	155.9	0	0	0	107.8
328	T	22.5	Very low	22.5	Very low	112 Å²	112	156.7 Å²	156.7	69%	0.687	80%	0.801	S	S	*	*			trans	-128.8	138	171	35.7	0	0	0	0	109
329	D	19.9	Very low	22.6	Very low	152 Å²	152	155.8 Å²	155.8	81%	0.813	81%	0.805	S	S	*	*			trans	-58.8	135.9	-168.6	-56.4	-61.7	0	0	0	114.7
330	Y	22.8	Very low	22.5	Very low	228 Å²	228	156.8 Å²	156.8	89%	0.894	81%	0.805	S	S	*	*			trans	-137.5	104.7	154.9	-84.6	-78.9	0	0	0	110.6
331	N	20.5	Very low	22.6	Very low	151 Å²	151	152.3 Å²	152.3	81%	0.807	80%	0.799	S	S	*	*			trans	-71.4	141.3	156.2	-80.6	-37.4	0	0	0	109.8
332	C	20.7	Very low	22.7	Very low	117 Å²	117	154.1 Å²	154.1	79%	0.791	81%	0.807	S	S	*	*			trans	177.4	98	146.9	-96.8	0	0	0	0	108.7
333	T	21.4	Very low	22.8	Very low	125 Å²	125	155.1 Å²	155.1	77%	0.767	81%	0.807	S	S	*	*				63.1	106.8	96.1	56.4	0	0	0	0	116.3
334	E	19.2	Very low	22.9	Very low	172 Å²	172	154.7 Å²	154.7	80%	0.804	81%	0.809	S	S	*	*			trans	8.1	127.4	140.2	-64.6	177.6	160.1	0	0	119
335	N	21.7	Very low	23.1	Very low	138 Å²	138	150 Å²	150	74%	0.738	80%	0.801	S	S	*	*				146.8	117.7	128	-79.1	-42.4	0	0	0	108.3
336	F	23.7	Very low	23.2	Very low	213 Å²	213	149.6 Å²	149.6	93%	0.934	80%	0.798	S	S	*	*			trans	-165	116.7	130.4	-94.4	-64.8	0	0	0	110
337	S	21.9	Very low	23.3	Very low	98 Å²	98	149 Å²	149	69%	0.685	80%	0.801	S	S	*	*			trans	-71.2	150.9	170.8	39.5	0	0	0	0	112.2
338	H	24	Very low	23.6	Very low	165 Å²	165	150 Å²	150	76%	0.764	80%	0.801	S	S	*	*			trans	46.2	111.2	151.7	-71.7	-65.8	0	0	0	119.7
339	N	28.4	Very low	23.8	Very low	171 Å²	171	150.7 Å²	150.7	91%	0.914	81%	0.806	S	S	*	*				-150.9	110.2	128.7	-97.6	-23.3	0	0	0	110
340	E	22.2	Very low	24	Very low	170 Å²	170	151.7 Å²	151.7	79%	0.794	81%	0.81	S	S	*	*			trans	-76.3	158.8	164.1	-72.5	-178.6	144.8	0	0	110.1
341	S	24.6	Very low	24.2	Very low	111 Å²	111	150.4 Å²	150.4	78%	0.776	81%	0.809	S	S	*	*			trans	81.4	88.4	166.2	74.5	0	0	0	0	117.9
342	T	24.7	Very low	24.6	Very low	128 Å²	128	148.7 Å²	148.7	79%	0.785	81%	0.809	S	S	*	*			trans	178.6	97.4	143.1	30.8	0	0	0	0	104.6
343	H	28.2	Very low	24.7	Very low	169 Å²	169	147.5 Å²	147.5	78%	0.782	82%	0.816	S	S	*	*				-172.4	97.5	89.5	-97.1	-93.2	0	0	0	107.8
344	S	26	Very low	24.9	Very low	120 Å²	120	146.1 Å²	146.1	84%	0.839	81%	0.812	S	S	*	*			trans	-101.9	29.4	169.6	-178.4	0	0	0	0	111.5
345	C	24.9	Very low	25.1	Very low	109 Å²	109	142.8 Å²	142.8	74%	0.736	81%	0.808	S	S	*	*			trans	-130.8	74.2	-176.1	-65.2	0	0	0	0	112.1
346	I	26.1	Very low	25.1	Very low	146 Å²	146	146 Å²	146	75%	0.749	82%	0.815	S	S	*	*	S	Bend	trans	-133.1	-1.9	156.3	-62.6	-174.4	0	0	0	112.4
347	N	25.2	Very low	25.1	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	81%	0.805	S	S	*	*	S	Bend	trans	-104.7	21	-168.2	-92.4	-0	0	0	0	118.8
348	E	26.9	Very low	25.1	Very low	194 Å²	194	141.1 Å²	141.1	91%	0.907	81%	0.807	S	S	*	*			trans	-130.7	60.4	172.9	-72.2	-144.1	156.8	0	0	114.5
349	T	26.3	Very low	25.2	Very low	128 Å²	128	141 Å²	141	79%	0.785	81%	0.812	S	S	*	*	S	Bend	trans	-130.7	18.5	172.3	12.5	0	0	0	0	116.2
350	L	24.6	Very low	25	Very low	172 Å²	172	137 Å²	137	90%	0.901	80%	0.797	S	S	*	*	S	Bend	trans	-133.1	24.1	-179.6	-74.8	177.3	0	0	0	117.2
351	K	26.3	Very low	25.1	Very low	202 Å²	202	135.7 Å²	135.7	88%	0.878	80%	0.796	S	S	*	*			trans	-146.7	96.8	169.8	-70.8	-172.4	-178.8	175.3	0	113.1
352	S	29.9	Very low	25.3	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	79%	0.79	S	S	*	*			trans	168.8	89.6	130.7	43.2	0	0	0	0	110.2	S354	S352-S354 PolarHBondContact O-N 2.66Å
353	G	21.9	Very low	25.4	Very low	91 Å²	91	136.5 Å²	136.5	94%	0.938	79%	0.786	S	S	*	*			trans	-78.6	102.2	157.8	0	0	0	0	0	108.8
354	S	26.8	Very low	25.4	Very low	97 Å²	97	135.1 Å²	135.1	68%	0.678	79%	0.785	S	S	*	*			trans	-156.4	92.7	162	54.4	0	0	0	0	110.3	S352	S352-S354 PolarHBondContact O-N 2.66Å
355	S	23.1	Very low	25.4	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	78%	0.784	S	S	*	*			trans	17.2	120.8	139.7	50.8	0	0	0	0	120.5
356	F	20.9	Very low	25.3	Very low	204 Å²	204	137.2 Å²	137.2	90%	0.895	78%	0.782	S	S	*	*			trans	56	114.1	139.5	-75	-87.7	0	0	0	119.6
357	S	24	Very low	25.2	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	79%	0.79	S	S	*	*				167.1	123.9	97	58.8	0	0	0	0	112.3
358	S	22.7	Very low	25.1	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	78%	0.781	S	S	*	*			trans	39.7	120.8	142.7	60.5	0	0	0	0	121.1
359	L	26.6	Very low	25	Very low	162 Å²	162	133.4 Å²	133.4	85%	0.848	78%	0.777	S	S	*	*			trans	171.5	87.2	134.2	-88.8	159.4	0	0	0	105.8
360	S	23.4	Very low	24.9	Very low	88 Å²	88	133.6 Å²	133.6	62%	0.615	77%	0.774	S	S	*	*				64.1	112.8	94	71.8	0	0	0	0	114.7
361	N	24.6	Very low	24.8	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	78%	0.776	S	S	*	*			trans	100.8	127.5	132.7	-75.2	21.3	0	0	0	120.7
362	D	28.6	Very low	24.7	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	77%	0.77	S	S	*	*			trans	96.9	88.7	144.5	-53.6	-15.1	0	0	0	117.8
363	D	27.2	Very low	24.4	Very low	132 Å²	132	133.2 Å²	133.2	71%	0.706	77%	0.773	S	S	*	*				49.6	113.1	114.2	-56.4	-19.3	0	0	0	117.7
364	N	27.1	Very low	24.4	Very low	141 Å²	141	133.9 Å²	133.9	75%	0.754	76%	0.763	S	S	*	*				175.8	131.4	95.5	-88.5	-52.1	0	0	0	113.5
365	E	26.3	Very low	24.3	Very low	173 Å²	173	133.1 Å²	133.1	81%	0.808	76%	0.763	S	S	*	*			trans	69.8	92	141.3	-65.5	-174.4	155.4	0	0	120.7
366	S	22.1	Very low	24.2	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	77%	0.773	S	S	*	*			trans	-37.1	127.4	139.9	52.6	0	0	0	0	115.2
367	L	24.4	Very low	24.3	Very low	175 Å²	175	138.3 Å²	138.3	92%	0.916	77%	0.77	S	S	*	*			trans	-117	88.4	146.1	-80.6	169.1	0	0	0	108.4
368	T	23.6	Very low	24.3	Very low	109 Å²	109	140.6 Å²	140.6	67%	0.669	78%	0.775	S	S	*	*			trans	-78.5	112.8	167.6	48.2	0	0	0	0	109.4
369	T	24.2	Very low	24.2	Very low	136 Å²	136	141.6 Å²	141.6	83%	0.834	78%	0.776	S	S	*	*			trans	-104.1	91.9	160.5	41.1	0	0	0	0	108.9	M371	T369-M371 PolarHBondContact O-N 3.04Å
370	N	24.1	Very low	23.9	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	77%	0.771	S	S	*	*			trans	-61.1	107.2	168.5	-73.8	-30.1	0	0	0	109.7
371	M	22.9	Very low	23.8	Very low	191 Å²	191	144.4 Å²	144.4	94%	0.941	78%	0.783	S	S	*	*			trans	-95	107.5	157.2	-79.4	-152.1	170.4	0	0	108.8	T369 S373	T369-M371 PolarHBondContact O-N 3.04Å; M371-S373 PolarHBondContact O-N 3.46Å
372	H	25	Very low	23.8	Very low	165 Å²	165	144.8 Å²	144.8	76%	0.764	79%	0.785	S	S	*	*			trans	-59.4	116.1	179.4	-81.6	-88.2	0	0	0	111.8	S374	H372-S374 PolarHBondContact O-N 3.41Å
373	S	22.2	Very low	23.5	Very low	124 Å²	124	147.3 Å²	147.3	87%	0.867	79%	0.79	S	S	*	*			trans	-72.1	106.7	155.2	61.2	0	0	0	0	108.6	M371	M371-S373 PolarHBondContact O-N 3.46Å
374	S	22.7	Very low	23.4	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	79%	0.792	S	S	*	*			trans	-122	139.4	172	59.5	0	0	0	0	110.5	H372	H372-S374 PolarHBondContact O-N 3.41Å
375	A	24.2	Very low	23.4	Very low	81 Å²	81	148.1 Å²	148.1	67%	0.669	79%	0.794	S	S	*	*			trans	83	77.3	164.1	0	0	0	0	0	117.1
376	Y	21.6	Very low	23.4	Very low	234 Å²	234	147 Å²	147	92%	0.918	79%	0.794	S	S	*	*				-123.6	104.6	127.5	-90	-83.7	0	0	0	107.9	N378	Y376-N378 PolarHBondContact O-N 2.88Å
377	E	22.3	Very low	23.5	Very low	181 Å²	181	150 Å²	150	85%	0.846	80%	0.797	S	S	*	*			trans	-60.6	115.4	174.1	-80.5	172.6	130.1	0	0	109.7	V379	E377-V379 PolarHBondContact O-N 3.1Å; E377-V379 VanDerWaalsContact O-N 3.1Å
378	N	23.8	Very low	23.5	Very low	152 Å²	152	145.1 Å²	145.1	81%	0.813	79%	0.789	S	S	*	*			trans	-68	100.7	162.4	-74.3	-46.6	0	0	0	107.9	Y376 I380	Y376-N378 PolarHBondContact O-N 2.88Å; N378-I380 PolarHBondContact O-N 2.94Å
379	V	21.8	Very low	23.5	Very low	127 Å²	127	148 Å²	148	77%	0.77	79%	0.792	S	S	*	*			trans	-66.8	103.8	164.7	175.8	0	0	0	0	107.6	E377 L381	E377-V379 PolarHBondContact O-N 3.1Å; E377-V379 VanDerWaalsContact O-N 3.1Å; V379-L381 PolarHBondContact O-N 3.36Å
380	I	20.3	Very low	23.6	Very low	145 Å²	145	150.9 Å²	150.9	74%	0.744	79%	0.789	S	S	*	*			trans	-58	117.4	167.4	-64.2	163.8	0	0	0	107.6	N378	N378-I380 PolarHBondContact O-N 2.94Å
381	L	21.8	Very low	23.8	Very low	164 Å²	164	152.4 Å²	152.4	86%	0.859	80%	0.796	S	S	*	*			trans	-104.6	131.9	155.5	-81.9	172.2	0	0	0	108.6	V379	V379-L381 PolarHBondContact O-N 3.36Å
382	D	24.3	Very low	24	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	78%	0.779	S	S	*	*			trans	-57.9	155.8	-164.1	-103.5	-42.5	0	0	0	115.8
383	K	22.5	Very low	24.7	Very low	177 Å²	177	144 Å²	144	77%	0.77	77%	0.771	S	S	*	*			trans	-62.2	168.3	170.7	-64.8	176.8	173.3	178	0	112.4
384	N	24.4	Very low	25.4	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	75%	0.754	S	S	*	*			trans	98.9	118	166.8	-48.4	-21.2	0	0	0	110.8
385	D	28	Very low	25.9	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	75%	0.746	S	S	*	*			cis	-147.8	155.4	33.6	-82.2	-52.9	0	0	0	112.7
386	N	24.5	Very low	26.4	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	75%	0.746	S	S	*	*			trans	-48.9	134.1	177.2	-57.9	-63.5	0	0	0	113.7
387	E	25	Very low	27.1	Very low	163 Å²	163	138.2 Å²	138.2	76%	0.762	73%	0.729	S	S	*	*				-167.9	76.3	129.3	-105.1	179.9	-155.8	0	0	109	F389	E387-F389 VanDerWaalsContact C-N 3.3Å; E387-F389 HydrophobicContact CB-CD2 4.46Å; E387-F389 HydrophobicContact CG-CE2 4.4Å; E387-F389 PolarHBondContact O-N 3.49Å
388	G	24	Very low	27.7	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	72%	0.718	S	S	*	*			trans	-68.8	88.6	164.8	0	0	0	0	0	109.6	Y390	G388-Y390 PolarHBondContact O-N 3.26Å; G388-Y390 VanDerWaalsContact O-N 3.12Å
389	F	24.5	Very low	28.1	Very low	168 Å²	168	133.8 Å²	133.8	74%	0.737	71%	0.707	S	S	*	*			trans	-76	94.9	165.6	-97.8	-86.5	0	0	0	109.1	E387 L391	E387-F389 VanDerWaalsContact C-N 3.3Å; E387-F389 HydrophobicContact CB-CD2 4.46Å; E387-F389 HydrophobicContact CG-CE2 4.4Å; E387-F389 PolarHBondContact O-N 3.49Å; F389-L391 PolarHBondContact O-N 2.79Å; F389-L391 VanDerWaalsContact O-N 3.1Å
390	Y	26.8	Very low	28.8	Very low	198 Å²	198	130.1 Å²	130.1	78%	0.776	69%	0.689	S	S	*	*			trans	-56.5	111.7	161.4	-73.6	-91.3	0	0	0	108.6	G388 T392	G388-Y390 PolarHBondContact O-N 3.26Å; G388-Y390 VanDerWaalsContact O-N 3.12Å; Y390-T392 PolarHBondContact O-N 2.93Å
391	L	26.6	Very low	29.6	Very low	163 Å²	163	129 Å²	129	85%	0.853	68%	0.681	S	S	*	*			trans	-71.3	74.9	163.7	-76.9	165.9	0	0	0	108.3	F389 S393	F389-L391 PolarHBondContact O-N 2.79Å; F389-L391 VanDerWaalsContact O-N 3.1Å; L391-S393 PolarHBondContact O-N 2.86Å
392	T	28.5	Very low	30.1	Very low	93 Å²	93	124.5 Å²	124.5	57%	0.571	67%	0.667	S	S	*	*			trans	-71.7	116.3	171.7	52.8	0	0	0	0	109.6	Y390 N394	Y390-T392 PolarHBondContact O-N 2.93Å; T392-N394 PolarHBondContact O-N 3.32Å
393	S	38.2	Very low	30.6	Very low	87 Å²	87	123 Å²	123	61%	0.608	66%	0.658	S	S	*	*	S	Bend	trans	44.6	-1.1	146.5	61.2	0	0	0	0	122.1	L391	L391-S393 PolarHBondContact O-N 2.86Å
394	N	36.9	Very low	31.3	Very low	94 Å²	94	120.9 Å²	120.9	50%	0.503	66%	0.655	S	S	.	*	H	α-helix	trans	-85.6	-19.2	-173.5	-98	-13.4	0	0	0	113.9	T392 Q398	T392-N394 PolarHBondContact O-N 3.32Å; N394-Q398 WeakPolarHBondContact O-CB 3.39Å; N394-Q398 WeakPolarHBondContact O-CG 3.48Å; N394-Q398 PolarHBondContact O-N 3.14Å
395	I	34.5	Very low	31.7	Very low	112 Å²	112	120.1 Å²	120.1	57%	0.574	65%	0.652	S	S	*	*	H	α-helix	trans	-73.5	-36.1	175.8	-63.6	170.2	0	0	0	110.5	Q398 L399	I395-Q398 PolarHBondContact O-N 2.81Å; I395-L399 HydrophobicContact CG2-CD1 4.24Å; I395-L399 PolarHBondContact O-N 3.19Å
396	S	33.9	Very low	31.7	Very low	95 Å²	95	116.6 Å²	116.6	66%	0.664	64%	0.638	S	S	*	*	H	α-helix	trans	-69.8	-34.1	175.1	-58.5	0	0	0	0	112.4	A400	S396-A400 WeakPolarHBondContact O-CB 2.91Å; S396-A400 PolarHBondContact O-N 2.69Å; S396-A400 VanDerWaalsContact O-N 3.1Å
397	Q	37.7	Very low	31.9	Very low	121 Å²	121	116.7 Å²	116.7	57%	0.565	63%	0.634	S	S	*	*	H	α-helix	trans	-75	-33.4	173.7	-76.6	-171.4	-11.4	0	0	113	A400 Q401	Q397-A400 PolarHBondContact O-N 2.87Å; Q397-Q401 WeakPolarHBondContact O-CB 3.38Å; Q397-Q401 PolarHBondContact O-N 2.76Å
398	Q	33.8	Very low	31.9	Very low	132 Å²	132	116 Å²	116	62%	0.617	63%	0.634	S	S	*	*	H	α-helix	trans	-68.4	-36.1	173.8	-78.4	-175.5	-3.3	0	0	112.5	N394 I395 Q401 A402	N394-Q398 WeakPolarHBondContact O-CB 3.39Å; N394-Q398 WeakPolarHBondContact O-CG 3.48Å; N394-Q398 PolarHBondContact O-N 3.14Å; I395-Q398 PolarHBondContact O-N 2.81Å; Q398-Q401 PolarHBondContact O-N 2.85Å; Q398-A402 WeakPolarHBondContact O-CB 2.95Å; Q398-A402 PolarHBondContact O-N 2.83Å
399	L	32.7	Very low	32.1	Very low	109 Å²	109	120.7 Å²	120.7	57%	0.571	63%	0.634	S	S	*	*	H	α-helix	trans	-67.9	-38.2	171.9	-91.8	152.9	0	0	0	112.2	I395 A402 I403	I395-L399 HydrophobicContact CG2-CD1 4.24Å; I395-L399 PolarHBondContact O-N 3.19Å; L399-A402 PolarHBondContact O-N 3.27Å; L399-I403 WeakPolarHBondContact O-CG1 3.18Å; L399-I403 PolarHBondContact O-N 3.19Å
400	A	35.1	Very low	32.1	Very low	49 Å²	49	121 Å²	121	41%	0.405	64%	0.637	S	S	.	*	H	α-helix	trans	-69.7	-35.9	174.9	0	0	0	0	0	112.9	S396 Q397 I403 N404	S396-A400 WeakPolarHBondContact O-CB 2.91Å; S396-A400 PolarHBondContact O-N 2.69Å; S396-A400 VanDerWaalsContact O-N 3.1Å; Q397-A400 PolarHBondContact O-N 2.87Å; A400-I403 PolarHBondContact O-N 3.03Å; A400-N404 WeakPolarHBondContact O-CB 3.49Å; A400-N404 PolarHBondContact O-N 3.25Å
401	Q	37.3	Very low	32.1	Very low	121 Å²	121	117.5 Å²	117.5	57%	0.565	64%	0.639	S	S	*	*	H	α-helix	trans	-72.3	-33.3	173.8	-83.1	-177.7	-14.7	0	0	112.6	Q397 Q398 I403 N404 N405	Q397-Q401 WeakPolarHBondContact O-CB 3.38Å; Q397-Q401 PolarHBondContact O-N 2.76Å; Q398-Q401 PolarHBondContact O-N 2.85Å; Q401-I403 VanDerWaalsContact C-N 3.26Å; Q401-I403 PolarHBondContact O-N 2.77Å; Q401-N404 PolarHBondContact O-N 3.37Å; Q401-N405 VanDerWaalsContact O-CB 3.29Å; Q401-N405 WeakPolarHBondContact O-CB 3.46Å; Q401-N405 PolarHBondContact O-N 2.67Å
402	A	33	Very low	31.9	Very low	70 Å²	70	117.7 Å²	117.7	58%	0.579	64%	0.639	S	S	*	*	H	α-helix	trans	-64.6	-33.6	173.2	0	0	0	0	0	111.9	Q398 L399	Q398-A402 WeakPolarHBondContact O-CB 2.95Å; Q398-A402 PolarHBondContact O-N 2.83Å; L399-A402 PolarHBondContact O-N 3.27Å
403	I	35.4	Very low	31.8	Very low	117 Å²	117	118.2 Å²	118.2	60%	0.6	65%	0.647	S	S	*	*	H	α-helix	trans	-74.5	-42	174.9	-65.6	168.2	0	0	0	110.7	L399 A400 Q401 S406	L399-I403 WeakPolarHBondContact O-CG1 3.18Å; L399-I403 PolarHBondContact O-N 3.19Å; A400-I403 PolarHBondContact O-N 3.03Å; Q401-I403 VanDerWaalsContact C-N 3.26Å; Q401-I403 PolarHBondContact O-N 2.77Å; I403-S406 PolarHBondContact O-N 3.45Å; I403-S406 PolarHBondContact O-OG 3.12Å
404	N	36	Very low	31.2	Very low	133 Å²	133	120.4 Å²	120.4	71%	0.711	66%	0.659	S	S	*	*	H	α-helix	trans	-76.3	-19.8	-179.4	-81.4	-16.1	0	0	0	115.1	A400 Q401 S406	A400-N404 WeakPolarHBondContact O-CB 3.49Å; A400-N404 PolarHBondContact O-N 3.25Å; Q401-N404 PolarHBondContact O-N 3.37Å; N404-S406 VanDerWaalsContact C-N 3.26Å; N404-S406 PolarHBondContact O-N 2.84Å
405	N	33.2	Very low	30.7	Very low	128 Å²	128	119.4 Å²	119.4	68%	0.684	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	3.2	175.1	-74.8	-14.8	0	0	0	113.6	Q401 Q407	Q401-N405 VanDerWaalsContact O-CB 3.29Å; Q401-N405 WeakPolarHBondContact O-CB 3.46Å; Q401-N405 PolarHBondContact O-N 2.67Å; N405-Q407 VanDerWaalsContact C-N 3.29Å; N405-Q407 PolarHBondContact O-N 2.85Å
406	S	29.4	Very low	30.2	Very low	72 Å²	72	121.3 Å²	121.3	50%	0.503	68%	0.682	S	S	.	*			trans	-75.6	85.4	164.3	66.6	0	0	0	0	109.4	I403 N404 I408	I403-S406 PolarHBondContact O-N 3.45Å; I403-S406 PolarHBondContact O-OG 3.12Å; N404-S406 VanDerWaalsContact C-N 3.26Å; N404-S406 PolarHBondContact O-N 2.84Å; S406-I408 PolarHBondContact O-N 3.38Å
407	Q	27.6	Very low	29.8	Very low	153 Å²	153	123.2 Å²	123.2	72%	0.715	69%	0.685	S	S	*	*			trans	-66.7	73.9	168	-72.3	-149.6	-8	0	0	110.5	N405 K409	N405-Q407 VanDerWaalsContact C-N 3.29Å; N405-Q407 PolarHBondContact O-N 2.85Å; Q407-K409 PolarHBondContact O-N 3.46Å; Q407-K409 VanDerWaalsContact OE1-CE 3.27Å
408	I	26	Very low	29.3	Very low	149 Å²	149	125 Å²	125	76%	0.764	70%	0.698	S	S	*	*			trans	-76.9	84	160.1	-58.7	178.1	0	0	0	105.7	S406 Q410	S406-I408 PolarHBondContact O-N 3.38Å; I408-Q410 PolarHBondContact O-N 3.32Å
409	K	27.2	Very low	28.9	Very low	171 Å²	171	123 Å²	123	74%	0.743	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-62.6	123	170.6	-78.7	-178.8	177.6	175.3	0	108.6	Q407	Q407-K409 PolarHBondContact O-N 3.46Å; Q407-K409 VanDerWaalsContact OE1-CE 3.27Å
410	Q	25.3	Very low	28.6	Very low	173 Å²	173	127 Å²	127	81%	0.808	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-54	151.3	173.5	-70	-164.8	-0.5	0	0	112	I408 I412	I408-Q410 PolarHBondContact O-N 3.32Å; Q410-I412 PolarHBondContact O-N 2.83Å
411	P	25.2	Very low	28.2	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-75.2	122.4	-166	27.1	-27.5	0	0	0	111.5
412	I	23.6	Very low	27.6	Very low	166 Å²	166	133 Å²	133	85%	0.851	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.4	173.2	-62.7	167.6	0	0	0	108.8	Q410	Q410-I412 PolarHBondContact O-N 2.83Å
413	S	25.3	Very low	27.2	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-59.6	146.9	179.7	-51	0	0	0	0	112.9	G415	S413-G415 PolarHBondContact O-N 3.23Å
414	P	27	Very low	26.6	Very low	133 Å²	133	137.7 Å²	137.7	86%	0.864	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-83.9	116	-168.1	32	-31.7	0	0	0	111.9
415	G	24.8	Very low	26.2	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-89.2	139.7	165.3	0	0	0	0	0	111.4	S413	S413-G415 PolarHBondContact O-N 3.23Å
416	N	24.8	Very low	25.9	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	77%	0.766	S	S	*	*			trans	-39.7	134.4	172.7	-78.6	-30	0	0	0	114.4
417	D	26.4	Very low	25.7	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	78%	0.78	S	S	*	*				174.8	112.1	105.4	-93.1	-34.5	0	0	0	112.3	A419	D417-A419 PolarHBondContact O-N 2.82Å
418	N	25.9	Very low	25.7	Very low	158 Å²	158	137.1 Å²	137.1	85%	0.845	78%	0.779	S	S	*	*			trans	30.4	78.2	133.9	-63.7	-39.4	0	0	0	119.5
419	A	26.9	Very low	25.7	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	78%	0.779	S	S	*	*			trans	-157.1	86.1	149.8	0	0	0	0	0	112.7	D417	D417-A419 PolarHBondContact O-N 2.82Å
420	K	25.4	Very low	25.8	Very low	193 Å²	193	132.4 Å²	132.4	84%	0.839	78%	0.781	S	S	*	*			trans	44.9	108.6	141.2	-68.3	176.7	-179.9	172.2	0	119.2
421	K	26	Very low	26	Very low	203 Å²	203	131.6 Å²	131.6	88%	0.883	78%	0.783	S	S	*	*			trans	86.1	129.1	132.8	-70	-177.8	174.1	-177.1	0	117.8
422	A	24.7	Very low	26.2	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	77%	0.773	S	S	*	*	S	Bend	trans	87.3	123.3	170.6	0	0	0	0	0	114.9
423	I	24.4	Very low	26.7	Very low	162 Å²	162	127.7 Å²	127.7	83%	0.831	76%	0.764	S	S	*	*			trans	90.1	79.1	176.2	-44.9	157.6	0	0	0	113.8
424	V	23.8	Very low	27	Very low	122 Å²	122	126.1 Å²	126.1	74%	0.739	76%	0.757	S	S	*	*			trans	-104.2	111.5	153.3	176.1	0	0	0	0	106.9	T426	V424-T426 HydrophobicContact CG1-CG2 4.14Å; V424-T426 PolarHBondContact O-N 3.36Å
425	P	28.4	Very low	27.1	Very low	113 Å²	113	124.8 Å²	124.8	73%	0.734	75%	0.746	S	S	*	*			trans	-87.1	91.4	167.1	32.4	-24.5	0	0	0	107.8	V427	P425-V427 PolarHBondContact O-N 2.93Å
426	T	25.9	Very low	27.5	Very low	98 Å²	98	129.3 Å²	129.3	60%	0.601	75%	0.748	S	S	*	*			trans	-86.7	109.6	169.5	12.9	0	0	0	0	109.1	V424 L428	V424-T426 HydrophobicContact CG1-CG2 4.14Å; V424-T426 PolarHBondContact O-N 3.36Å; T426-L428 VanDerWaalsContact C-N 3.34Å; T426-L428 PolarHBondContact O-N 3.32Å
427	V	26.2	Very low	27.8	Very low	131 Å²	131	130.2 Å²	130.2	79%	0.794	74%	0.744	S	S	*	*			trans	-47.9	98	155.3	176.7	0	0	0	0	107.6	P425 N429	P425-V427 PolarHBondContact O-N 2.93Å; V427-N429 PolarHBondContact O-N 3.42Å
428	L	26.1	Very low	27.9	Very low	132 Å²	132	128.9 Å²	128.9	69%	0.691	74%	0.741	S	S	*	*			trans	-88.3	98.3	178.5	-78.5	171	0	0	0	109.3	T426 G430	T426-L428 VanDerWaalsContact C-N 3.34Å; T426-L428 PolarHBondContact O-N 3.32Å; L428-G430 PolarHBondContact O-N 2.74Å; L428-G430 VanDerWaalsContact O-N 3.12Å
429	N	26.6	Very low	28	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	73%	0.731	S	S	*	*			trans	-41.1	108.6	155.7	-76.6	-32.5	0	0	0	111.3	V427 N431	V427-N429 PolarHBondContact O-N 3.42Å; N429-N431 VanDerWaalsContact C-N 3.29Å; N429-N431 PolarHBondContact O-N 2.83Å
430	G	28.6	Very low	28.1	Very low	76 Å²	76	125.4 Å²	125.4	78%	0.784	72%	0.723	S	S	*	*	S	Bend		66.3	-16.7	122.1	0	0	0	0	0	121.6	L428	L428-G430 PolarHBondContact O-N 2.74Å; L428-G430 VanDerWaalsContact O-N 3.12Å
431	N	31.2	Very low	28.1	Very low	157 Å²	157	126.1 Å²	126.1	84%	0.84	72%	0.722	S	S	*	*			trans	-136.2	11.6	-168.5	-86.6	-14.2	0	0	0	117.2	N429	N429-N431 VanDerWaalsContact C-N 3.29Å; N429-N431 PolarHBondContact O-N 2.83Å
432	D	28.7	Very low	28	Very low	116 Å²	116	122.3 Å²	122.3	62%	0.62	71%	0.71	S	S	*	*			trans	-92.5	118.1	172.7	-96.2	-37.9	0	0	0	112.4	A434 V435	D432-A434 PolarHBondContact O-N 3.43Å; D432-V435 PolarHBondContact O-N 3.21Å
433	S	34.7	Very low	28	Very low	94 Å²	94	125.7 Å²	125.7	66%	0.657	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.2	1.6	-176	65.4	0	0	0	0	117.2
434	A	31	Very low	28	Very low	71 Å²	71	121.3 Å²	121.3	59%	0.587	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-29.3	174.5	0	0	0	0	0	112.9	D432 Q436 K437	D432-A434 PolarHBondContact O-N 3.43Å; A434-Q436 VanDerWaalsContact C-N 3.35Å; A434-K437 PolarHBondContact O-N 2.94Å
435	V	29.4	Very low	28.1	Very low	105 Å²	105	122.4 Å²	122.4	64%	0.636	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-76.9	-23.6	178.4	-178.7	0	0	0	0	111.9	D432 K437 V438 N439	D432-V435 PolarHBondContact O-N 3.21Å; V435-K437 PolarHBondContact O-N 3.15Å; V435-V438 PolarHBondContact O-N 2.93Å; V435-N439 PolarHBondContact O-N 3.35Å
436	Q	31.9	Very low	27.9	Very low	169 Å²	169	126.7 Å²	126.7	79%	0.79	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-69.3	-13.3	171.2	-78.1	-173.8	-10.3	0	0	113.8	A434	A434-Q436 VanDerWaalsContact C-N 3.35Å
437	K	32.5	Very low	27.8	Very low	170 Å²	170	133.3 Å²	133.3	74%	0.739	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-90.1	-14.1	175.7	-84.8	-175.9	175.7	177.3	0	115	A434 V435	A434-K437 PolarHBondContact O-N 2.94Å; V435-K437 PolarHBondContact O-N 3.15Å
438	V	28.4	Very low	27.7	Very low	107 Å²	107	134.9 Å²	134.9	65%	0.648	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-22.6	-179.1	-174.5	0	0	0	0	112.7	V435 G440	V435-V438 PolarHBondContact O-N 2.93Å; V438-G440 PolarHBondContact O-N 3.39Å
439	N	28.1	Very low	27.5	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-74.3	-4.5	169.4	-89.4	0.5	0	0	0	114.5	V435 Y441	V435-N439 PolarHBondContact O-N 3.35Å; N439-Y441 VanDerWaalsContact C-N 3.31Å
440	G	28.5	Very low	27.3	Very low	56 Å²	56	132.2 Å²	132.2	58%	0.577	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-77.9	-8.6	174.3	0	0	0	0	0	115.2	V438	V438-G440 PolarHBondContact O-N 3.39Å
441	Y	25	Very low	27.1	Very low	208 Å²	208	134.8 Å²	134.8	82%	0.816	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-109.9	7	-175.8	-72.2	-76.6	0	0	0	114.7	N439 I443	N439-Y441 VanDerWaalsContact C-N 3.31Å; Y441-I443 PolarHBondContact O-N 3.13Å
442	I	23.4	Very low	26.9	Very low	123 Å²	123	136.5 Å²	136.5	63%	0.631	73%	0.733	S	S	*	*			trans	-93.5	75.3	170.1	-51.2	176.5	0	0	0	107.5	A444	I442-A444 PolarHBondContact O-N 3.39Å
443	I	25	Very low	26.6	Very low	164 Å²	164	139 Å²	139	84%	0.841	74%	0.741	S	S	*	*			trans	-73.4	91.7	161.7	-60.8	179	0	0	0	105.8	Y441	Y441-I443 PolarHBondContact O-N 3.13Å
444	A	25	Very low	26.1	Very low	70 Å²	70	140.2 Å²	140.2	58%	0.579	75%	0.747	S	S	*	*			trans	-61.6	133.1	170	0	0	0	0	0	110	I442	I442-A444 PolarHBondContact O-N 3.39Å
445	N	25.3	Very low	26	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	76%	0.758	S	S	*	*			trans	47.6	100.1	157.7	-67.8	-18.1	0	0	0	116	R447	N445-R447 PolarHBondContact O-N 2.75Å
446	E	23.9	Very low	26.1	Very low	202 Å²	202	145.8 Å²	145.8	94%	0.944	77%	0.768	S	S	*	*			trans	-50.1	91.4	150	-68.3	-178.4	161.8	0	0	108.8	L448	E446-L448 PolarHBondContact O-N 3.32Å; E446-L448 VanDerWaalsContact O-N 3.14Å
447	R	24.1	Very low	26.1	Very low	237 Å²	237	145 Å²	145	89%	0.894	77%	0.769	S	S	*	*			trans	-65.8	111.5	162.7	-91.1	-176.9	172.5	173.7	-1.8	106.2	N445 C449	N445-R447 PolarHBondContact O-N 2.75Å; R447-C449 PolarHBondContact O-N 3.02Å
448	L	23.8	Very low	25.8	Very low	164 Å²	164	140.9 Å²	140.9	86%	0.859	78%	0.775	S	S	*	*			trans	-29	119	162.9	-75.3	145.8	0	0	0	110.5	E446 S450	E446-L448 PolarHBondContact O-N 3.32Å; E446-L448 VanDerWaalsContact O-N 3.14Å; L448-S450 VanDerWaalsContact C-N 3.35Å; L448-S450 PolarHBondContact O-N 3.35Å
449	C	21.8	Very low	25.7	Very low	123 Å²	123	144.8 Å²	144.8	83%	0.831	79%	0.786	S	S	*	*			trans	-56.1	100.2	168.9	-80.2	0	0	0	0	108.8	R447 V451	R447-C449 PolarHBondContact O-N 3.02Å; C449-V451 PolarHBondContact O-N 3.36Å
450	S	23.3	Very low	25.7	Very low	98 Å²	98	146.6 Å²	146.6	69%	0.685	79%	0.794	S	S	*	*			trans	-69	116.4	166.4	50.5	0	0	0	0	108.4	L448 F452	L448-S450 VanDerWaalsContact C-N 3.35Å; L448-S450 PolarHBondContact O-N 3.35Å; S450-F452 PolarHBondContact O-N 3.33Å
451	V	25.2	Very low	25.4	Very low	131 Å²	131	153 Å²	153	79%	0.794	81%	0.809	S	S	*	*			trans	10.9	100.6	149	-171.3	0	0	0	0	113.7	C449 E453	C449-V451 PolarHBondContact O-N 3.36Å; V451-E453 PolarHBondContact O-N 2.91Å
452	F	25.3	Very low	25.3	Very low	192 Å²	192	153.4 Å²	153.4	84%	0.842	81%	0.811	S	S	*	*			trans	-73.5	106.2	168.6	-80.8	-86.1	0	0	0	108.9	S450	S450-F452 PolarHBondContact O-N 3.33Å
453	E	22.8	Very low	25.2	Very low	168 Å²	168	153.5 Å²	153.5	79%	0.785	82%	0.821	S	S	*	*			trans	-76.8	134.7	160.3	-74.9	-173.1	164.4	0	0	109.5	V451 T455	V451-E453 PolarHBondContact O-N 2.91Å; E453-T455 PolarHBondContact O-N 2.93Å
454	P	24.5	Very low	25.4	Very low	121 Å²	121	151.4 Å²	151.4	79%	0.786	82%	0.818	S	S	*	*			trans	-80.7	113.7	-172.4	31.7	-32.7	0	0	0	110.7
455	T	29	Very low	25.5	Very low	134 Å²	134	154.2 Å²	154.2	82%	0.822	83%	0.828	S	S	*	*			trans	-82.7	131.2	170.8	50	0	0	0	0	111.1	E453 N457	E453-T455 PolarHBondContact O-N 2.93Å; T455-N457 PolarHBondContact O-N 3.18Å
456	N	32.6	Very low	25.4	Very low	158 Å²	158	154.8 Å²	154.8	85%	0.845	83%	0.831	S	S	*	*	S	Bend	trans	-74.9	8.8	-152.9	-111.5	-13.7	0	0	0	118.9
457	N	30.7	Very low	25.5	Very low	153 Å²	153	154 Å²	154	82%	0.818	83%	0.827	S	S	*	*	S	Bend	trans	-134	94	-178.5	-69.2	-28.9	0	0	0	110.6	T455 Q459	T455-N457 PolarHBondContact O-N 3.18Å; N457-Q459 PolarHBondContact O-N 3.07Å
458	G	26.3	Very low	25.7	Very low	83 Å²	83	148.1 Å²	148.1	86%	0.856	82%	0.822	S	S	*	*			trans	-68.1	78	-170.7	0	0	0	0	0	116
459	Q	26.9	Very low	25.8	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	82%	0.82	S	S	*	*			trans	-128.8	113.6	163.6	-71.9	-176	-13.7	0	0	109.9	N457	N457-Q459 PolarHBondContact O-N 3.07Å
460	I	27.3	Very low	25.8	Very low	157 Å²	157	149.4 Å²	149.4	81%	0.805	82%	0.822	S	S	*	*			trans	-97.3	113.4	178.6	-61.7	172.4	0	0	0	107.6
461	E	22.3	Very low	25.9	Very low	191 Å²	191	154.3 Å²	154.3	89%	0.893	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-79.5	124.9	177.6	-125	177.3	179.2	0	0	110.7
462	Y	23.8	Very low	25.7	Very low	216 Å²	216	159.1 Å²	159.1	85%	0.847	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-87.8	122.3	-179.3	-86.5	-99	0	0	0	111
463	C	21.4	Very low	25.6	Very low	125 Å²	125	157.3 Å²	157.3	85%	0.845	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-99.5	130.4	169.2	-80.9	0	0	0	0	111.5
464	P	27.8	Very low	25.7	Very low	120 Å²	120	161.5 Å²	161.5	78%	0.779	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-95.2	141.5	-170.5	35.6	-32.5	0	0	0	113.5
465	T	26.8	Very low	25.7	Very low	129 Å²	129	166.1 Å²	166.1	79%	0.791	85%	0.846	S	S	*	*			trans	-121.3	114.8	173.6	50.3	0	0	0	0	111.9
466	N	23.7	Very low	25.6	Very low	159 Å²	159	166.4 Å²	166.4	85%	0.85	84%	0.842	S	S	*	*			trans	-77.2	131.3	176	-79.1	-32.5	0	0	0	112.2
467	H	25.8	Very low	25.5	Very low	186 Å²	186	169.2 Å²	169.2	86%	0.861	85%	0.847	S	S	*	*			trans	-137.4	109.7	163.8	-82.3	-70.2	0	0	0	111.5
468	S	28.1	Very low	25.2	Very low	112 Å²	112	165.9 Å²	165.9	78%	0.783	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-80.1	135.9	175.9	51	0	0	0	0	112.4
469	S	25.5	Very low	25.4	Very low	115 Å²	115	165.4 Å²	165.4	80%	0.804	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-91.6	131.7	-175.2	46	0	0	0	0	113.2
470	F	23	Very low	25.9	Very low	199 Å²	199	162.5 Å²	162.5	87%	0.873	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-96	126.2	172.4	-88.9	-89.7	0	0	0	111.2
471	K	24.1	Very low	26	Very low	202 Å²	202	163.2 Å²	163.2	88%	0.878	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-89.9	132.9	176.9	-74.4	177.8	175.4	175.8	0	110.9
472	Y	21.2	Very low	26.3	Very low	232 Å²	232	159.4 Å²	159.4	91%	0.91	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-98.6	129.5	170.1	-103.5	-90.6	0	0	0	111.7
473	N	24.1	Very low	26.4	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-79.7	130.8	178.5	-94.6	-36.7	0	0	0	111.9
474	R	24.3	Very low	26.6	Very low	255 Å²	255	154.2 Å²	154.2	96%	0.962	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-100.7	120.3	165.6	-76.1	-175.6	176.8	-179.7	-0.6	109
475	R	24.5	Very low	26.6	Very low	219 Å²	219	156.4 Å²	156.4	83%	0.826	83%	0.83	S	S	*	*			trans	-116.4	129	169.3	-86.8	-174.1	-179.8	166.7	-1.4	110.7
476	D	27.1	Very low	26.4	Very low	139 Å²	139	162.3 Å²	162.3	74%	0.743	84%	0.838	S	S	*	*			trans	56.4	99.4	135.7	-50.7	-32.7	0	0	0	119.8
477	K	31	Very low	26.6	Very low	218 Å²	218	162.7 Å²	162.7	95%	0.948	84%	0.839	S	S	*	*			trans	-142.7	97.3	136.9	-71.8	-161.3	178	-179.4	0	109.7
478	G	24.5	Very low	26.4	Very low	83 Å²	83	164.9 Å²	164.9	86%	0.856	84%	0.839	S	S	*	*			trans	-88.3	151.9	167.5	0	0	0	0	0	111.7
479	G	29.7	Very low	26.3	Very low	72 Å²	72	166.4 Å²	166.4	74%	0.742	84%	0.839	S	S	*	*			trans	-175.3	130.5	171.4	0	0	0	0	0	109.6
480	P	38.1	Very low	26.3	Very low	130 Å²	130	166.1 Å²	166.1	84%	0.844	84%	0.837	S	S	*	*			trans	-94.7	135.7	-160.7	35.4	-31.2	0	0	0	112.4
481	I	29.1	Very low	26.4	Very low	172 Å²	172	166 Å²	166	88%	0.882	84%	0.836	S	S	*	*			trans	-133.1	127.7	160	-58.6	-179.9	0	0	0	109.5
482	S	28.4	Very low	26.4	Very low	110 Å²	110	168.1 Å²	168.1	77%	0.769	84%	0.838	S	S	*	*			trans	-60.7	160.9	-179.4	174.6	0	0	0	0	114.2
483	S	26.5	Very low	26.7	Very low	90 Å²	90	164.7 Å²	164.7	63%	0.629	83%	0.831	S	S	*	*			trans	-65.7	158.2	-165.7	49.9	0	0	0	0	117.8
484	N	25.2	Very low	26.7	Very low	143 Å²	143	166.6 Å²	166.6	77%	0.765	84%	0.835	S	S	*	*			trans	91.3	82.2	158.1	-59.5	-22.6	0	0	0	117.7
485	N	27.7	Very low	26.7	Very low	166 Å²	166	161.3 Å²	161.3	89%	0.888	82%	0.824	S	S	*	*				-162.1	101.6	125.7	-94.1	-28.9	0	0	0	109.6	L487	N485-L487 PolarHBondContact O-N 3.46Å
486	R	22.6	Very low	26.7	Very low	253 Å²	253	159.5 Å²	159.5	96%	0.955	83%	0.825	S	S	*	*			trans	-77.9	93.9	173.5	-76.6	179.9	176.2	174	-0.4	108.8
487	L	27.3	Very low	26.6	Very low	167 Å²	167	160.3 Å²	160.3	87%	0.874	82%	0.824	S	S	*	*			trans	-133.4	104.7	157.5	-95.2	149.8	0	0	0	108.5	N485 N489	N485-L487 PolarHBondContact O-N 3.46Å; L487-N489 PolarHBondContact O-N 2.99Å
488	R	22.4	Very low	26.2	Very low	231 Å²	231	157.7 Å²	157.7	87%	0.872	82%	0.82	S	S	*	*			trans	-56.2	119	169.4	-77.3	173.5	166.4	172.5	-5.5	108.7
489	N	25.5	Very low	26.1	Very low	144 Å²	144	163 Å²	163	77%	0.77	81%	0.814	S	S	*	*				178.5	130	109	-89.4	-25.2	0	0	0	113.2	L487	L487-N489 PolarHBondContact O-N 2.99Å
490	S	26.5	Very low	25.9	Very low	109 Å²	109	165.1 Å²	165.1	76%	0.762	81%	0.813	S	S	*	*			trans	48.7	89.6	148.7	61.3	0	0	0	0	118.5	R492	S490-R492 PolarHBondContact O-N 3.23Å
491	K	25.3	Very low	25.2	Very low	197 Å²	197	167.5 Å²	167.5	86%	0.857	81%	0.811	S	S	*	*			trans	-53.5	102.1	155.4	-76.1	176	173.8	177.3	0	110	Q493	K491-Q493 PolarHBondContact O-N 3.08Å
492	R	23.8	Very low	24.9	Very low	246 Å²	246	169.7 Å²	169.7	93%	0.928	81%	0.81	S	S	*	*			trans	-84.6	97.5	156	-138.1	177	-174.1	-179	0.8	105.6	S490 Q494	S490-R492 PolarHBondContact O-N 3.23Å; R492-Q494 PolarHBondContact O-N 3.35Å
493	Q	27.2	Very low	24.6	Very low	161 Å²	161	170.4 Å²	170.4	75%	0.752	81%	0.813	S	S	*	*			trans	-62.2	126.5	177.1	-76.3	176.3	-23.7	0	0	109	K491 I495	K491-Q493 PolarHBondContact O-N 3.08Å; Q493-I495 PolarHBondContact O-N 3.25Å
494	Q	24	Very low	24.5	Very low	194 Å²	194	171.3 Å²	171.3	91%	0.907	82%	0.819	S	S	*	*			trans	-54.1	113	165.4	-79.1	165.1	-43.7	0	0	108.4	R492	R492-Q494 PolarHBondContact O-N 3.35Å
495	I	25.1	Very low	24.4	Very low	144 Å²	144	168.3 Å²	168.3	74%	0.738	81%	0.81	S	S	*	*			trans	-101.2	113.2	161	-63.5	175.5	0	0	0	104.8	Q493	Q493-I495 PolarHBondContact O-N 3.25Å
496	E	23.7	Very low	24.2	Very low	181 Å²	181	163.9 Å²	163.9	85%	0.846	80%	0.803	S	S	*	*			trans	-54.9	137.1	171.7	-76.5	174.3	140.8	0	0	109.8	D498	E496-D498 PolarHBondContact O-N 3.12Å
497	H	24.2	Very low	24.2	Very low	155 Å²	155	160.1 Å²	160.1	72%	0.718	79%	0.79	S	S	*	*			trans	-78.1	99	-170.7	-67.4	44.3	0	0	0	110.4	R499	H497-R499 HydrophobicContact CB-CG 4.14Å; H497-R499 PolarHBondContact O-N 3.37Å
498	D	23.1	Very low	24	Very low	163 Å²	163	159 Å²	159	87%	0.872	78%	0.784	S	S	*	*			trans	-71.9	88.2	156.5	-91.3	-23.2	0	0	0	108.5	E496 T500	E496-D498 PolarHBondContact O-N 3.12Å; D498-T500 VanDerWaalsContact C-N 3.3Å; D498-T500 PolarHBondContact O-N 2.92Å
499	R	22.7	Very low	24	Very low	194 Å²	194	153.1 Å²	153.1	73%	0.732	77%	0.774	S	S	*	*			trans	-73	78.8	172.4	-69.1	-178.6	176	176.8	-1.8	109.9	H497 F501	H497-R499 HydrophobicContact CB-CG 4.14Å; H497-R499 PolarHBondContact O-N 3.37Å; R499-F501 HydrophobicContact CB-CE2 4.28Å
500	T	24.5	Very low	24	Very low	118 Å²	118	150.4 Å²	150.4	72%	0.724	76%	0.764	S	S	*	*			trans	-107.2	99.4	158.5	41.4	0	0	0	0	109	D498 Y502	D498-T500 VanDerWaalsContact C-N 3.3Å; D498-T500 PolarHBondContact O-N 2.92Å; T500-Y502 PolarHBondContact O-N 3.43Å
501	F	25	Very low	24	Very low	179 Å²	179	152.7 Å²	152.7	79%	0.785	77%	0.768	S	S	*	*			trans	-54.9	115.6	-178.4	-74.1	-99.9	0	0	0	112.4	R499	R499-F501 HydrophobicContact CB-CE2 4.28Å
502	Y	21.8	Very low	23.9	Very low	219 Å²	219	147.7 Å²	147.7	86%	0.859	76%	0.757	S	S	*	*			trans	-120.6	96	155.4	-78.8	-82.2	0	0	0	107.8	T500	T500-Y502 PolarHBondContact O-N 3.43Å
503	C	21.4	Very low	23.9	Very low	124 Å²	124	142.4 Å²	142.4	84%	0.838	74%	0.738	S	S	*	*			trans	-144.6	137.2	163.1	-82.4	0	0	0	0	105
504	S	24.3	Very low	23.9	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	74%	0.737	S	S	*	*			cis	-161.3	118	31	44.9	0	0	0	0	110.4
505	S	24	Very low	23.8	Very low	81 Å²	81	138.3 Å²	138.3	57%	0.566	74%	0.737	S	S	*	*			trans	-66.4	137	150.4	49.9	0	0	0	0	109	Y507	S505-Y507 PolarHBondContact O-N 3.29Å
506	G	22.8	Very low	23.7	Very low	73 Å²	73	138.4 Å²	138.4	75%	0.753	73%	0.734	S	S	*	*	S	Bend	trans	-69.6	25	174.8	0	0	0	0	0	114.9
507	Y	23.1	Very low	23.6	Very low	173 Å²	173	135.6 Å²	135.6	68%	0.678	74%	0.735	S	S	*	*			trans	-112.3	101	174.5	-69.9	-81.8	0	0	0	108.9	S505 T509	S505-Y507 PolarHBondContact O-N 3.29Å; Y507-T509 PolarHBondContact O-N 2.97Å; Y507-T509 VanDerWaalsContact O-N 3.07Å
508	I	22.8	Very low	23.4	Very low	145 Å²	145	137.6 Å²	137.6	74%	0.744	74%	0.737	S	S	*	*			trans	-74.4	95.9	170.3	-60	172.8	0	0	0	107.2
509	T	22.8	Very low	23.4	Very low	107 Å²	107	135.5 Å²	135.5	66%	0.656	74%	0.735	S	S	*	*			trans	-68.1	141.5	156.9	49.7	0	0	0	0	108.5	Y507 D511	Y507-T509 PolarHBondContact O-N 2.97Å; Y507-T509 VanDerWaalsContact O-N 3.07Å; T509-D511 PolarHBondContact O-N 2.63Å
510	P	26.2	Very low	23.5	Very low	87 Å²	87	133.9 Å²	133.9	57%	0.565	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	18	-160.3	-19.5	32.9	0	0	0	118.6	Y513	P510-Y513 VanDerWaalsContact O-CD2 3.31Å; P510-Y513 WeakPolarHBondContact O-CD2 3.27Å
511	D	25.9	Very low	23.4	Very low	157 Å²	157	133 Å²	133	84%	0.84	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	6.2	-173.2	-71.6	-22.2	0	0	0	114.9	T509 Y513	T509-D511 PolarHBondContact O-N 2.63Å; D511-Y513 PolarHBondContact O-N 2.69Å
512	S	22.5	Very low	23.3	Very low	91 Å²	91	133.5 Å²	133.5	64%	0.636	74%	0.743	S	S	*	*			trans	-97.1	58.1	170.5	69.8	0	0	0	0	111.8
513	Y	25.3	Very low	23.5	Very low	135 Å²	135	129.3 Å²	129.3	53%	0.529	74%	0.741	S	S	.	*			trans	-100.1	104	168.9	-82.7	-74.1	0	0	0	110.9	P510 D511 K702	P510-Y513 VanDerWaalsContact O-CD2 3.31Å; P510-Y513 WeakPolarHBondContact O-CD2 3.27Å; D511-Y513 PolarHBondContact O-N 2.69Å; Y513-K702 VanDerWaalsContact CZ-NZ 3.33Å; Y513-K702 WeakPolarHBondContact OH-CD 3.39Å; Y513-K702 WeakPolarHBondContact OH-CE 3.46Å; Y513-K702 PolarHBondContact OH-NZ 3.43Å; Y513-K702 VanDerWaalsContact OH-NZ 3.15Å
514	L	25.6	Very low	23.6	Very low	141 Å²	141	130.5 Å²	130.5	74%	0.738	74%	0.739	S	S	*	*			trans	54	92.5	138.3	-59.1	167.9	0	0	0	117.1	E516	L514-E516 VanDerWaalsContact C-N 3.33Å; L514-E516 PolarHBondContact O-N 3.1Å
515	S	22.6	Very low	23.5	Very low	128 Å²	128	129.1 Å²	129.1	90%	0.895	74%	0.742	S	S	*	*			trans	-89.6	69.3	150.8	64.3	0	0	0	0	109.8
516	E	22.3	Very low	23.5	Very low	146 Å²	146	135.9 Å²	135.9	68%	0.682	76%	0.757	S	S	*	*			trans	-118.1	106.3	158.6	-79.5	-172.6	176	0	0	107.6	L514 Y518	L514-E516 VanDerWaalsContact C-N 3.33Å; L514-E516 PolarHBondContact O-N 3.1Å; E516-Y518 VanDerWaalsContact C-N 3.34Å; E516-Y518 PolarHBondContact O-N 3.4Å
517	S	21.4	Very low	23.6	Very low	123 Å²	123	140 Å²	140	86%	0.86	76%	0.762	S	S	*	*			trans	-59.2	88.1	179.5	48.4	0	0	0	0	110.8
518	Y	21.7	Very low	23.4	Very low	196 Å²	196	138 Å²	138	77%	0.769	77%	0.771	S	S	*	*			trans	-88.4	106.8	157.8	-81.5	-82.5	0	0	0	108.2	E516 I520	E516-Y518 VanDerWaalsContact C-N 3.34Å; E516-Y518 PolarHBondContact O-N 3.4Å; Y518-I520 PolarHBondContact O-N 3.02Å
519	S	23	Very low	23.6	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	78%	0.775	S	S	*	*			trans	-55.7	96.4	166.7	48.1	0	0	0	0	109.5	S521	S519-S521 PolarHBondContact O-N 2.83Å
520	I	24	Very low	23.7	Very low	160 Å²	160	142 Å²	142	82%	0.821	78%	0.784	S	S	*	*			trans	-80.2	112.5	171.2	-67.4	172.4	0	0	0	107.5	Y518	Y518-I520 PolarHBondContact O-N 3.02Å
521	S	22.8	Very low	23.5	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	80%	0.801	S	S	*	*			trans	-57.3	133.3	167.2	48.8	0	0	0	0	111	S519 T523	S519-S521 PolarHBondContact O-N 2.83Å; S521-T523 PolarHBondContact O-N 3.32Å
522	Q	23.1	Very low	23.4	Very low	189 Å²	189	143 Å²	143	88%	0.883	79%	0.791	S	S	*	*			trans	-41.5	125.1	174.4	-62.3	167.4	-19.3	0	0	113.6
523	T	24.9	Very low	23.5	Very low	130 Å²	130	147.1 Å²	147.1	80%	0.798	80%	0.8	S	S	*	*			trans	-149.1	106.8	148.9	40.6	0	0	0	0	111.4	S521	S521-T523 PolarHBondContact O-N 3.32Å
524	N	25	Very low	23.5	Very low	149 Å²	149	151.2 Å²	151.2	80%	0.797	82%	0.816	S	S	*	*			trans	44.2	112.9	143.7	-60.7	-11.4	0	0	0	120.3
525	G	21.9	Very low	23.5	Very low	81 Å²	81	153.3 Å²	153.3	84%	0.835	82%	0.822	S	S	*	*			trans	-65.1	144.5	171.4	0	0	0	0	0	113.6
526	Y	23.3	Very low	23.6	Very low	222 Å²	222	154.7 Å²	154.7	87%	0.871	82%	0.818	S	S	*	*			trans	-101.1	116.9	163.6	-78.9	-87.7	0	0	0	108	C528	Y526-C528 PolarHBondContact O-N 3.29Å
527	D	24.9	Very low	23.8	Very low	161 Å²	161	155.1 Å²	155.1	86%	0.861	83%	0.825	S	S	*	*			trans	-67.6	110.8	171.5	-89.3	-33.6	0	0	0	110.1	Q529	D527-Q529 PolarHBondContact O-N 2.95Å
528	C	20.3	Very low	24.2	Very low	130 Å²	130	157.6 Å²	157.6	88%	0.878	82%	0.823	S	S	*	*			trans	-79.9	98.3	169.4	-66.2	0	0	0	0	109.4	Y526	Y526-C528 PolarHBondContact O-N 3.29Å
529	Q	25.9	Very low	24.5	Very low	178 Å²	178	156.7 Å²	156.7	83%	0.832	83%	0.825	S	S	*	*			trans	-74.2	135.7	171.8	-74.4	-173.1	-14.9	0	0	111.9	D527 L531	D527-Q529 PolarHBondContact O-N 2.95Å; Q529-L531 PolarHBondContact O-N 3.2Å
530	N	24.4	Very low	24.7	Very low	157 Å²	157	159.2 Å²	159.2	84%	0.84	83%	0.829	S	S	*	*			trans	-46.9	116.9	177.6	-86.7	-42.8	0	0	0	114.1
531	L	23.7	Very low	24.9	Very low	174 Å²	174	156.5 Å²	156.5	91%	0.911	82%	0.819	S	S	*	*			trans	-100.7	81	161.9	-89.6	147.6	0	0	0	108.7	Q529	Q529-L531 PolarHBondContact O-N 3.2Å
532	S	24	Very low	25.1	Very low	91 Å²	91	161.5 Å²	161.5	64%	0.636	83%	0.828	S	S	*	*			trans	-116.5	91.1	170.3	59.1	0	0	0	0	109.2
533	Q	24.6	Very low	25.3	Very low	178 Å²	178	162 Å²	162	83%	0.832	83%	0.831	S	S	*	*			trans	176.9	88.1	157.9	-102.1	162.3	6.7	0	0	109.3
534	Y	24.5	Very low	25.3	Very low	221 Å²	221	165.8 Å²	165.8	87%	0.867	83%	0.831	S	S	*	*			trans	-125.2	103.9	154.4	-90.2	-80.4	0	0	0	107.4
535	H	25.8	Very low	25.4	Very low	186 Å²	186	165.7 Å²	165.7	86%	0.861	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.6	171.5	-105.3	-86.2	0	0	0	109.3
536	I	25	Very low	25.5	Very low	157 Å²	157	168.6 Å²	168.6	81%	0.805	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-85	116.2	176.2	-62.3	169.8	0	0	0	107.1
537	D	25.4	Very low	25.5	Very low	154 Å²	154	164.8 Å²	164.8	82%	0.824	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-80.7	117	178.6	-133.8	-18.1	0	0	0	109.9	Q539	D537-Q539 VanDerWaalsContact C-N 3.33Å; D537-Q539 PolarHBondContact O-N 3.37Å
538	E	29.7	Very low	25.4	Very low	176 Å²	176	165.1 Å²	165.1	82%	0.822	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	21.2	-157.9	-141.8	179.3	-162.6	0	0	114.7
539	Q	28.7	Very low	25.6	Very low	176 Å²	176	165.5 Å²	165.5	82%	0.822	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	1.9	-171	-72.9	-116.6	-6.6	0	0	116.4	D537	D537-Q539 VanDerWaalsContact C-N 3.33Å; D537-Q539 PolarHBondContact O-N 3.37Å
540	L	26.5	Very low	25.3	Very low	173 Å²	173	165.3 Å²	165.3	91%	0.906	81%	0.814	S	S	*	*	S	Bend	trans	-110	29.3	-178	-83.8	164.6	0	0	0	115.3
541	V	27.9	Very low	25.2	Very low	102 Å²	102	167.5 Å²	167.5	62%	0.618	81%	0.811	S	S	*	*			trans	-113	15.4	178.4	-171.7	0	0	0	0	113.5
542	K	28.9	Very low	25.1	Very low	207 Å²	207	168.1 Å²	168.1	90%	0.9	81%	0.809	S	S	*	*			trans	-99.1	29.1	177	-79.3	-169.7	179.5	178.6	0	116
543	Q	26.6	Very low	25.3	Very low	200 Å²	200	167.9 Å²	167.9	94%	0.935	81%	0.806	S	S	*	*			trans	-126.3	71.7	161.5	-73.8	-171.7	-5.1	0	0	110.1
544	R	23.7	Very low	25.4	Very low	209 Å²	209	168.2 Å²	168.2	79%	0.789	81%	0.807	S	S	*	*			trans	-94.9	134.2	160.5	-75.3	-179.4	171.5	170.9	-1.6	107.7
545	N	27.4	Very low	25.5	Very low	147 Å²	147	167.1 Å²	167.1	79%	0.786	81%	0.81	S	S	*	*			trans	-144.2	98.9	145.8	-92.9	-18.3	0	0	0	109.4
546	H	24.9	Very low	25.4	Very low	141 Å²	141	166.7 Å²	166.7	65%	0.653	81%	0.814	S	S	*	*			trans	58.3	89.1	141.2	-56.3	-69.7	0	0	0	120.2
547	T	22.8	Very low	25.4	Very low	142 Å²	142	162.4 Å²	162.4	87%	0.871	81%	0.809	S	S	*	*				-117.9	100.6	129.5	25.3	0	0	0	0	107.4	I549	T547-I549 PolarHBondContact O-N 3.3Å; T547-I549 VanDerWaalsContact O-N 3.1Å
548	Q	23.6	Very low	25.4	Very low	168 Å²	168	163.2 Å²	163.2	79%	0.785	81%	0.812	S	S	*	*			trans	-70.6	99.7	176.9	-80.2	173.8	-29.6	0	0	109	L550	Q548-L550 PolarHBondContact O-N 2.8Å
549	I	22.9	Very low	25.1	Very low	138 Å²	138	165.3 Å²	165.3	71%	0.708	81%	0.814	S	S	*	*			trans	-77.3	109.3	161.3	-62	173.8	0	0	0	106.1	T547 Y551	T547-I549 PolarHBondContact O-N 3.3Å; T547-I549 VanDerWaalsContact O-N 3.1Å; I549-Y551 VanDerWaalsContact C-N 3.31Å; I549-Y551 HydrophobicContact CG2-CD2 4.13Å; I549-Y551 PolarHBondContact O-N 3.09Å
550	L	21	Very low	25	Very low	175 Å²	175	164.5 Å²	164.5	92%	0.916	82%	0.815	S	S	*	*			trans	-65.5	91.4	171.7	-79.9	158.5	0	0	0	108.9	Q548	Q548-L550 PolarHBondContact O-N 2.8Å
551	Y	20.9	Very low	24.9	Very low	202 Å²	202	164.8 Å²	164.8	79%	0.792	81%	0.809	S	S	*	*			trans	-80.1	118.8	167.9	-121.8	-96	0	0	0	108.1	I549	I549-Y551 VanDerWaalsContact C-N 3.31Å; I549-Y551 HydrophobicContact CG2-CD2 4.13Å; I549-Y551 PolarHBondContact O-N 3.09Å
552	H	21.6	Very low	24.9	Very low	187 Å²	187	166.3 Å²	166.3	87%	0.866	81%	0.814	S	S	*	*			trans	-102.9	108.6	164	-146.2	-68.7	0	0	0	108.4
553	P	30.1	Very low	24.8	Very low	87 Å²	87	164 Å²	164	57%	0.565	81%	0.81	S	S	*	*			trans	-86.7	133.2	-178.1	33.4	-29.1	0	0	0	109.4
554	Q	25.4	Very low	24.9	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.864	79%	0.793	S	S	*	*			trans	151.9	94.7	146.4	-83.7	167.7	17.5	0	0	109.4
555	Q	26.2	Very low	25.1	Very low	197 Å²	197	156.1 Å²	156.1	92%	0.921	80%	0.796	S	S	*	*				177	102.2	125.6	-94.2	172.7	16.9	0	0	109
556	N	24.7	Very low	25	Very low	178 Å²	178	157.5 Å²	157.5	95%	0.952	80%	0.795	S	S	*	*			trans	-65.1	123.6	165.9	-81.1	-27.9	0	0	0	109.2
557	G	24.4	Very low	24.9	Very low	67 Å²	67	157.3 Å²	157.3	69%	0.691	80%	0.804	S	S	*	*			trans	-178.8	82.8	172	0	0	0	0	0	111.8	Y559	G557-Y559 PolarHBondContact O-N 3.08Å; G557-Y559 VanDerWaalsContact O-N 3.15Å
558	L	25.6	Very low	24.9	Very low	171 Å²	171	155.7 Å²	155.7	90%	0.895	80%	0.795	S	S	*	*			trans	-55.2	114.7	164.1	-83.5	100.9	0	0	0	109.1
559	Y	22.8	Very low	24.9	Very low	220 Å²	220	159 Å²	159	86%	0.863	80%	0.8	S	S	*	*			trans	-141.3	103.2	156.4	-107.1	-82.9	0	0	0	111	G557 K561	G557-Y559 PolarHBondContact O-N 3.08Å; G557-Y559 VanDerWaalsContact O-N 3.15Å; Y559-K561 PolarHBondContact O-N 2.92Å
560	N	27	Very low	24.8	Very low	158 Å²	158	158.2 Å²	158.2	85%	0.845	80%	0.801	S	S	*	*			trans	-50.4	117.1	158.5	-86.2	-33.4	0	0	0	109.8
561	K	25	Very low	24.9	Very low	180 Å²	180	153.1 Å²	153.1	78%	0.783	79%	0.791	S	S	*	*			trans	-136.7	112.2	154.6	-95	-173.3	174.4	179.5	0	109.7	Y559	Y559-K561 PolarHBondContact O-N 2.92Å
562	D	26.8	Very low	25	Very low	134 Å²	134	147.8 Å²	147.8	72%	0.717	78%	0.78	S	S	*	*			trans	52.8	76.9	145.1	-54	-30.5	0	0	0	117	S564	D562-S564 PolarHBondContact O-N 2.94Å
563	I	27.6	Very low	25	Very low	157 Å²	157	143.6 Å²	143.6	81%	0.805	78%	0.777	S	S	*	*			trans	-81.2	39.8	159.5	-50.6	170.3	0	0	0	109.5
564	S	28.4	Very low	24.7	Very low	85 Å²	85	146.1 Å²	146.1	59%	0.594	79%	0.785	S	S	*	*	S	Bend	trans	-99.7	111.4	164.4	52.7	0	0	0	0	107.9	D562	D562-S564 PolarHBondContact O-N 2.94Å
565	N	28.5	Very low	24.6	Very low	159 Å²	159	143.3 Å²	143.3	85%	0.85	79%	0.785	S	S	*	*	S	Bend	trans	92.8	20.7	169.9	-54.3	-11.6	0	0	0	119.2
566	K	24.5	Very low	24.6	Very low	176 Å²	176	141.6 Å²	141.6	77%	0.765	78%	0.779	S	S	*	*			trans	-116.1	98.6	151.3	-70.8	-173.2	179.9	-178.9	0	108.8	T568	K566-T568 PolarHBondContact O-N 3.18Å; K566-T568 PolarHBondContact O-OG1 2.86Å
567	T	23.9	Very low	24.6	Very low	137 Å²	137	137.6 Å²	137.6	84%	0.84	76%	0.762	S	S	*	*			trans	-61.6	83.9	155.9	32	0	0	0	0	106.8	R569	T567-R569 PolarHBondContact O-N 3.2Å
568	T	22.2	Very low	24.8	Very low	109 Å²	109	139.4 Å²	139.4	67%	0.669	77%	0.765	S	S	*	*			trans	-64.6	92.7	169.6	-34.3	0	0	0	0	105.8	K566 V570	K566-T568 PolarHBondContact O-N 3.18Å; K566-T568 PolarHBondContact O-OG1 2.86Å; T568-V570 VanDerWaalsContact C-N 3.29Å; T568-V570 PolarHBondContact O-N 2.99Å
569	R	22.9	Very low	24.8	Very low	236 Å²	236	139.6 Å²	139.6	89%	0.891	76%	0.761	S	S	*	*			trans	-60.9	102.2	163.2	-72.6	-175.2	177.5	-174.5	-0.9	105.1	T567 G571	T567-R569 PolarHBondContact O-N 3.2Å; R569-G571 PolarHBondContact O-N 2.74Å
570	V	22.3	Very low	24.9	Very low	122 Å²	122	134.1 Å²	134.1	74%	0.739	75%	0.753	S	S	*	*			trans	-70.4	83.6	170.1	-177.6	0	0	0	0	106	T568 V572	T568-V570 VanDerWaalsContact C-N 3.29Å; T568-V570 PolarHBondContact O-N 2.99Å; V570-V572 HydrophobicContact CG1-CG2 3.99Å; V570-V572 PolarHBondContact O-N 3.03Å
571	G	21.7	Very low	24.9	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	75%	0.747	S	S	*	*			trans	-78.7	106.4	163.7	0	0	0	0	0	107.3	R569 A573	R569-G571 PolarHBondContact O-N 2.74Å; G571-A573 PolarHBondContact O-N 3.28Å
572	V	23	Very low	25	Very low	90 Å²	90	131.5 Å²	131.5	55%	0.545	75%	0.751	S	S	.	*			trans	-79.8	99	171.3	-173.8	0	0	0	0	107.1	V570 L574	V570-V572 HydrophobicContact CG1-CG2 3.99Å; V570-V572 PolarHBondContact O-N 3.03Å; V572-L574 HydrophobicContact CG1-CD2 3.84Å; V572-L574 HydrophobicContact CG1-CG 3.86Å; V572-L574 PolarHBondContact O-N 2.9Å
573	A	21.5	Very low	24.9	Very low	99 Å²	99	134.3 Å²	134.3	82%	0.818	76%	0.757	S	S	*	*			trans	-74.2	99.8	170.2	0	0	0	0	0	108.9	G571 C575	G571-A573 PolarHBondContact O-N 3.28Å; A573-C575 PolarHBondContact O-N 3.4Å
574	L	25	Very low	24.9	Very low	139 Å²	139	134.3 Å²	134.3	73%	0.728	76%	0.758	S	S	*	*			trans	-89.1	91.4	173.2	-68.1	174.6	0	0	0	109.4	V572 M576	V572-L574 HydrophobicContact CG1-CD2 3.84Å; V572-L574 HydrophobicContact CG1-CG 3.86Å; V572-L574 PolarHBondContact O-N 2.9Å; L574-M576 PolarHBondContact O-N 3.31Å
575	C	23.4	Very low	24.8	Very low	127 Å²	127	135 Å²	135	86%	0.858	76%	0.761	S	S	*	*			trans	-74.3	109.9	165.2	-170.1	0	0	0	0	108.1	A573	A573-C575 PolarHBondContact O-N 3.4Å
576	M	24.4	Very low	25.1	Very low	161 Å²	161	137.4 Å²	137.4	79%	0.793	76%	0.763	S	S	*	*			trans	-110.1	128.7	170.8	-79	-88	-97.5	0	0	108.6	L574	L574-M576 PolarHBondContact O-N 3.31Å
577	P	25.7	Very low	25.4	Very low	93 Å²	93	136 Å²	136	60%	0.604	77%	0.765	S	S	*	*			trans	-70	138.7	-173.5	-9.6	25	0	0	0	111
578	S	28.1	Very low	25.4	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	76%	0.763	S	S	*	*	S	Bend	trans	-53.3	133.6	156.5	42.5	0	0	0	0	108.4
579	E	26.7	Very low	25.6	Very low	174 Å²	174	142 Å²	142	81%	0.813	77%	0.773	S	S	*	*			trans	90.4	45.1	177.2	-48.1	175.3	-173.4	0	0	117.9	T581	E579-T581 PolarHBondContact O-N 2.83Å; E579-T581 VanDerWaalsContact O-N 3.08Å
580	C	25.2	Very low	25.8	Very low	105 Å²	105	136.5 Å²	136.5	71%	0.709	77%	0.766	S	S	*	*			trans	-80.7	59.3	156.4	-80.2	0	0	0	0	111.7	L582	C580-L582 PolarHBondContact O-N 3.28Å
581	T	26.2	Very low	25.9	Very low	116 Å²	116	136.1 Å²	136.1	71%	0.712	77%	0.769	S	S	*	*			trans	-76.4	98.9	160.1	50.9	0	0	0	0	108	E579 K583	E579-T581 PolarHBondContact O-N 2.83Å; E579-T581 VanDerWaalsContact O-N 3.08Å; T581-K583 VanDerWaalsContact C-N 3.35Å; T581-K583 PolarHBondContact O-N 3.39Å
582	L	26.9	Very low	26.1	Very low	167 Å²	167	140.8 Å²	140.8	87%	0.874	77%	0.772	S	S	*	*			trans	-60.3	95.2	170.4	-84.6	155.2	0	0	0	109.3	C580 L584	C580-L582 PolarHBondContact O-N 3.28Å; L582-L584 PolarHBondContact O-N 3.46Å; L582-L584 VanDerWaalsContact O-N 3.09Å
583	K	25.4	Very low	26.3	Very low	193 Å²	193	143.3 Å²	143.3	84%	0.839	78%	0.782	S	S	*	*			trans	-62.8	109.2	165.7	-79.9	-179.5	177.2	171.6	0	107.7	T581	T581-K583 VanDerWaalsContact C-N 3.35Å; T581-K583 PolarHBondContact O-N 3.39Å
584	L	27.4	Very low	26.4	Very low	157 Å²	157	149.8 Å²	149.8	82%	0.822	79%	0.787	S	S	*	*			trans	-50.6	125.2	170	-113.2	83.1	0	0	0	109.3	L582 K586	L582-L584 PolarHBondContact O-N 3.46Å; L582-L584 VanDerWaalsContact O-N 3.09Å; L584-K586 PolarHBondContact O-N 3.46Å
585	P	26.5	Very low	26.4	Very low	101 Å²	101	151.4 Å²	151.4	66%	0.656	79%	0.791	S	S	*	*			trans	-65.3	129.2	176.2	-17	29.5	0	0	0	110.2	N587	P585-N587 PolarHBondContact O-N 3.35Å
586	K	33.3	Very low	26.5	Very low	208 Å²	208	151 Å²	151	90%	0.904	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-4.5	-170.7	-74.6	-175.7	174.9	-178.2	0	116.5	L584	L584-K586 PolarHBondContact O-N 3.46Å
587	N	31.4	Very low	26.5	Very low	148 Å²	148	151.9 Å²	151.9	79%	0.791	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.1	20.7	-170.1	-67.6	-0.9	0	0	0	114.9	P585 Q589	P585-N587 PolarHBondContact O-N 3.35Å; N587-Q589 PolarHBondContact O-N 2.99Å
588	F	24.6	Very low	26.4	Very low	185 Å²	185	154.4 Å²	154.4	81%	0.811	80%	0.796	S	S	*	*			trans	-78.3	76	172.1	-121.4	-92.3	0	0	0	110.9
589	Q	26.6	Very low	26.1	Very low	185 Å²	185	156.8 Å²	156.8	86%	0.864	80%	0.8	S	S	*	*			trans	-83.4	114.2	165.1	-77.2	-175.2	-19.3	0	0	108.8	N587 S591	N587-Q589 PolarHBondContact O-N 2.99Å; Q589-S591 PolarHBondContact O-N 3.38Å; Q589-S591 VanDerWaalsContact O-N 3.08Å
590	T	25.8	Very low	26	Very low	121 Å²	121	153.8 Å²	153.8	74%	0.742	79%	0.794	S	S	*	*			trans	-73.2	92.9	175.2	51.2	0	0	0	0	109.7
591	S	25.7	Very low	26	Very low	115 Å²	115	157.6 Å²	157.6	80%	0.804	80%	0.801	S	S	*	*			trans	-78.2	122.7	168	58.7	0	0	0	0	110.1	Q589	Q589-S591 PolarHBondContact O-N 3.38Å; Q589-S591 VanDerWaalsContact O-N 3.08Å
592	H	26.4	Very low	25.8	Very low	167 Å²	167	158.4 Å²	158.4	77%	0.773	81%	0.81	S	S	*	*			trans	-51.7	161.5	179.1	-73.3	-86.8	0	0	0	115.8
593	N	27.2	Very low	25.6	Very low	143 Å²	143	159.6 Å²	159.6	77%	0.765	81%	0.811	S	S	*	*			trans	86.4	74.6	160.2	-58.6	-18.6	0	0	0	117.4
594	Y	23.2	Very low	25.6	Very low	235 Å²	235	158.1 Å²	158.1	92%	0.922	81%	0.812	S	S	*	*			trans	-119.2	93.4	145.5	-102.9	-91.5	0	0	0	108.5
595	Q	24.5	Very low	25.5	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	80%	0.804	S	S	*	*			trans	-74.4	125.9	164.1	-81	-175.6	-32	0	0	108	Q597	Q595-Q597 PolarHBondContact O-N 3.14Å
596	P	24.9	Very low	25.4	Very low	119 Å²	119	158 Å²	158	77%	0.773	81%	0.814	S	S	*	*			trans	-71.8	106	179	28.3	-30.9	0	0	0	108.7	I598	P596-I598 PolarHBondContact O-N 3.4Å; P596-I598 VanDerWaalsContact O-N 3.15Å
597	Q	24	Very low	24.9	Very low	179 Å²	179	154.4 Å²	154.4	84%	0.836	81%	0.809	S	S	*	*			trans	-62.7	114.8	167.9	-75.4	-172.8	-22.8	0	0	108.6	Q595 N599	Q595-Q597 PolarHBondContact O-N 3.14Å; Q597-N599 PolarHBondContact O-N 3.17Å
598	I	24	Very low	24.5	Very low	145 Å²	145	151.3 Å²	151.3	74%	0.744	81%	0.805	S	S	*	*			trans	-68.4	94.2	175.4	-56.4	171.5	0	0	0	106.5	P596 T600	P596-I598 PolarHBondContact O-N 3.4Å; P596-I598 VanDerWaalsContact O-N 3.15Å; I598-T600 HydrophobicContact CG2-CG2 3.8Å; I598-T600 PolarHBondContact O-N 3.12Å
599	N	23	Very low	24.4	Very low	157 Å²	157	152 Å²	152	84%	0.84	81%	0.807	S	S	*	*			trans	-71.9	84.7	167.6	-98.6	-10.5	0	0	0	108.7	Q597 H601	Q597-N599 PolarHBondContact O-N 3.17Å; N599-H601 PolarHBondContact O-N 3.09Å; N599-H601 VanDerWaalsContact O-N 3.12Å
600	T	24.5	Very low	24.1	Very low	110 Å²	110	148.5 Å²	148.5	68%	0.675	80%	0.804	S	S	*	*			trans	-67.7	89.9	162.2	48.4	0	0	0	0	108.5	I598	I598-T600 HydrophobicContact CG2-CG2 3.8Å; I598-T600 PolarHBondContact O-N 3.12Å
601	H	24.5	Very low	23.9	Very low	185 Å²	185	148.1 Å²	148.1	86%	0.856	80%	0.801	S	S	*	*			trans	-168.8	65	159.2	-106.6	43	0	0	0	111	N599	N599-H601 PolarHBondContact O-N 3.09Å; N599-H601 VanDerWaalsContact O-N 3.12Å
602	C	21.9	Very low	23.7	Very low	134 Å²	134	146.2 Å²	146.2	91%	0.905	80%	0.8	S	S	*	*			trans	-138.7	74.1	154.1	-79.2	0	0	0	0	107.4	D604	C602-D604 PolarHBondContact O-N 2.65Å
603	Q	23.8	Very low	23.5	Very low	192 Å²	192	148 Å²	148	90%	0.897	80%	0.801	S	S	*	*			trans	-76.7	98.9	152.3	-76.8	-176.9	-26.8	0	0	105.9
604	D	24.7	Very low	23.2	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	80%	0.796	S	S	*	*			trans	-150.2	132.1	150.6	-98.8	-28.9	0	0	0	109.4	C602	C602-D604 PolarHBondContact O-N 2.65Å
605	S	25.4	Very low	23.2	Very low	94 Å²	94	141.5 Å²	141.5	66%	0.657	79%	0.79	S	S	*	*			trans	-60.6	139.5	-162.1	47.3	0	0	0	0	116.3	V607	S605-V607 PolarHBondContact O-N 2.95Å
606	N	24.5	Very low	23.2	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	79%	0.787	S	S	*	*			trans	55.3	47.7	143.2	-68.4	-17.3	0	0	0	119.1	A608	N606-A608 PolarHBondContact O-N 2.98Å
607	V	23.2	Very low	23.1	Very low	132 Å²	132	142.8 Å²	142.8	80%	0.8	79%	0.788	S	S	*	*			trans	-87.1	73.3	156.3	-170.2	0	0	0	0	108.9	S605 F609	S605-V607 PolarHBondContact O-N 2.95Å; V607-F609 PolarHBondContact O-N 3.38Å
608	A	21.8	Very low	23.2	Very low	84 Å²	84	141.2 Å²	141.2	69%	0.694	78%	0.783	S	S	*	*			trans	-65.5	118.4	165	0	0	0	0	0	108	N606 S610	N606-A608 PolarHBondContact O-N 2.98Å; A608-S610 VanDerWaalsContact C-N 3.3Å; A608-S610 PolarHBondContact O-N 2.76Å
609	F	21.9	Very low	23.2	Very low	199 Å²	199	138.9 Å²	138.9	87%	0.873	78%	0.78	S	S	*	*			trans	-57.3	92.5	168.5	-79.5	-95.3	0	0	0	109.2	V607 T611	V607-F609 PolarHBondContact O-N 3.38Å; F609-T611 VanDerWaalsContact C-N 3.35Å; F609-T611 PolarHBondContact O-N 2.95Å
610	S	20.3	Very low	23.5	Very low	112 Å²	112	140 Å²	140	78%	0.783	77%	0.773	S	S	*	*			trans	-74.5	93.3	169.2	56.7	0	0	0	0	107.9	A608 G612	A608-S610 VanDerWaalsContact C-N 3.3Å; A608-S610 PolarHBondContact O-N 2.76Å; S610-G612 VanDerWaalsContact C-N 3.32Å; S610-G612 PolarHBondContact O-N 2.87Å
611	T	23	Very low	23.5	Very low	112 Å²	112	144.7 Å²	144.7	69%	0.687	78%	0.783	S	S	*	*			trans	-55.1	107.2	151.3	51.7	0	0	0	0	105.7	F609 Y613	F609-T611 VanDerWaalsContact C-N 3.35Å; F609-T611 PolarHBondContact O-N 2.95Å; T611-Y613 PolarHBondContact O-N 2.82Å
612	G	20.8	Very low	23.8	Very low	76 Å²	76	139 Å²	139	78%	0.784	78%	0.775	S	S	*	*	S	Bend	trans	-66.6	43.5	-175.2	0	0	0	0	0	114.8	S610 S614	S610-G612 VanDerWaalsContact C-N 3.32Å; S610-G612 PolarHBondContact O-N 2.87Å; G612-S614 VanDerWaalsContact C-N 3.32Å; G612-S614 PolarHBondContact O-N 2.63Å
613	Y	22.1	Very low	24.1	Very low	203 Å²	203	141.9 Å²	141.9	80%	0.796	78%	0.775	S	S	*	*			trans	-87.4	81.9	155	-66.6	-75.4	0	0	0	106.6	T611 N615	T611-Y613 PolarHBondContact O-N 2.82Å; Y613-N615 PolarHBondContact O-N 2.83Å; Y613-N615 VanDerWaalsContact O-N 3.1Å
614	S	22	Very low	24.5	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	77%	0.769	S	S	*	*			trans	-61	113.6	159.2	61	0	0	0	0	106.7	G612 K616	G612-S614 VanDerWaalsContact C-N 3.32Å; G612-S614 PolarHBondContact O-N 2.63Å; S614-K616 PolarHBondContact O-N 3.16Å
615	N	22.8	Very low	25.2	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	75%	0.752	S	S	*	*			trans	-63.6	66.7	162.4	-81.3	-13.7	0	0	0	108.9	Y613 D617	Y613-N615 PolarHBondContact O-N 2.83Å; Y613-N615 VanDerWaalsContact O-N 3.1Å; N615-D617 PolarHBondContact O-N 3.06Å
616	K	23.3	Very low	26	Very low	173 Å²	173	139.4 Å²	139.4	75%	0.752	76%	0.762	S	S	*	*			trans	-81.5	105.6	151.2	-77.3	-168.4	175.2	-176.3	0	104.4	S614 I618	S614-K616 PolarHBondContact O-N 3.16Å; K616-I618 PolarHBondContact O-N 3.11Å
617	D	24.4	Very low	27.1	Very low	146 Å²	146	134 Å²	134	78%	0.781	73%	0.732	S	S	*	*			trans	-49.9	86.2	174.3	-62.8	-56.2	0	0	0	110.4	N615 S619	N615-D617 PolarHBondContact O-N 3.06Å; D617-S619 PolarHBondContact O-N 3.4Å; D617-S619 VanDerWaalsContact O-N 3.12Å
618	I	24.9	Very low	28.6	Very low	145 Å²	145	133.5 Å²	133.5	74%	0.744	73%	0.725	S	S	*	*			trans	-84.5	82.4	162.5	-58.6	175.1	0	0	0	104.5	K616 R620	K616-I618 PolarHBondContact O-N 3.11Å; I618-R620 VanDerWaalsContact C-N 3.31Å; I618-R620 PolarHBondContact O-N 3.43Å
619	S	25.2	Very low	30.1	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	70%	0.702	S	S	*	*			trans	-56.4	96.5	167.8	53.2	0	0	0	0	108.3	D617 K621	D617-S619 PolarHBondContact O-N 3.4Å; D617-S619 VanDerWaalsContact O-N 3.12Å; S619-K621 PolarHBondContact O-N 3.34Å
620	R	28.1	Very low	31.8	Very low	182 Å²	182	126 Å²	126	69%	0.687	69%	0.691	S	S	*	*			trans	-68.8	82.9	169.9	-71.3	-178.7	179.8	-164.9	-0.7	108.5	I618 Y734	I618-R620 VanDerWaalsContact C-N 3.31Å; I618-R620 PolarHBondContact O-N 3.43Å; R620-Y734 PolarHBondContact NH1-OH 3.06Å; R620-Y734 VanDerWaalsContact NH1-OH 3.09Å
621	K	26.1	Very low	33.6	Very low	207 Å²	207	127.8 Å²	127.8	90%	0.9	69%	0.687	S	S	*	*			trans	-105.1	88.3	163.6	-75.2	-171.2	176.3	-176.6	0	107.6	S619	S619-K621 PolarHBondContact O-N 3.34Å
622	G	28.9	Very low	35.2	Very low	66 Å²	66	123.8 Å²	123.8	68%	0.68	66%	0.659	S	S	*	*	S	Bend	trans	-147.1	106	171.3	0	0	0	0	0	107.1	T624	G622-T624 PolarHBondContact O-N 2.95Å
623	E	29.2	Very low	37	Very low	195 Å²	195	126.4 Å²	126.4	91%	0.911	65%	0.653	S	S	*	*			trans	1.5	99.3	171.3	-65.7	169.6	173.7	0	0	115.7	Q625	E623-Q625 PolarHBondContact O-N 2.93Å; E623-Q625 VanDerWaalsContact O-N 3.14Å
624	T	32.1	Very low	38.5	Very low	124 Å²	124	122 Å²	122	76%	0.761	64%	0.638	S	S	*	*			trans	-67	109.3	162.9	43.3	0	0	0	0	107.9	G622 N626	G622-T624 PolarHBondContact O-N 2.95Å; T624-N626 PolarHBondContact O-N 2.96Å; T624-N626 VanDerWaalsContact O-N 3.12Å
625	Q	38.5	Very low	39.9	Very low	110 Å²	110	120 Å²	120	51%	0.514	62%	0.618	S	S	.	*			trans	-51	121.1	160.1	-73.2	-177.5	-22	0	0	107.3	E623 I627 N775	E623-Q625 PolarHBondContact O-N 2.93Å; E623-Q625 VanDerWaalsContact O-N 3.14Å; Q625-I627 VanDerWaalsContact C-N 3.33Å; Q625-I627 PolarHBondContact O-N 2.76Å; Q625-N775 PolarHBondContact NE2-OD1 2.98Å
626	N	43.7	Very low	40.9	Very low	160 Å²	160	119 Å²	119	86%	0.856	61%	0.613	S	S	*	*			trans	-67.6	93.1	177.3	-84	-20.5	0	0	0	108.8	T624 N628	T624-N626 PolarHBondContact O-N 2.96Å; T624-N626 VanDerWaalsContact O-N 3.12Å; N626-N628 PolarHBondContact O-N 3.37Å
627	I	47.7	Very low	41.7	Very low	48 Å²	48	114.9 Å²	114.9	25%	0.246	61%	0.606	C	S	.	*			trans	-72.8	122.5	172.5	-52.1	170.9	0	0	0	106.8	Q625 T629 P739 I767 L771	Q625-I627 VanDerWaalsContact C-N 3.33Å; Q625-I627 PolarHBondContact O-N 2.76Å; I627-T629 HydrophobicContact CB-CG2 3.97Å; I627-T629 HydrophobicContact CG2-CG2 3.7Å; I627-T629 PolarHBondContact O-N 3.48Å; I627-P739 HydrophobicContact CD1-CG 4.42Å; I627-I767 HydrophobicContact CD1-CG2 4.48Å; I627-L771 HydrophobicContact CD1-CD1 3.75Å; I627-L771 HydrophobicContact CD1-CD2 3.53Å; I627-L771 HydrophobicContact CD1-CG 3.9Å; I627-L771 HydrophobicContact CG1-CD2 3.59Å; I627-L771 HydrophobicContact CG1-CG 4.4Å
628	N	54.2	Low	42.7	Very low	123 Å²	123	114.4 Å²	114.4	66%	0.658	61%	0.611	S	S	*	*			trans	-70.5	86.2	168.8	-168	12.8	0	0	0	109	N626 S630	N626-N628 PolarHBondContact O-N 3.37Å; N628-S630 PolarHBondContact ND2-OG 3.26Å; N628-S630 PolarHBondContact O-N 3.21Å; N628-S630 WeakPolarHBondContact OD1-CB 3.07Å; N628-S630 PolarHBondContact OD1-OG 2.95Å
629	T	53.2	Low	43.8	Very low	35 Å²	35	116.4 Å²	116.4	22%	0.215	61%	0.614	C	S	.	*	G	3₁₀ helix	trans	-81.5	11	179.3	59.3	0	0	0	0	112.6	I627 E631 Y632 Y742	I627-T629 HydrophobicContact CB-CG2 3.97Å; I627-T629 HydrophobicContact CG2-CG2 3.7Å; I627-T629 PolarHBondContact O-N 3.48Å; T629-E631 PolarHBondContact O-N 3.5Å; T629-Y632 PolarHBondContact O-N 3.09Å; T629-Y632 VanDerWaalsContact O-O 3.14Å; T629-Y742 WeakPolarHBondContact CB-OH 3.18Å; T629-Y742 HydrophobicContact CG2-CE2 3.93Å; T629-Y742 PolarHBondContact OG1-OH 3.46Å
630	S	57.1	Low	45.6	Very low	90 Å²	90	118 Å²	118	63%	0.629	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-60.7	-28.8	-175.5	63.6	0	0	0	0	113.7	N628 Y632	N628-S630 PolarHBondContact ND2-OG 3.26Å; N628-S630 PolarHBondContact O-N 3.21Å; N628-S630 WeakPolarHBondContact OD1-CB 3.07Å; N628-S630 PolarHBondContact OD1-OG 2.95Å; S630-Y632 VanDerWaalsContact C-N 3.28Å
631	E	59.1	Low	47.8	Very low	150 Å²	150	114.9 Å²	114.9	70%	0.701	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-75.8	-15	176.1	-66.1	-177.9	173.6	0	0	113.2	T629	T629-E631 PolarHBondContact O-N 3.5Å
632	Y	56.3	Low	50.3	Low	28 Å²	28	106.2 Å²	106.2	11%	0.11	58%	0.576	C	S	.	*	S	Bend	trans	-107.8	119.7	-173.6	-62.7	-77.3	0	0	0	111.1	T629 S630 K634 S766 I767 N770	T629-Y632 PolarHBondContact O-N 3.09Å; T629-Y632 VanDerWaalsContact O-O 3.14Å; S630-Y632 VanDerWaalsContact C-N 3.28Å; Y632-K634 PolarHBondContact O-N 3.45Å; Y632-S766 WeakPolarHBondContact CE1-OG 3.22Å; Y632-S766 PolarHBondContact OH-OG 3.41Å; Y632-I767 HydrophobicContact CD1-CD1 4.34Å; Y632-I767 HydrophobicContact CD1-CG1 3.89Å; Y632-I767 HydrophobicContact CD2-CD1 4.37Å; Y632-I767 HydrophobicContact CD2-CG1 3.82Å; Y632-I767 HydrophobicContact CE1-CG1 3.98Å; Y632-I767 HydrophobicContact CE2-CG1 3.91Å; Y632-I767 HydrophobicContact CG-CD1 4.05Å; Y632-I767 HydrophobicContact CG-CG1 3.79Å; Y632-N770 PolarHBondContact OH-ND2 3.22Å
633	M	58.2	Low	52.7	Low	131 Å²	131	108.3 Å²	108.3	65%	0.645	57%	0.566	S	S	*	*			trans	-70.9	128.9	174.1	-71.9	-172.9	165.4	0	0	110.8	M635	M633-M635 PolarHBondContact O-N 3.1Å
634	K	54.3	Low	55	Low	109 Å²	109	101 Å²	101	47%	0.474	53%	0.53	S	S	.	.			trans	-67.1	98.6	171.3	-160.5	172.3	-174	155.7	0	108.1	Y632 N636 E741 Y742	Y632-K634 PolarHBondContact O-N 3.45Å; K634-N636 PolarHBondContact O-N 2.92Å; K634-E741 VanDerWaalsContact CE-OE1 3.3Å; K634-E741 WeakPolarHBondContact CE-OE1 3.35Å; K634-E741 WeakPolarHBondContact CE-OE2 2.92Å; K634-E741 HydrophobicContact CG-CB 4.44Å; K634-E741 IonicContact NZ-OE1 2.78Å; K634-E741 PolarHBondContact NZ-OE1 2.7Å; K634-E741 IonicContact NZ-OE2 2.8Å; K634-E741 PolarHBondContact NZ-OE2 2.85Å; K634-Y742 HydrophobicContact CB-CE1 4.29Å
635	M	51.7	Low	56.9	Low	52 Å²	52	100.9 Å²	100.9	26%	0.256	52%	0.521	S	S	.	.	S	Bend	trans	-74.2	82.8	174.2	-78.4	-147	169.8	0	0	109.3	M633 L759	M633-M635 PolarHBondContact O-N 3.1Å; M635-L759 HydrophobicContact CE-CB 3.4Å; M635-L759 HydrophobicContact CE-CD1 3.77Å; M635-L759 HydrophobicContact CE-CG 4.11Å; M635-L759 HydrophobicContact SD-CB 3.73Å
636	N	42.5	Very low	58.8	Low	129 Å²	129	100.5 Å²	100.5	69%	0.69	52%	0.519	S	S	*	.			trans	-175.2	37.1	164.5	-85.9	-39.5	0	0	0	112.2	K634	K634-N636 PolarHBondContact O-N 2.92Å
637	S	40.5	Very low	60.3	Low	86 Å²	86	94.2 Å²	94.2	60%	0.601	49%	0.485	S	S	*	.			trans	-75.2	123	151.2	61.4	0	0	0	0	106.3	K639	S637-K639 PolarHBondContact O-N 3.34Å
638	P	44.4	Very low	61.8	Low	137 Å²	137	95.6 Å²	95.6	89%	0.89	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	12.3	-167.6	-20.4	31.7	0	0	0	116.6
639	K	49.6	Very low	62.6	Low	186 Å²	186	93.6 Å²	93.6	81%	0.809	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-25.3	-165.6	-77.2	-170.3	173.8	-177.1	0	116.8	S637	S637-K639 PolarHBondContact O-N 3.34Å
640	D	62.2	Low	63.7	Low	131 Å²	131	96.5 Å²	96.5	70%	0.701	50%	0.503	S	S	*	.			trans	-120.6	91.3	-173.1	-56.8	-38.2	0	0	0	111.3	V642	D640-V642 PolarHBondContact O-N 3.03Å
641	I	73.7	Confident	65	Low	115 Å²	115	92.7 Å²	92.7	59%	0.59	48%	0.476	S	S	*	.			trans	-67.8	118.3	166.3	-75.8	166.3	0	0	0	107.8	K643 N754	I641-K643 PolarHBondContact O-N 3.42Å; I641-N754 HydrophobicContact CG2-CB 3.89Å; I641-N754 WeakPolarHBondContact CG2-ND2 3.11Å
642	V	79.6	Confident	65.8	Low	26 Å²	26	89.3 Å²	89.3	16%	0.158	46%	0.462	C	S	.	.			trans	-85.4	109	-178.3	-175.8	0	0	0	0	109.8	D640 L647 N754 A755 D756 L759	D640-V642 PolarHBondContact O-N 3.03Å; V642-L647 HydrophobicContact CG1-CD2 4.27Å; V642-N754 WeakPolarHBondContact O-CB 3.2Å; V642-A755 HydrophobicContact CG1-CB 4.3Å; V642-A755 PolarHBondContact O-N 2.77Å; V642-D756 WeakPolarHBondContact CB-OD1 3.21Å; V642-D756 PolarHBondContact N-OD1 3.02Å; V642-L759 HydrophobicContact CB-CD1 4.21Å; V642-L759 HydrophobicContact CG1-CD1 4.08Å; V642-L759 HydrophobicContact CG2-CD1 4.39Å
643	K	78.4	Confident	66.7	Low	109 Å²	109	92.2 Å²	92.2	47%	0.474	48%	0.478	S	S	.	.			trans	-69.4	154.7	173.8	-58.8	-169.7	-157.9	117.8	0	110.7	I641 E645 E646	I641-K643 PolarHBondContact O-N 3.42Å; K643-E645 PolarHBondContact O-N 3.33Å; K643-E645 VanDerWaalsContact O-N 3.16Å; K643-E646 HydrophobicContact CB-CB 4.39Å; K643-E646 HydrophobicContact CB-CG 4.18Å; K643-E646 IonicContact NZ-OE1 2.76Å; K643-E646 PolarHBondContact NZ-OE1 2.65Å; K643-E646 PolarHBondContact O-N 3.49Å
644	W	78.6	Confident	67.9	Low	42 Å²	42	88.4 Å²	88.4	16%	0.159	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-55.6	-32.6	175.8	-69	109.3	0	0	0	113.8	E646 L647 P674 K675 I678 P752 N754 A755 L758	W644-E646 VanDerWaalsContact C-N 3.33Å; W644-L647 HydrophobicContact CE3-CD1 4.04Å; W644-L647 HydrophobicContact CZ3-CD1 4.5Å; W644-P674 HydrophobicContact CE3-CB 4.08Å; W644-P674 HydrophobicContact CZ3-CB 3.58Å; W644-K675 VanDerWaalsContact CB-CE 3.4Å; W644-K675 HydrophobicContact CD2-CD 4.44Å; W644-K675 HydrophobicContact CD2-CG 3.66Å; W644-K675 HydrophobicContact CE3-CG 3.8Å; W644-K675 HydrophobicContact CG-CD 4.31Å; W644-K675 HydrophobicContact CG-CG 4.05Å; W644-K675 HydrophobicContact CZ2-CG 4.47Å; W644-K675 HydrophobicContact CZ3-CG 4.26Å; W644-I678 HydrophobicContact CH2-CB 4.19Å; W644-I678 HydrophobicContact CH2-CD1 4.19Å; W644-I678 HydrophobicContact CH2-CG2 3.66Å; W644-I678 HydrophobicContact CZ2-CD1 4.38Å; W644-I678 HydrophobicContact CZ2-CG2 3.87Å; W644-P752 HydrophobicContact CZ2-CB 3.94Å; W644-N754 VanDerWaalsContact CZ2-O 3.23Å; W644-N754 WeakPolarHBondContact CZ2-O 3.23Å; W644-A755 HydrophobicContact CD2-CB 4.27Å; W644-A755 HydrophobicContact CE3-CB 3.89Å; W644-A755 HydrophobicContact CH2-CB 4.43Å; W644-A755 HydrophobicContact CZ3-CB 3.98Å; W644-L758 HydrophobicContact CH2-CB 4.22Å; W644-L758 HydrophobicContact CH2-CD2 4.15Å; W644-L758 HydrophobicContact CZ3-CD2 4.03Å
645	E	72.3	Confident	69.2	Low	122 Å²	122	83.4 Å²	83.4	57%	0.57	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-79.7	-16.3	-179.2	-66.3	163.1	-157.5	0	0	113.1	K643	K643-E645 PolarHBondContact O-N 3.33Å; K643-E645 VanDerWaalsContact O-N 3.16Å
646	E	76.9	Confident	70.5	Confident	101 Å²	101	85.3 Å²	85.3	47%	0.472	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-101.2	11.9	-175.9	-66.4	167.7	-170.5	0	0	111.8	K643 W644 N648	K643-E646 HydrophobicContact CB-CB 4.39Å; K643-E646 HydrophobicContact CB-CG 4.18Å; K643-E646 IonicContact NZ-OE1 2.76Å; K643-E646 PolarHBondContact NZ-OE1 2.65Å; K643-E646 PolarHBondContact O-N 3.49Å; W644-E646 VanDerWaalsContact C-N 3.33Å; E646-N648 PolarHBondContact O-N 3.35Å
647	L	76	Confident	72.5	Confident	28 Å²	28	83.5 Å²	83.5	15%	0.147	43%	0.431	C	S	.	.			trans	-64.9	113.4	175.5	-76.1	172.6	0	0	0	110.5	V642 W644 D651 L652 I655 P674 A755 L759	V642-L647 HydrophobicContact CG1-CD2 4.27Å; W644-L647 HydrophobicContact CE3-CD1 4.04Å; W644-L647 HydrophobicContact CZ3-CD1 4.5Å; L647-D651 HydrophobicContact CD2-CB 3.74Å; L647-L652 HydrophobicContact CB-CD2 4.36Å; L647-L652 HydrophobicContact CB-CG 4.4Å; L647-L652 HydrophobicContact CD1-CD2 4.29Å; L647-I655 HydrophobicContact CD1-CD1 4.11Å; L647-I655 HydrophobicContact CD2-CD1 4Å; L647-P674 HydrophobicContact CD1-CB 4.17Å; L647-P674 HydrophobicContact CD1-CG 4.1Å; L647-A755 HydrophobicContact CD1-CB 4.35Å; L647-A755 HydrophobicContact CD2-CB 3.74Å; L647-A755 HydrophobicContact CG-CB 4.16Å; L647-L759 HydrophobicContact CD2-CD1 3.94Å; L647-L759 HydrophobicContact CD2-CD2 4.25Å; L647-L759 HydrophobicContact CD2-CG 4.4Å
648	N	79	Confident	74.8	Confident	78 Å²	78	79.5 Å²	79.5	42%	0.417	40%	0.403	S	S	.	.			trans	-79.1	175.1	174.8	60.9	49.5	0	0	0	111.6	E646 D650 D651 L652	E646-N648 PolarHBondContact O-N 3.35Å; N648-D650 VanDerWaalsContact C-N 3.3Å; N648-D650 PolarHBondContact O-N 2.93Å; N648-D650 PolarHBondContact OD1-N 3.15Å; N648-D650 VanDerWaalsContact OD1-N 3.1Å; N648-D651 VanDerWaalsContact CG-OD2 3.27Å; N648-D651 PolarHBondContact ND2-OD2 3.31Å; N648-D651 PolarHBondContact O-N 3.07Å; N648-D651 WeakPolarHBondContact OD1-CB 3.21Å; N648-D651 VanDerWaalsContact OD1-CG 3.24Å; N648-D651 PolarHBondContact OD1-N 3.01Å; N648-D651 PolarHBondContact OD1-OD2 3.42Å; N648-L652 WeakPolarHBondContact O-CG 3.49Å; N648-L652 PolarHBondContact O-N 3.34Å
649	S	70.7	Confident	76.7	Confident	80 Å²	80	74 Å²	74	56%	0.559	37%	0.365	S	S	*	.	H	α-helix	trans	-57.3	-41.2	178.9	50.9	0	0	0	0	112.8	L652 I653	S649-L652 PolarHBondContact O-N 3.32Å; S649-I653 WeakPolarHBondContact O-CD1 3.36Å; S649-I653 WeakPolarHBondContact O-CG1 3.47Å; S649-I653 PolarHBondContact O-N 3.33Å
650	D	76.9	Confident	78	Confident	97 Å²	97	71.7 Å²	71.7	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-69.5	-38.6	-176.1	-63.2	-13.1	0	0	0	111.4	N648 I653 R654	N648-D650 VanDerWaalsContact C-N 3.3Å; N648-D650 PolarHBondContact O-N 2.93Å; N648-D650 PolarHBondContact OD1-N 3.15Å; N648-D650 VanDerWaalsContact OD1-N 3.1Å; D650-I653 PolarHBondContact O-N 2.95Å; D650-R654 WeakPolarHBondContact O-CG 3.38Å; D650-R654 PolarHBondContact O-N 3.36Å
651	D	84.7	Confident	79.1	Confident	10 Å²	10	66.5 Å²	66.5	5%	0.053	33%	0.326	C	S	.	.	H	α-helix	trans	-65.8	-42	174.8	-71.9	-31	0	0	0	111.2	L647 N648 I653 R654 I655 L759	L647-D651 HydrophobicContact CD2-CB 3.74Å; N648-D651 VanDerWaalsContact CG-OD2 3.27Å; N648-D651 PolarHBondContact ND2-OD2 3.31Å; N648-D651 PolarHBondContact O-N 3.07Å; N648-D651 WeakPolarHBondContact OD1-CB 3.21Å; N648-D651 VanDerWaalsContact OD1-CG 3.24Å; N648-D651 PolarHBondContact OD1-N 3.01Å; N648-D651 PolarHBondContact OD1-OD2 3.42Å; D651-I653 VanDerWaalsContact C-N 3.35Å; D651-R654 PolarHBondContact O-N 3.13Å; D651-R654 IonicContact OD1-NH1 3.26Å; D651-R654 PolarHBondContact OD1-NH1 3.24Å; D651-I655 WeakPolarHBondContact O-CD1 3.31Å; D651-I655 VanDerWaalsContact O-CG1 3.26Å; D651-I655 WeakPolarHBondContact O-CG1 3.3Å; D651-I655 PolarHBondContact O-N 2.9Å; D651-L759 HydrophobicContact CB-CD1 4.47Å; D651-L759 HydrophobicContact CB-CD2 3.73Å
652	L	75.4	Confident	79.5	Confident	78 Å²	78	61 Å²	61	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-63.5	-39.8	173	-70.8	174.6	0	0	0	112	L647 N648 S649 I655 H656 P674	L647-L652 HydrophobicContact CB-CD2 4.36Å; L647-L652 HydrophobicContact CB-CG 4.4Å; L647-L652 HydrophobicContact CD1-CD2 4.29Å; N648-L652 WeakPolarHBondContact O-CG 3.49Å; N648-L652 PolarHBondContact O-N 3.34Å; S649-L652 PolarHBondContact O-N 3.32Å; L652-I655 PolarHBondContact O-N 3.09Å; L652-H656 VanDerWaalsContact O-CB 3.31Å; L652-H656 WeakPolarHBondContact O-CB 3.45Å; L652-H656 PolarHBondContact O-N 3.05Å; L652-P674 HydrophobicContact CD2-CG 4Å
653	I	75.4	Confident	79.2	Confident	89 Å²	89	61 Å²	61	46%	0.456	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-45.1	174.6	-71.5	163.3	0	0	0	110.3	S649 D650 D651 I655 H656 Q657	S649-I653 WeakPolarHBondContact O-CD1 3.36Å; S649-I653 WeakPolarHBondContact O-CG1 3.47Å; S649-I653 PolarHBondContact O-N 3.33Å; D650-I653 PolarHBondContact O-N 2.95Å; D651-I653 VanDerWaalsContact C-N 3.35Å; I653-I655 PolarHBondContact O-N 3.23Å; I653-H656 PolarHBondContact O-N 3.31Å; I653-Q657 HydrophobicContact CG2-CG 4.37Å; I653-Q657 WeakPolarHBondContact O-CB 3.16Å; I653-Q657 VanDerWaalsContact O-CG 3.26Å; I653-Q657 WeakPolarHBondContact O-CG 3.49Å; I653-Q657 PolarHBondContact O-N 3.46Å
654	R	82.9	Confident	79.1	Confident	51 Å²	51	62.8 Å²	62.8	19%	0.192	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-43.5	176.6	-72.3	171.2	-177.8	162.2	-1	112.1	D650 D651 Q657 L658 A762	D650-R654 WeakPolarHBondContact O-CG 3.38Å; D650-R654 PolarHBondContact O-N 3.36Å; D651-R654 PolarHBondContact O-N 3.13Å; D651-R654 IonicContact OD1-NH1 3.26Å; D651-R654 PolarHBondContact OD1-NH1 3.24Å; R654-Q657 PolarHBondContact O-N 2.98Å; R654-L658 PolarHBondContact O-N 3.04Å; R654-A762 HydrophobicContact CB-CB 4.48Å
655	I	82.5	Confident	79.1	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-43.1	176.7	-67.2	162.8	0	0	0	110.5	L647 D651 L652 I653 Q657 L658 R659 P674 L677 L758 L759	L647-I655 HydrophobicContact CD1-CD1 4.11Å; L647-I655 HydrophobicContact CD2-CD1 4Å; D651-I655 WeakPolarHBondContact O-CD1 3.31Å; D651-I655 VanDerWaalsContact O-CG1 3.26Å; D651-I655 WeakPolarHBondContact O-CG1 3.3Å; D651-I655 PolarHBondContact O-N 2.9Å; L652-I655 PolarHBondContact O-N 3.09Å; I653-I655 PolarHBondContact O-N 3.23Å; I655-Q657 PolarHBondContact O-N 2.99Å; I655-L658 WeakPolarHBondContact O-CB 3.23Å; I655-L658 PolarHBondContact O-N 3.26Å; I655-R659 PolarHBondContact O-N 2.94Å; I655-P674 HydrophobicContact CD1-CB 4.1Å; I655-P674 HydrophobicContact CD1-CG 4.09Å; I655-P674 HydrophobicContact CG2-CB 4.38Å; I655-P674 HydrophobicContact CG2-CG 4.23Å; I655-L677 HydrophobicContact CG2-CD2 3.61Å; I655-L758 HydrophobicContact CD1-CD2 3.95Å; I655-L758 HydrophobicContact CG1-CD2 3.98Å; I655-L758 HydrophobicContact CG1-CG 4.19Å; I655-L758 HydrophobicContact CG2-CD2 3.9Å; I655-L759 HydrophobicContact CD1-CD2 3.86Å; I655-L759 HydrophobicContact CG1-CD2 3.9Å
656	H	77.7	Confident	79.2	Confident	92 Å²	92	58.1 Å²	58.1	43%	0.426	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-37.5	177.3	-172.5	83.4	0	0	0	112.1	L652 I653 R659 K660	L652-H656 VanDerWaalsContact O-CB 3.31Å; L652-H656 WeakPolarHBondContact O-CB 3.45Å; L652-H656 PolarHBondContact O-N 3.05Å; I653-H656 PolarHBondContact O-N 3.31Å; H656-R659 WeakPolarHBondContact O-CB 3.43Å; H656-R659 PolarHBondContact O-N 3.35Å; H656-K660 VanDerWaalsContact O-CB 3.27Å; H656-K660 WeakPolarHBondContact O-CB 3.19Å; H656-K660 PolarHBondContact O-N 3.39Å
657	Q	84.5	Confident	78.6	Confident	91 Å²	91	56.2 Å²	56.2	43%	0.425	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-46.4	173	-76.1	174.8	-3.6	0	0	111.5	I653 R654 I655 R659 K660 I661	I653-Q657 HydrophobicContact CG2-CG 4.37Å; I653-Q657 WeakPolarHBondContact O-CB 3.16Å; I653-Q657 VanDerWaalsContact O-CG 3.26Å; I653-Q657 WeakPolarHBondContact O-CG 3.49Å; I653-Q657 PolarHBondContact O-N 3.46Å; R654-Q657 PolarHBondContact O-N 2.98Å; I655-Q657 PolarHBondContact O-N 2.99Å; Q657-R659 VanDerWaalsContact C-N 3.34Å; Q657-R659 PolarHBondContact O-N 3.45Å; Q657-K660 PolarHBondContact O-N 3.05Å; Q657-I661 VanDerWaalsContact O-CG1 3.26Å; Q657-I661 WeakPolarHBondContact O-CG1 3.47Å; Q657-I661 PolarHBondContact O-N 3Å
658	L	89.8	Confident	77.9	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-54.5	-51.6	173.3	170.9	66.6	0	0	0	110.9	R654 I655 K660 I661 I662 L681 L758 L761 A762 I765	R654-L658 PolarHBondContact O-N 3.04Å; I655-L658 WeakPolarHBondContact O-CB 3.23Å; I655-L658 PolarHBondContact O-N 3.26Å; L658-K660 PolarHBondContact O-N 3.1Å; L658-I661 PolarHBondContact O-N 3.08Å; L658-I662 HydrophobicContact CD1-CD1 3.8Å; L658-I662 HydrophobicContact CD1-CG1 4.32Å; L658-I662 HydrophobicContact CG-CD1 4.05Å; L658-I662 WeakPolarHBondContact O-CG1 3.34Å; L658-I662 PolarHBondContact O-N 3.37Å; L658-L681 HydrophobicContact CD2-CD1 4.09Å; L658-L758 HydrophobicContact CD2-CD1 4.06Å; L658-L761 HydrophobicContact CD2-CD2 4.21Å; L658-L761 HydrophobicContact CD2-CG 4.26Å; L658-A762 HydrophobicContact CB-CB 3.92Å; L658-A762 HydrophobicContact CD2-CB 4Å; L658-A762 HydrophobicContact CG-CB 4.49Å; L658-I765 HydrophobicContact CD1-CB 3.68Å; L658-I765 HydrophobicContact CD1-CG1 3.83Å; L658-I765 HydrophobicContact CD1-CG2 3.71Å
659	R	83.5	Confident	77	Confident	22 Å²	22	56.9 Å²	56.9	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-55.6	-50.7	177.7	-179	-171.7	169.1	-73.9	-21.2	111.1	I655 H656 Q657 I661 I662 D663 L670 P671 L677	I655-R659 PolarHBondContact O-N 2.94Å; H656-R659 WeakPolarHBondContact O-CB 3.43Å; H656-R659 PolarHBondContact O-N 3.35Å; Q657-R659 VanDerWaalsContact C-N 3.34Å; Q657-R659 PolarHBondContact O-N 3.45Å; R659-I661 VanDerWaalsContact C-N 3.34Å; R659-I661 PolarHBondContact O-N 3.41Å; R659-I662 PolarHBondContact O-N 3.19Å; R659-I662 VanDerWaalsContact O-N 3.16Å; R659-D663 IonicContact CZ-OD2 3.33Å; R659-D663 IonicContact NE-OD2 3.62Å; R659-D663 IonicContact NH1-OD2 2.79Å; R659-D663 PolarHBondContact NH1-OD2 3.14Å; R659-D663 IonicContact NH2-OD2 3.1Å; R659-D663 PolarHBondContact NH2-OD2 3.04Å; R659-D663 WeakPolarHBondContact O-CB 3.47Å; R659-D663 PolarHBondContact O-N 3.24Å; R659-L670 HydrophobicContact CG-CB 4.02Å; R659-L670 PolarHBondContact NE-O 3.1Å; R659-L670 PolarHBondContact NH2-O 3.3Å; R659-P671 WeakPolarHBondContact CD-O 3.48Å; R659-L677 HydrophobicContact CB-CD2 4.36Å
660	K	77.8	Confident	77.1	Confident	136 Å²	136	53.4 Å²	53.4	59%	0.591	25%	0.252	S	S	*	.	H	α-helix	trans	-61.4	-39.2	-179.1	-173.8	178.2	-178.9	178.5	0	112.5	H656 Q657 L658 K664	H656-K660 VanDerWaalsContact O-CB 3.27Å; H656-K660 WeakPolarHBondContact O-CB 3.19Å; H656-K660 PolarHBondContact O-N 3.39Å; Q657-K660 PolarHBondContact O-N 3.05Å; L658-K660 PolarHBondContact O-N 3.1Å; K660-K664 WeakPolarHBondContact O-CB 3.29Å; K660-K664 PolarHBondContact O-N 3.15Å
661	I	84.3	Confident	76	Confident	22 Å²	22	49.6 Å²	49.6	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-51.4	173.9	-69.9	163.5	0	0	0	109.4	Q657 L658 R659 K664 E665 I765 Y769	Q657-I661 VanDerWaalsContact O-CG1 3.26Å; Q657-I661 WeakPolarHBondContact O-CG1 3.47Å; Q657-I661 PolarHBondContact O-N 3Å; L658-I661 PolarHBondContact O-N 3.08Å; R659-I661 VanDerWaalsContact C-N 3.34Å; R659-I661 PolarHBondContact O-N 3.41Å; I661-K664 PolarHBondContact O-N 2.92Å; I661-E665 HydrophobicContact CG2-CG 4.38Å; I661-E665 WeakPolarHBondContact O-CB 3.45Å; I661-E665 VanDerWaalsContact O-CG 3.29Å; I661-E665 WeakPolarHBondContact O-CG 3.39Å; I661-E665 PolarHBondContact O-N 3.5Å; I661-I765 HydrophobicContact CG2-CG2 4.36Å; I661-Y769 HydrophobicContact CD1-CD1 4.38Å; I661-Y769 HydrophobicContact CD1-CG 4.16Å; I661-Y769 HydrophobicContact CG1-CD2 4.46Å; I661-Y769 HydrophobicContact CG1-CG 4.44Å; I661-Y769 HydrophobicContact CG2-CD2 3.71Å; I661-Y769 HydrophobicContact CG2-CE2 3.87Å; I661-Y769 HydrophobicContact CG2-CG 4.4Å
662	I	82.1	Confident	75	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-45.6	-176.8	-59.8	168.1	0	0	0	111.5	L658 R659 K664 E665 L666 I668 L670 L681 I686 L690	L658-I662 HydrophobicContact CD1-CD1 3.8Å; L658-I662 HydrophobicContact CD1-CG1 4.32Å; L658-I662 HydrophobicContact CG-CD1 4.05Å; L658-I662 WeakPolarHBondContact O-CG1 3.34Å; L658-I662 PolarHBondContact O-N 3.37Å; R659-I662 PolarHBondContact O-N 3.19Å; R659-I662 VanDerWaalsContact O-N 3.16Å; I662-K664 VanDerWaalsContact C-N 3.32Å; I662-K664 PolarHBondContact O-N 2.87Å; I662-E665 PolarHBondContact O-N 2.99Å; I662-L666 HydrophobicContact CG2-CD1 3.84Å; I662-L666 HydrophobicContact CG2-CG 4.31Å; I662-L666 WeakPolarHBondContact O-CB 3.39Å; I662-L666 PolarHBondContact O-N 3.32Å; I662-I668 HydrophobicContact CG2-CD1 3.82Å; I662-I668 HydrophobicContact CG2-CG1 4.19Å; I662-L670 HydrophobicContact CB-CD1 3.68Å; I662-L670 HydrophobicContact CD1-CD1 3.75Å; I662-L670 HydrophobicContact CG1-CD1 4.32Å; I662-L670 HydrophobicContact CG2-CD1 3.53Å; I662-L670 HydrophobicContact CG2-CG 4.4Å; I662-L681 HydrophobicContact CD1-CD1 4.38Å; I662-L681 HydrophobicContact CD1-CD2 3.87Å; I662-I686 HydrophobicContact CG2-CG2 3.72Å; I662-L690 HydrophobicContact CG1-CD1 4.3Å; I662-L690 HydrophobicContact CG1-CD2 3.92Å
663	D	74	Confident	74.7	Confident	25 Å²	25	50.2 Å²	50.2	13%	0.134	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-46.4	179.6	-76.1	3.3	0	0	0	110.9	R659 N667 I668 L670	R659-D663 IonicContact CZ-OD2 3.33Å; R659-D663 IonicContact NE-OD2 3.62Å; R659-D663 IonicContact NH1-OD2 2.79Å; R659-D663 PolarHBondContact NH1-OD2 3.14Å; R659-D663 IonicContact NH2-OD2 3.1Å; R659-D663 PolarHBondContact NH2-OD2 3.04Å; R659-D663 WeakPolarHBondContact O-CB 3.47Å; R659-D663 PolarHBondContact O-N 3.24Å; D663-N667 WeakPolarHBondContact O-CA 3.37Å; D663-N667 PolarHBondContact O-N 2.88Å; D663-I668 WeakPolarHBondContact CA-O 3.22Å; D663-I668 VanDerWaalsContact CB-O 3.29Å; D663-I668 WeakPolarHBondContact CB-O 3.49Å; D663-I668 VanDerWaalsContact OD1-O 3.09Å; D663-L670 VanDerWaalsContact OD1-CB 3.31Å; D663-L670 WeakPolarHBondContact OD1-CB 3.42Å; D663-L670 WeakPolarHBondContact OD1-CG 3.48Å; D663-L670 PolarHBondContact OD1-N 3.04Å
664	K	76.3	Confident	74.6	Confident	147 Å²	147	46.7 Å²	46.7	64%	0.639	22%	0.219	S	C	*	.	H	α-helix	trans	-64.2	-49.1	178.8	-177.5	-172	174.1	-165.3	0	111.8	K660 I661 I662	K660-K664 WeakPolarHBondContact O-CB 3.29Å; K660-K664 PolarHBondContact O-N 3.15Å; I661-K664 PolarHBondContact O-N 2.92Å; I662-K664 VanDerWaalsContact C-N 3.32Å; I662-K664 PolarHBondContact O-N 2.87Å
665	E	79.2	Confident	74.2	Confident	38 Å²	38	48.9 Å²	48.9	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-72.2	-43.3	-174.8	-67.3	-55.9	148	0	0	111.2	I661 I662 L690 K693 F694 Y769	I661-E665 HydrophobicContact CG2-CG 4.38Å; I661-E665 WeakPolarHBondContact O-CB 3.45Å; I661-E665 VanDerWaalsContact O-CG 3.29Å; I661-E665 WeakPolarHBondContact O-CG 3.39Å; I661-E665 PolarHBondContact O-N 3.5Å; I662-E665 PolarHBondContact O-N 2.99Å; E665-L690 HydrophobicContact CB-CD1 3.69Å; E665-L690 HydrophobicContact CG-CD1 4.2Å; E665-K693 WeakPolarHBondContact O-CD 3.49Å; E665-K693 WeakPolarHBondContact O-CE 3.44Å; E665-K693 PolarHBondContact O-NZ 2.99Å; E665-F694 HydrophobicContact CG-CD2 4.43Å; E665-Y769 HydrophobicContact CG-CE2 4.27Å; E665-Y769 PolarHBondContact OE1-OH 3.11Å; E665-Y769 VanDerWaalsContact OE1-OH 3.1Å
666	L	72.9	Confident	73.5	Confident	29 Å²	29	49.7 Å²	49.7	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-91.6	-10.4	-176.5	-67.7	-174.9	0	0	0	114.6	I662 I668 I686 Q689 L690 K693	I662-L666 HydrophobicContact CG2-CD1 3.84Å; I662-L666 HydrophobicContact CG2-CG 4.31Å; I662-L666 WeakPolarHBondContact O-CB 3.39Å; I662-L666 PolarHBondContact O-N 3.32Å; L666-I668 HydrophobicContact CB-CB 4.49Å; L666-I668 HydrophobicContact CB-CD1 4.15Å; L666-I668 HydrophobicContact CB-CG1 3.92Å; L666-I668 HydrophobicContact CB-CG2 4.06Å; L666-I668 HydrophobicContact CD1-CD1 3.92Å; L666-I668 PolarHBondContact O-N 3.01Å; L666-I686 HydrophobicContact CD1-CG2 3.87Å; L666-I686 WeakPolarHBondContact CD1-O 3.32Å; L666-Q689 HydrophobicContact CD1-CB 3.93Å; L666-Q689 HydrophobicContact CD2-CB 4.02Å; L666-L690 HydrophobicContact CD1-CB 4.07Å; L666-L690 HydrophobicContact CG-CB 4.37Å; L666-L690 HydrophobicContact CG-CD1 4.28Å; L666-K693 HydrophobicContact CD2-CB 4.25Å; L666-K693 HydrophobicContact CD2-CD 4.06Å
667	N	64.6	Low	73.4	Confident	60 Å²	60	45.3 Å²	45.3	32%	0.321	21%	0.213	S	C	.	.			trans	53.7	39.3	-169.5	-165.2	68	0	0	0	112.3	K195 D663	K195-N667 VanDerWaalsContact NZ-CB 3.34Å; K195-N667 PolarHBondContact NZ-ND2 3.08Å; K195-N667 VanDerWaalsContact NZ-ND2 3.11Å; K195-N667 PolarHBondContact NZ-OD1 3.01Å; D663-N667 WeakPolarHBondContact O-CA 3.37Å; D663-N667 PolarHBondContact O-N 2.88Å
668	I	61.4	Low	73.4	Confident	56 Å²	56	41.1 Å²	41.1	29%	0.287	19%	0.193	S	C	.	.			trans	-109.7	162.6	170.6	66.9	178.3	0	0	0	108.3	I662 D663 L666 L670 I686	I662-I668 HydrophobicContact CG2-CD1 3.82Å; I662-I668 HydrophobicContact CG2-CG1 4.19Å; D663-I668 WeakPolarHBondContact CA-O 3.22Å; D663-I668 VanDerWaalsContact CB-O 3.29Å; D663-I668 WeakPolarHBondContact CB-O 3.49Å; D663-I668 VanDerWaalsContact OD1-O 3.09Å; L666-I668 HydrophobicContact CB-CB 4.49Å; L666-I668 HydrophobicContact CB-CD1 4.15Å; L666-I668 HydrophobicContact CB-CG1 3.92Å; L666-I668 HydrophobicContact CB-CG2 4.06Å; L666-I668 HydrophobicContact CD1-CD1 3.92Å; L666-I668 PolarHBondContact O-N 3.01Å; I668-L670 HydrophobicContact CD1-CD1 4.42Å; I668-L670 HydrophobicContact CD1-CD2 3.92Å; I668-L670 HydrophobicContact CD1-CG 3.99Å; I668-L670 HydrophobicContact CG1-CG 4.21Å; I668-I686 HydrophobicContact CD1-CD1 4.21Å; I668-I686 HydrophobicContact CD1-CG1 4.4Å; I668-I686 HydrophobicContact CD1-CG2 3.54Å
669	R	61.6	Low	72.5	Confident	64 Å²	64	44.1 Å²	44.1	24%	0.242	21%	0.209	C	C	.	.			trans	-112.5	105.8	172.9	-165.3	-163.6	-160.9	92	25	109.5	L105 E126 D128	L105-R669 VanDerWaalsContact CD1-CZ 3.41Å; E126-R669 IonicContact OE1-CZ 3.44Å; E126-R669 IonicContact OE1-NH1 2.72Å; E126-R669 PolarHBondContact OE1-NH1 2.89Å; E126-R669 IonicContact OE1-NH2 2.99Å; E126-R669 PolarHBondContact OE1-NH2 2.77Å; E126-R669 IonicContact OE2-NH2 3.02Å; E126-R669 PolarHBondContact OE2-NH2 3.26Å; D128-R669 IonicContact OD2-NH1 3.8Å; D128-R669 PolarHBondContact OD2-NH1 3.35Å
670	L	70.8	Confident	72.1	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.037	22%	0.218	C	C	.	.			trans	-83.8	151.3	174.9	-70.6	179.1	0	0	0	111.4	R659 I662 D663 I668 L677 E680 L681 I686	R659-L670 HydrophobicContact CG-CB 4.02Å; R659-L670 PolarHBondContact NE-O 3.1Å; R659-L670 PolarHBondContact NH2-O 3.3Å; I662-L670 HydrophobicContact CB-CD1 3.68Å; I662-L670 HydrophobicContact CD1-CD1 3.75Å; I662-L670 HydrophobicContact CG1-CD1 4.32Å; I662-L670 HydrophobicContact CG2-CD1 3.53Å; I662-L670 HydrophobicContact CG2-CG 4.4Å; D663-L670 VanDerWaalsContact OD1-CB 3.31Å; D663-L670 WeakPolarHBondContact OD1-CB 3.42Å; D663-L670 WeakPolarHBondContact OD1-CG 3.48Å; D663-L670 PolarHBondContact OD1-N 3.04Å; I668-L670 HydrophobicContact CD1-CD1 4.42Å; I668-L670 HydrophobicContact CD1-CD2 3.92Å; I668-L670 HydrophobicContact CD1-CG 3.99Å; I668-L670 HydrophobicContact CG1-CG 4.21Å; L670-L677 HydrophobicContact CB-CD1 3.7Å; L670-L677 HydrophobicContact CD1-CD1 3.75Å; L670-L677 HydrophobicContact CD2-CD1 4.45Å; L670-L677 HydrophobicContact CG-CD1 4.2Å; L670-E680 HydrophobicContact CD2-CB 4.32Å; L670-L681 HydrophobicContact CD1-CD2 4.18Å; L670-I686 HydrophobicContact CD2-CD1 3.65Å
671	P	54.9	Low	72.4	Confident	17 Å²	17	39.3 Å²	39.3	11%	0.11	19%	0.189	C	C	.	.			trans	-61.4	144.4	177.4	26.9	-35.9	0	0	0	111.1	R659 H676 L677 E680	R659-P671 WeakPolarHBondContact CD-O 3.48Å; P671-H676 HydrophobicContact CB-CB 3.74Å; P671-H676 HydrophobicContact CG-CB 3.81Å; P671-L677 HydrophobicContact CG-CB 4.19Å; P671-L677 HydrophobicContact CG-CD1 4.46Å; P671-E680 HydrophobicContact CG-CG 4.11Å
672	I	64.3	Low	72.5	Confident	78 Å²	78	39.2 Å²	39.2	40%	0.4	19%	0.19	S	C	.	.	S	Bend	trans	-73.8	-36.1	177.6	-60.1	170.6	0	0	0	110.2	T80 P674	T80-I672 HydrophobicContact CG2-CD1 4.41Å; I672-P674 WeakPolarHBondContact O-CD 3.18Å
673	N	67.9	Low	72.3	Confident	23 Å²	23	40.7 Å²	40.7	12%	0.123	20%	0.199	C	C	.	.	S	Bend	trans	-64	122.1	-179.9	-179.3	-28.4	0	0	0	111.3	I36 S38 K675 H676 L677	I36-N673 HydrophobicContact CG2-CB 4.41Å; I36-N673 WeakPolarHBondContact CG2-ND2 3.35Å; S38-N673 PolarHBondContact OG-ND2 3.16Å; N673-K675 VanDerWaalsContact C-N 3.31Å; N673-K675 PolarHBondContact O-N 3.44Å; N673-K675 WeakPolarHBondContact OD1-CB 3.45Å; N673-K675 PolarHBondContact OD1-N 2.99Å; N673-H676 HydrophobicContact CB-CB 4.23Å; N673-H676 PolarHBondContact O-N 3.27Å; N673-H676 VanDerWaalsContact O-N 3.14Å; N673-L677 WeakPolarHBondContact O-CB 3.36Å; N673-L677 PolarHBondContact O-N 3.5Å
674	P	73.3	Confident	72.7	Confident	16 Å²	16	39.5 Å²	39.5	10%	0.104	19%	0.193	C	C	.	.	H	α-helix	trans	-53.6	-39.1	178.5	-29.1	36.3	0	0	0	115	W644 L647 L652 I655 I672 L677 I678 L758	W644-P674 HydrophobicContact CE3-CB 4.08Å; W644-P674 HydrophobicContact CZ3-CB 3.58Å; L647-P674 HydrophobicContact CD1-CB 4.17Å; L647-P674 HydrophobicContact CD1-CG 4.1Å; L652-P674 HydrophobicContact CD2-CG 4Å; I655-P674 HydrophobicContact CD1-CB 4.1Å; I655-P674 HydrophobicContact CD1-CG 4.09Å; I655-P674 HydrophobicContact CG2-CB 4.38Å; I655-P674 HydrophobicContact CG2-CG 4.23Å; I672-P674 WeakPolarHBondContact O-CD 3.18Å; P674-L677 PolarHBondContact O-N 3.38Å; P674-I678 PolarHBondContact O-N 3.37Å; P674-L758 HydrophobicContact CB-CD2 3.72Å; P674-L758 WeakPolarHBondContact O-CD2 3.16Å
675	K	75.2	Confident	72.7	Confident	97 Å²	97	34.5 Å²	34.5	42%	0.422	18%	0.175	S	C	.	.	H	α-helix	trans	-67.8	-40	179.2	-70.2	-177	179.6	177.1	0	111.7	W644 N673 I678 I679	W644-K675 VanDerWaalsContact CB-CE 3.4Å; W644-K675 HydrophobicContact CD2-CD 4.44Å; W644-K675 HydrophobicContact CD2-CG 3.66Å; W644-K675 HydrophobicContact CE3-CG 3.8Å; W644-K675 HydrophobicContact CG-CD 4.31Å; W644-K675 HydrophobicContact CG-CG 4.05Å; W644-K675 HydrophobicContact CZ2-CG 4.47Å; W644-K675 HydrophobicContact CZ3-CG 4.26Å; N673-K675 VanDerWaalsContact C-N 3.31Å; N673-K675 PolarHBondContact O-N 3.44Å; N673-K675 WeakPolarHBondContact OD1-CB 3.45Å; N673-K675 PolarHBondContact OD1-N 2.99Å; K675-I678 WeakPolarHBondContact O-CG2 3.43Å; K675-I679 WeakPolarHBondContact O-CD1 3.35Å; K675-I679 VanDerWaalsContact O-CG1 3.3Å; K675-I679 WeakPolarHBondContact O-CG1 3.4Å; K675-I679 PolarHBondContact O-N 3.01Å
676	H	67.3	Low	72.6	Confident	21 Å²	21	33.5 Å²	33.5	10%	0.097	17%	0.171	C	C	.	.	H	α-helix	trans	-72	-37.8	174.8	-82.4	-74.4	0	0	0	112	S38 N39 P671 N673 I678 I679 E680	S38-H676 WeakPolarHBondContact CB-NE2 3.28Å; S38-H676 PolarHBondContact OG-CD2 3.37Å; S38-H676 VanDerWaalsContact OG-CD2 3.28Å; N39-H676 VanDerWaalsContact CB-CE1 3.47Å; N39-H676 WeakPolarHBondContact CB-CE1 3.09Å; P671-H676 HydrophobicContact CB-CB 3.74Å; P671-H676 HydrophobicContact CG-CB 3.81Å; N673-H676 HydrophobicContact CB-CB 4.23Å; N673-H676 PolarHBondContact O-N 3.27Å; N673-H676 VanDerWaalsContact O-N 3.14Å; H676-I678 PolarHBondContact O-N 2.8Å; H676-I679 WeakPolarHBondContact O-CB 3.42Å; H676-I679 PolarHBondContact O-N 2.9Å; H676-E680 PolarHBondContact O-N 2.81Å; H676-E680 VanDerWaalsContact O-N 3.09Å
677	L	76.4	Confident	73.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-46.6	177.5	-178	64.5	0	0	0	111.4	I655 R659 L670 P671 N673 P674 I679 E680 L681 L758	I655-L677 HydrophobicContact CG2-CD2 3.61Å; R659-L677 HydrophobicContact CB-CD2 4.36Å; L670-L677 HydrophobicContact CB-CD1 3.7Å; L670-L677 HydrophobicContact CD1-CD1 3.75Å; L670-L677 HydrophobicContact CD2-CD1 4.45Å; L670-L677 HydrophobicContact CG-CD1 4.2Å; P671-L677 HydrophobicContact CG-CB 4.19Å; P671-L677 HydrophobicContact CG-CD1 4.46Å; N673-L677 WeakPolarHBondContact O-CB 3.36Å; N673-L677 PolarHBondContact O-N 3.5Å; P674-L677 PolarHBondContact O-N 3.38Å; L677-I679 VanDerWaalsContact C-N 3.27Å; L677-I679 PolarHBondContact O-N 3.38Å; L677-E680 PolarHBondContact O-N 3.39Å; L677-L681 HydrophobicContact CD1-CD1 3.95Å; L677-L681 HydrophobicContact CD1-CG 4.27Å; L677-L681 HydrophobicContact CG-CD1 3.86Å; L677-L681 HydrophobicContact CG-CG 4.49Å; L677-L681 WeakPolarHBondContact O-CB 3.17Å; L677-L681 VanDerWaalsContact O-CG 3.23Å; L677-L681 WeakPolarHBondContact O-CG 3.45Å; L677-L681 PolarHBondContact O-N 3.01Å; L677-L758 HydrophobicContact CD2-CD1 4.19Å; L677-L758 HydrophobicContact CD2-CD2 4.39Å; L677-L758 HydrophobicContact CG-CD1 4.27Å
678	I	83.4	Confident	74.2	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-33.2	178.3	-169.5	152.8	0	0	0	112.2	W644 P674 K675 H676 L681 S682 I749 P752 L758	W644-I678 HydrophobicContact CH2-CB 4.19Å; W644-I678 HydrophobicContact CH2-CD1 4.19Å; W644-I678 HydrophobicContact CH2-CG2 3.66Å; W644-I678 HydrophobicContact CZ2-CD1 4.38Å; W644-I678 HydrophobicContact CZ2-CG2 3.87Å; P674-I678 PolarHBondContact O-N 3.37Å; K675-I678 WeakPolarHBondContact O-CG2 3.43Å; H676-I678 PolarHBondContact O-N 2.8Å; I678-L681 PolarHBondContact O-N 3.06Å; I678-S682 VanDerWaalsContact O-CB 3.3Å; I678-S682 WeakPolarHBondContact O-CB 3.34Å; I678-S682 PolarHBondContact O-N 2.77Å; I678-I749 HydrophobicContact CG1-CG2 4.42Å; I678-P752 HydrophobicContact CD1-CB 3.76Å; I678-P752 HydrophobicContact CG1-CB 4.12Å; I678-P752 HydrophobicContact CG1-CG 4.43Å; I678-P752 HydrophobicContact CG2-CB 3.99Å; I678-P752 HydrophobicContact CG2-CG 4.07Å; I678-L758 HydrophobicContact CB-CB 4.45Å; I678-L758 HydrophobicContact CB-CD1 4.21Å; I678-L758 HydrophobicContact CD1-CB 3.78Å
679	I	71.9	Confident	75	Confident	66 Å²	66	30.9 Å²	30.9	34%	0.338	15%	0.154	S	C	.	.	H	α-helix	trans	-63.7	-50.4	175.9	-67.1	165.8	0	0	0	110.5	K675 H676 L677 L681 S682	K675-I679 WeakPolarHBondContact O-CD1 3.35Å; K675-I679 VanDerWaalsContact O-CG1 3.3Å; K675-I679 WeakPolarHBondContact O-CG1 3.4Å; K675-I679 PolarHBondContact O-N 3.01Å; H676-I679 WeakPolarHBondContact O-CB 3.42Å; H676-I679 PolarHBondContact O-N 2.9Å; L677-I679 VanDerWaalsContact C-N 3.27Å; L677-I679 PolarHBondContact O-N 3.38Å; I679-L681 VanDerWaalsContact C-N 3.28Å; I679-L681 PolarHBondContact O-N 3.16Å; I679-S682 WeakPolarHBondContact O-CB 3.32Å; I679-S682 PolarHBondContact O-N 2.71Å; I679-S682 VanDerWaalsContact O-N 3.1Å; I679-S682 PolarHBondContact O-OG 2.94Å
680	E	74.1	Confident	76.2	Confident	58 Å²	58	28 Å²	28	27%	0.271	14%	0.144	S	C	.	.	H	α-helix	trans	-58.8	-40.3	177.2	-75.1	-65	158.2	0	0	112.1	R62 L670 P671 H676 L677 S682 T683 I686	R62-E680 IonicContact CZ-OE1 2.74Å; R62-E680 IonicContact NH1-OE1 3.28Å; R62-E680 PolarHBondContact NH1-OE1 3.16Å; R62-E680 IonicContact NH2-OE1 3.47Å; R62-E680 PolarHBondContact NH2-OE1 3.18Å; L670-E680 HydrophobicContact CD2-CB 4.32Å; P671-E680 HydrophobicContact CG-CG 4.11Å; H676-E680 PolarHBondContact O-N 2.81Å; H676-E680 VanDerWaalsContact O-N 3.09Å; L677-E680 PolarHBondContact O-N 3.39Å; E680-S682 VanDerWaalsContact C-N 3.31Å; E680-S682 PolarHBondContact O-N 3.45Å; E680-T683 PolarHBondContact O-OG1 3.42Å; E680-I686 HydrophobicContact CB-CD1 4.21Å
681	L	85.6	Confident	77	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-76.3	-17.4	179.5	-61.9	176.8	0	0	0	113.2	L658 I662 L670 L677 I678 I679 T683 G684 I686 L687 L758 L761	L658-L681 HydrophobicContact CD2-CD1 4.09Å; I662-L681 HydrophobicContact CD1-CD1 4.38Å; I662-L681 HydrophobicContact CD1-CD2 3.87Å; L670-L681 HydrophobicContact CD1-CD2 4.18Å; L677-L681 HydrophobicContact CD1-CD1 3.95Å; L677-L681 HydrophobicContact CD1-CG 4.27Å; L677-L681 HydrophobicContact CG-CD1 3.86Å; L677-L681 HydrophobicContact CG-CG 4.49Å; L677-L681 WeakPolarHBondContact O-CB 3.17Å; L677-L681 VanDerWaalsContact O-CG 3.23Å; L677-L681 WeakPolarHBondContact O-CG 3.45Å; L677-L681 PolarHBondContact O-N 3.01Å; I678-L681 PolarHBondContact O-N 3.06Å; I679-L681 VanDerWaalsContact C-N 3.28Å; I679-L681 PolarHBondContact O-N 3.16Å; L681-T683 VanDerWaalsContact C-N 3.31Å; L681-T683 PolarHBondContact O-N 2.73Å; L681-G684 PolarHBondContact O-N 3.39Å; L681-G684 VanDerWaalsContact O-N 3.07Å; L681-I686 HydrophobicContact CD2-CB 4.12Å; L681-I686 HydrophobicContact CD2-CG2 3.9Å; L681-L687 HydrophobicContact CD2-CD2 4.29Å; L681-L687 HydrophobicContact CD2-CG 4.38Å; L681-L758 HydrophobicContact CD1-CD1 4.15Å; L681-L761 HydrophobicContact CB-CD2 4.31Å; L681-L761 HydrophobicContact CD1-CD2 3.75Å
682	S	84.6	Confident	78.2	Confident	19 Å²	19	29.4 Å²	29.4	13%	0.133	15%	0.151	C	C	.	.	H	α-helix	trans	-67.7	-26.1	-172.3	73	0	0	0	0	114.9	I678 I679 E680 G684 L726	I678-S682 VanDerWaalsContact O-CB 3.3Å; I678-S682 WeakPolarHBondContact O-CB 3.34Å; I678-S682 PolarHBondContact O-N 2.77Å; I679-S682 WeakPolarHBondContact O-CB 3.32Å; I679-S682 PolarHBondContact O-N 2.71Å; I679-S682 VanDerWaalsContact O-N 3.1Å; I679-S682 PolarHBondContact O-OG 2.94Å; E680-S682 VanDerWaalsContact C-N 3.31Å; E680-S682 PolarHBondContact O-N 3.45Å; S682-G684 PolarHBondContact O-N 2.98Å; S682-L726 WeakPolarHBondContact O-CD1 3.31Å
683	T	79.3	Confident	78.7	Confident	31 Å²	31	31.6 Å²	31.6	19%	0.19	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.2	175	67.5	0	0	0	0	112.2	E680 L681 V685 Y722 N725	E680-T683 PolarHBondContact O-OG1 3.42Å; L681-T683 VanDerWaalsContact C-N 3.31Å; L681-T683 PolarHBondContact O-N 2.73Å; T683-V685 PolarHBondContact O-N 3.33Å; T683-V685 PolarHBondContact OG1-N 2.99Å; T683-Y722 HydrophobicContact CG2-CE1 4.17Å; T683-Y722 HydrophobicContact CG2-CE2 4.06Å; T683-N725 WeakPolarHBondContact O-CB 2.97Å; T683-N725 PolarHBondContact O-ND2 3.22Å; T683-N725 VanDerWaalsContact O-ND2 3.13Å
684	G	81.5	Confident	79	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	74	-3.1	-172.1	0	0	0	0	0	114.6	L681 S682 L687 I688	L681-G684 PolarHBondContact O-N 3.39Å; L681-G684 VanDerWaalsContact O-N 3.07Å; S682-G684 PolarHBondContact O-N 2.98Å; G684-L687 PolarHBondContact O-N 3.36Å; G684-I688 VanDerWaalsContact O-CG1 3.3Å; G684-I688 WeakPolarHBondContact O-CG1 3.43Å; G684-I688 PolarHBondContact O-N 2.86Å
685	V	75.8	Confident	78.9	Confident	42 Å²	42	31.5 Å²	31.5	26%	0.255	16%	0.155	S	C	.	.	H	α-helix	trans	-64.9	-48.9	-176.1	174.6	0	0	0	0	111.1	T683 L687 I688 Q689 I703	T683-V685 PolarHBondContact O-N 3.33Å; T683-V685 PolarHBondContact OG1-N 2.99Å; V685-L687 VanDerWaalsContact C-N 3.29Å; V685-L687 PolarHBondContact O-N 3.2Å; V685-I688 WeakPolarHBondContact O-CB 3.31Å; V685-I688 PolarHBondContact O-N 3.45Å; V685-I688 VanDerWaalsContact O-N 3.15Å; V685-Q689 WeakPolarHBondContact O-CG 3.38Å; V685-Q689 PolarHBondContact O-N 3.45Å; V685-I703 HydrophobicContact CG1-CD1 4Å; V685-I703 HydrophobicContact CG2-CG2 4.26Å
686	I	77.7	Confident	78.1	Confident	18 Å²	18	28.3 Å²	28.3	9%	0.092	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-41.5	178.5	-60.7	-179	0	0	0	110.6	I662 L666 I668 L670 E680 L681 Q689 L690	I662-I686 HydrophobicContact CG2-CG2 3.72Å; L666-I686 HydrophobicContact CD1-CG2 3.87Å; L666-I686 WeakPolarHBondContact CD1-O 3.32Å; I668-I686 HydrophobicContact CD1-CD1 4.21Å; I668-I686 HydrophobicContact CD1-CG1 4.4Å; I668-I686 HydrophobicContact CD1-CG2 3.54Å; L670-I686 HydrophobicContact CD2-CD1 3.65Å; E680-I686 HydrophobicContact CB-CD1 4.21Å; L681-I686 HydrophobicContact CD2-CB 4.12Å; L681-I686 HydrophobicContact CD2-CG2 3.9Å; I686-Q689 PolarHBondContact O-N 2.98Å; I686-L690 WeakPolarHBondContact O-CB 3.49Å; I686-L690 PolarHBondContact O-N 3.36Å
687	L	87.8	Confident	77.1	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-66.8	-38	177	-65.8	174.9	0	0	0	112.3	L681 G684 V685 L690 L691 L726 C729 L761 I765	L681-L687 HydrophobicContact CD2-CD2 4.29Å; L681-L687 HydrophobicContact CD2-CG 4.38Å; G684-L687 PolarHBondContact O-N 3.36Å; V685-L687 VanDerWaalsContact C-N 3.29Å; V685-L687 PolarHBondContact O-N 3.2Å; L687-L690 PolarHBondContact O-N 2.89Å; L687-L691 WeakPolarHBondContact O-CB 3.43Å; L687-L691 WeakPolarHBondContact O-CG 3.27Å; L687-L691 PolarHBondContact O-N 3.44Å; L687-L726 HydrophobicContact CD1-CD2 3.62Å; L687-C729 HydrophobicContact CB-CB 4.41Å; L687-L761 HydrophobicContact CD1-CD1 3.85Å; L687-L761 HydrophobicContact CD1-CD2 4.07Å; L687-L761 HydrophobicContact CD2-CD1 4.19Å; L687-L761 HydrophobicContact CD2-CD2 4.31Å; L687-I765 HydrophobicContact CD2-CD1 4.46Å
688	I	83.8	Confident	75.7	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-45.8	173.9	-73	174	0	0	0	110.2	G684 V685 L691 N692 I701 I703 N725 C729	G684-I688 VanDerWaalsContact O-CG1 3.3Å; G684-I688 WeakPolarHBondContact O-CG1 3.43Å; G684-I688 PolarHBondContact O-N 2.86Å; V685-I688 WeakPolarHBondContact O-CB 3.31Å; V685-I688 PolarHBondContact O-N 3.45Å; V685-I688 VanDerWaalsContact O-N 3.15Å; I688-L691 PolarHBondContact O-N 2.93Å; I688-N692 WeakPolarHBondContact O-CB 3.49Å; I688-N692 PolarHBondContact O-N 3.19Å; I688-N692 PolarHBondContact O-OD1 2.85Å; I688-I701 HydrophobicContact CD1-CG2 4Å; I688-I701 HydrophobicContact CG1-CG2 3.86Å; I688-I701 HydrophobicContact CG2-CB 4.05Å; I688-I701 HydrophobicContact CG2-CG2 4.09Å; I688-I701 WeakPolarHBondContact CG2-O 3.26Å; I688-I703 HydrophobicContact CD1-CG1 4.11Å; I688-I703 HydrophobicContact CG2-CG1 3.98Å; I688-N725 HydrophobicContact CD1-CB 3.79Å; I688-C729 WeakPolarHBondContact CG1-SG 3.49Å
689	Q	78.8	Confident	74.2	Confident	86 Å²	86	38.1 Å²	38.1	40%	0.402	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-46.2	177.5	-72	174	-18.6	0	0	111.2	L666 V685 I686 L691 N692 K693	L666-Q689 HydrophobicContact CD1-CB 3.93Å; L666-Q689 HydrophobicContact CD2-CB 4.02Å; V685-Q689 WeakPolarHBondContact O-CG 3.38Å; V685-Q689 PolarHBondContact O-N 3.45Å; I686-Q689 PolarHBondContact O-N 2.98Å; Q689-L691 VanDerWaalsContact C-N 3.34Å; Q689-L691 PolarHBondContact O-N 3.34Å; Q689-N692 PolarHBondContact O-N 3.13Å; Q689-K693 WeakPolarHBondContact O-CB 3.4Å; Q689-K693 PolarHBondContact O-N 3.14Å
690	L	86.5	Confident	73.7	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-56.1	-51.9	176.6	180	74.9	0	0	0	109.9	I662 E665 L666 I686 L687 K693 F694 I765	I662-L690 HydrophobicContact CG1-CD1 4.3Å; I662-L690 HydrophobicContact CG1-CD2 3.92Å; E665-L690 HydrophobicContact CB-CD1 3.69Å; E665-L690 HydrophobicContact CG-CD1 4.2Å; L666-L690 HydrophobicContact CD1-CB 4.07Å; L666-L690 HydrophobicContact CG-CB 4.37Å; L666-L690 HydrophobicContact CG-CD1 4.28Å; I686-L690 WeakPolarHBondContact O-CB 3.49Å; I686-L690 PolarHBondContact O-N 3.36Å; L687-L690 PolarHBondContact O-N 2.89Å; L690-K693 PolarHBondContact O-N 2.85Å; L690-F694 WeakPolarHBondContact O-CB 3.46Å; L690-F694 PolarHBondContact O-N 3.4Å; L690-I765 HydrophobicContact CD2-CD1 4.12Å; L690-I765 HydrophobicContact CD2-CG2 4.23Å
691	L	86.6	Confident	73.8	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-49.8	-179.3	-68.9	171.1	0	0	0	110.8	L687 I688 Q689 K693 F694 I695 S699 I701 C729 I733 L768	L687-L691 WeakPolarHBondContact O-CB 3.43Å; L687-L691 WeakPolarHBondContact O-CG 3.27Å; L687-L691 PolarHBondContact O-N 3.44Å; I688-L691 PolarHBondContact O-N 2.93Å; Q689-L691 VanDerWaalsContact C-N 3.34Å; Q689-L691 PolarHBondContact O-N 3.34Å; L691-K693 PolarHBondContact O-N 3.25Å; L691-F694 PolarHBondContact O-N 3.23Å; L691-I695 HydrophobicContact CB-CD1 4.17Å; L691-I695 HydrophobicContact CD2-CD1 3.69Å; L691-I695 HydrophobicContact CG-CD1 4.5Å; L691-I695 WeakPolarHBondContact O-CB 3.36Å; L691-I695 PolarHBondContact O-N 3.2Å; L691-S699 PolarHBondContact O-OG 3.44Å; L691-I701 HydrophobicContact CB-CD1 3.96Å; L691-I701 HydrophobicContact CD1-CD1 3.91Å; L691-C729 HydrophobicContact CD1-CB 3.67Å; L691-I733 HydrophobicContact CD1-CD1 4.47Å; L691-I733 HydrophobicContact CD1-CG1 4.11Å; L691-I733 HydrophobicContact CD2-CD1 4.36Å; L691-I733 HydrophobicContact CD2-CG1 3.77Å; L691-L768 HydrophobicContact CD2-CD2 3.53Å
692	N	79.7	Confident	73.3	Confident	53 Å²	53	44.7 Å²	44.7	28%	0.283	24%	0.244	S	C	.	.	H	α-helix	trans	-56.4	-36.6	178.8	-69.6	-4.2	0	0	0	112.4	I688 Q689 G696 S699 I701	I688-N692 WeakPolarHBondContact O-CB 3.49Å; I688-N692 PolarHBondContact O-N 3.19Å; I688-N692 PolarHBondContact O-OD1 2.85Å; Q689-N692 PolarHBondContact O-N 3.13Å; N692-G696 PolarHBondContact O-N 3.28Å; N692-S699 VanDerWaalsContact CA-OG 3.3Å; N692-S699 WeakPolarHBondContact CA-OG 3.4Å; N692-S699 VanDerWaalsContact CG-O 3.26Å; N692-S699 PolarHBondContact OD1-O 3.4Å; N692-I701 PolarHBondContact ND2-O 3.35Å; N692-I701 VanDerWaalsContact ND2-O 3.15Å; N692-I701 WeakPolarHBondContact OD1-CB 3.45Å; N692-I701 PolarHBondContact OD1-N 3.13Å
693	K	76.3	Confident	72.7	Confident	123 Å²	123	47.2 Å²	47.2	54%	0.535	26%	0.255	S	S	.	.	H	α-helix	trans	-76.8	-47	175.6	-172.8	171.8	-179.3	171.1	0	112.8	E665 L666 Q689 L690 L691	E665-K693 WeakPolarHBondContact O-CD 3.49Å; E665-K693 WeakPolarHBondContact O-CE 3.44Å; E665-K693 PolarHBondContact O-NZ 2.99Å; L666-K693 HydrophobicContact CD2-CB 4.25Å; L666-K693 HydrophobicContact CD2-CD 4.06Å; Q689-K693 WeakPolarHBondContact O-CB 3.4Å; Q689-K693 PolarHBondContact O-N 3.14Å; L690-K693 PolarHBondContact O-N 2.85Å; L691-K693 PolarHBondContact O-N 3.25Å
694	F	73.8	Confident	72.3	Confident	19 Å²	19	46.4 Å²	46.4	8%	0.083	25%	0.25	C	S	.	.	H	α-helix	trans	-72.1	-40.3	-172.6	-170.6	-110.9	0	0	0	112.8	E665 L690 L691 L768 Y769 H772	E665-F694 HydrophobicContact CG-CD2 4.43Å; L690-F694 WeakPolarHBondContact O-CB 3.46Å; L690-F694 PolarHBondContact O-N 3.4Å; L691-F694 PolarHBondContact O-N 3.23Å; F694-L768 HydrophobicContact CD1-CD2 4.16Å; F694-L768 HydrophobicContact CD1-CG 4.34Å; F694-L768 HydrophobicContact CE1-CD2 4.37Å; F694-L768 HydrophobicContact CE1-CG 4.09Å; F694-Y769 HydrophobicContact CD2-CD2 4.19Å; F694-Y769 HydrophobicContact CD2-CE2 4.15Å; F694-Y769 HydrophobicContact CE1-CD2 4.24Å; F694-Y769 AromaticContact CE2-CD2 3.27Å; F694-Y769 HydrophobicContact CE2-CD2 3.27Å; F694-Y769 AromaticContact CE2-CE2 3.3Å; F694-Y769 HydrophobicContact CE2-CE2 3.3Å; F694-Y769 HydrophobicContact CE2-CG 4.35Å; F694-Y769 AromaticContact CZ-CD2 3.29Å; F694-Y769 HydrophobicContact CZ-CD2 3.29Å; F694-Y769 AromaticContact CZ-CE2 3.82Å; F694-Y769 HydrophobicContact CZ-CE2 3.82Å; F694-Y769 HydrophobicContact CZ-CG 4.02Å; F694-H772 HydrophobicContact CE1-CB 3.48Å; F694-H772 VanDerWaalsContact CE1-CB 3.48Å; F694-H772 AromaticContact CE1-CG 3.69Å; F694-H772 HydrophobicContact CE2-CB 4.43Å; F694-H772 AromaticContact CE2-ND1 3.87Å; F694-H772 HydrophobicContact CZ-CB 3.36Å; F694-H772 AromaticContact CZ-CD2 3.99Å; F694-H772 AromaticContact CZ-CG 3.37Å; F694-H772 AromaticContact CZ-ND1 3.6Å
695	I	71.2	Confident	71.7	Confident	19 Å²	19	52.2 Å²	52.2	10%	0.097	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-20.5	180	-75.7	166.9	0	0	0	111.4	L691 T698 S699 T732 Y736	L691-I695 HydrophobicContact CB-CD1 4.17Å; L691-I695 HydrophobicContact CD2-CD1 3.69Å; L691-I695 HydrophobicContact CG-CD1 4.5Å; L691-I695 WeakPolarHBondContact O-CB 3.36Å; L691-I695 PolarHBondContact O-N 3.2Å; I695-T698 WeakPolarHBondContact CG2-OG1 3.49Å; I695-T698 PolarHBondContact O-OG1 2.98Å; I695-S699 WeakPolarHBondContact CB-OG 3.16Å; I695-S699 VanDerWaalsContact CG2-OG 3.23Å; I695-S699 WeakPolarHBondContact CG2-OG 3.46Å; I695-T732 HydrophobicContact CD1-CG2 3.51Å; I695-Y736 HydrophobicContact CB-CE1 4.3Å; I695-Y736 HydrophobicContact CB-CE2 4.13Å; I695-Y736 HydrophobicContact CD1-CD1 4.34Å; I695-Y736 HydrophobicContact CD1-CD2 3.48Å; I695-Y736 VanDerWaalsContact CD1-CD2 3.48Å; I695-Y736 HydrophobicContact CD1-CE1 4.48Å; I695-Y736 HydrophobicContact CD1-CE2 3.67Å; I695-Y736 HydrophobicContact CD1-CG 3.89Å; I695-Y736 HydrophobicContact CG1-CD1 4Å; I695-Y736 HydrophobicContact CG1-CD2 3.94Å; I695-Y736 HydrophobicContact CG1-CE1 3.86Å; I695-Y736 HydrophobicContact CG1-CE2 3.82Å; I695-Y736 HydrophobicContact CG1-CG 4.07Å; I695-Y736 HydrophobicContact CG2-CD2 4.23Å; I695-Y736 HydrophobicContact CG2-CE1 3.89Å; I695-Y736 HydrophobicContact CG2-CE2 3.27Å; I695-Y736 WeakPolarHBondContact CG2-OH 3.49Å
696	G	57.9	Low	70.9	Confident	30 Å²	30	52.7 Å²	52.7	31%	0.309	29%	0.285	S	S	.	.			trans	77.2	-158.7	-176.5	0	0	0	0	0	113.3	N692 T698 S699	N692-G696 PolarHBondContact O-N 3.28Å; G696-T698 PolarHBondContact O-N 3.41Å; G696-S699 PolarHBondContact O-N 3.39Å; G696-S699 VanDerWaalsContact O-N 3.12Å; G696-S699 PolarHBondContact O-OG 3.45Å
697	T	45.7	Very low	70.1	Confident	128 Å²	128	60.1 Å²	60.1	79%	0.785	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.6	-169.4	54.9	0	0	0	0	115.1
698	T	46.6	Very low	68.4	Low	93 Å²	93	67.1 Å²	67.1	57%	0.571	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-24.6	177.8	54.3	0	0	0	0	112.8	I695 G696 Y736	I695-T698 WeakPolarHBondContact CG2-OG1 3.49Å; I695-T698 PolarHBondContact O-OG1 2.98Å; G696-T698 PolarHBondContact O-N 3.41Å; T698-Y736 PolarHBondContact OG1-OH 2.88Å
699	S	52.4	Low	66.8	Low	8 Å²	8	71.1 Å²	71.1	6%	0.056	37%	0.371	C	S	.	.			trans	-101.8	86.3	176.5	61.5	0	0	0	0	110.7	L691 N692 I695 G696 I701	L691-S699 PolarHBondContact O-OG 3.44Å; N692-S699 VanDerWaalsContact CA-OG 3.3Å; N692-S699 WeakPolarHBondContact CA-OG 3.4Å; N692-S699 VanDerWaalsContact CG-O 3.26Å; N692-S699 PolarHBondContact OD1-O 3.4Å; I695-S699 WeakPolarHBondContact CB-OG 3.16Å; I695-S699 VanDerWaalsContact CG2-OG 3.23Å; I695-S699 WeakPolarHBondContact CG2-OG 3.46Å; G696-S699 PolarHBondContact O-N 3.39Å; G696-S699 VanDerWaalsContact O-N 3.12Å; G696-S699 PolarHBondContact O-OG 3.45Å; S699-I701 PolarHBondContact O-N 3.43Å; S699-I701 VanDerWaalsContact O-N 3.15Å
700	N	62.8	Low	65.3	Low	137 Å²	137	76.8 Å²	76.8	73%	0.733	40%	0.397	S	S	*	.			trans	-85.1	54.3	165.2	-76.2	-29.6	0	0	0	109.8	K702	N700-K702 PolarHBondContact O-N 3.14Å
701	I	74.5	Confident	63.5	Low	17 Å²	17	86.8 Å²	86.8	9%	0.087	44%	0.435	C	S	.	.			trans	-68.9	109.2	177.9	-52.6	170.7	0	0	0	107.5	I688 L691 N692 S699 R728 T732	I688-I701 HydrophobicContact CD1-CG2 4Å; I688-I701 HydrophobicContact CG1-CG2 3.86Å; I688-I701 HydrophobicContact CG2-CB 4.05Å; I688-I701 HydrophobicContact CG2-CG2 4.09Å; I688-I701 WeakPolarHBondContact CG2-O 3.26Å; L691-I701 HydrophobicContact CB-CD1 3.96Å; L691-I701 HydrophobicContact CD1-CD1 3.91Å; N692-I701 PolarHBondContact ND2-O 3.35Å; N692-I701 VanDerWaalsContact ND2-O 3.15Å; N692-I701 WeakPolarHBondContact OD1-CB 3.45Å; N692-I701 PolarHBondContact OD1-N 3.13Å; S699-I701 PolarHBondContact O-N 3.43Å; S699-I701 VanDerWaalsContact O-N 3.15Å; I701-R728 HydrophobicContact CG2-CB 3.72Å; I701-R728 HydrophobicContact CG2-CG 4.45Å; I701-T732 HydrophobicContact CD1-CG2 3.91Å; I701-T732 WeakPolarHBondContact CD1-OG1 3.38Å; I701-T732 WeakPolarHBondContact CG1-OG1 3.35Å
702	K	75.3	Confident	61.8	Low	108 Å²	108	94.9 Å²	94.9	47%	0.47	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-74.6	136.8	174	-63.4	-175.4	-179.5	-171.2	0	110.2	Y513 N700 C704 R728	Y513-K702 VanDerWaalsContact CZ-NZ 3.33Å; Y513-K702 WeakPolarHBondContact OH-CD 3.39Å; Y513-K702 WeakPolarHBondContact OH-CE 3.46Å; Y513-K702 PolarHBondContact OH-NZ 3.43Å; Y513-K702 VanDerWaalsContact OH-NZ 3.15Å; N700-K702 PolarHBondContact O-N 3.14Å; K702-C704 PolarHBondContact O-N 3.5Å; K702-R728 PolarHBondContact O-NH1 3.15Å
703	I	73.5	Confident	60.7	Low	71 Å²	71	97 Å²	97	36%	0.364	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-68.1	128.6	169.2	-60.7	169.4	0	0	0	108.2	V685 I688 L705	V685-I703 HydrophobicContact CG1-CD1 4Å; V685-I703 HydrophobicContact CG2-CG2 4.26Å; I688-I703 HydrophobicContact CD1-CG1 4.11Å; I688-I703 HydrophobicContact CG2-CG1 3.98Å; I703-L705 HydrophobicContact CG2-CD2 4.11Å
704	C	70.9	Confident	59.9	Low	14 Å²	14	96.5 Å²	96.5	10%	0.095	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-80.7	124.2	165.9	-66.7	0	0	0	0	108.4	K702 S721 R724 N725 R728	K702-C704 PolarHBondContact O-N 3.5Å; C704-S721 PolarHBondContact O-OG 2.98Å; C704-R724 HydrophobicContact CB-CB 4.04Å; C704-N725 WeakPolarHBondContact CA-OD1 3.37Å; C704-N725 VanDerWaalsContact CB-OD1 3.25Å; C704-N725 WeakPolarHBondContact CB-OD1 3.4Å; C704-N725 PolarHBondContact N-OD1 2.83Å; C704-N725 PolarHBondContact O-ND2 3.08Å; C704-R728 PolarHBondContact SG-NH1 2.89Å; C704-R728 VanDerWaalsContact SG-NH1 3.41Å
705	L	68.3	Low	59.3	Low	122 Å²	122	98.9 Å²	98.9	64%	0.639	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-97.5	150.9	170.6	-62.4	175.5	0	0	0	110.3	I703 S721	I703-L705 HydrophobicContact CG2-CD2 4.11Å; L705-S721 PolarHBondContact N-OG 3.44Å; L705-S721 PolarHBondContact O-OG 2.86Å
706	P	58.9	Low	59	Low	52 Å²	52	101.5 Å²	101.5	34%	0.338	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-60.9	144.2	171.5	20.8	-26	0	0	0	110.5	E717 V718	P706-E717 HydrophobicContact CB-CB 4.48Å; P706-V718 HydrophobicContact CB-CG2 3.92Å; P706-V718 HydrophobicContact CG-CG2 4.04Å
707	R	61.5	Low	59.6	Low	175 Å²	175	101.1 Å²	101.1	66%	0.66	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-81.2	133	174.7	-69.1	-178.9	177.7	179.8	-1.6	108.7	D709	R707-D709 PolarHBondContact O-N 3.05Å
708	N	52.4	Low	60.7	Low	149 Å²	149	96.2 Å²	96.2	80%	0.797	48%	0.477	S	S	*	.			trans	-71.7	79.2	171.5	-86.8	-8.2	0	0	0	109.8
709	D	50.1	Low	61.9	Low	85 Å²	85	92.6 Å²	92.6	46%	0.455	46%	0.455	S	S	.	.			trans	-87.2	120.2	168.5	-72.5	-15.9	0	0	0	108.2	R707 R711	R707-D709 PolarHBondContact O-N 3.05Å; D709-R711 PolarHBondContact O-N 3.01Å
710	Q	47.6	Very low	63	Low	205 Å²	205	97 Å²	97	96%	0.958	47%	0.473	S	S	*	.	S	Bend	trans	-62.2	-7	178.2	-71.3	-176.1	-15.3	0	0	114.1
711	R	46.9	Very low	63.5	Low	214 Å²	214	90.5 Å²	90.5	81%	0.808	44%	0.439	S	S	*	.	S	Bend	trans	-87.4	144.3	176.7	-66.6	-178.6	-175.3	177.2	1.5	108.9	D709 N713	D709-R711 PolarHBondContact O-N 3.01Å; R711-N713 PolarHBondContact O-N 3.47Å
712	N	51	Low	64	Low	171 Å²	171	92 Å²	92	91%	0.914	44%	0.444	S	S	*	.	S	Bend	trans	-46.3	10.6	-177.7	-64.2	-20.3	0	0	0	118.7
713	N	57.6	Low	64.5	Low	96 Å²	96	89.5 Å²	89.5	51%	0.513	43%	0.431	S	S	.	.			trans	-98.9	14.9	-178.8	-79	-18.2	0	0	0	114.6	R711 L715 N716 E717	R711-N713 PolarHBondContact O-N 3.47Å; N713-L715 PolarHBondContact O-N 3.42Å; N713-L715 VanDerWaalsContact O-N 3.12Å; N713-N716 PolarHBondContact O-N 3.11Å; N713-E717 PolarHBondContact O-N 3.5Å
714	M	59.7	Low	64.9	Low	114 Å²	114	89.7 Å²	89.7	56%	0.562	43%	0.427	S	S	*	.	H	α-helix	trans	-51.1	-41.5	-177.8	-165.3	-147.8	-90.4	0	0	112	N716 E717 V718	M714-N716 PolarHBondContact O-N 3.32Å; M714-E717 PolarHBondContact O-N 3.09Å; M714-E717 VanDerWaalsContact O-N 3.08Å; M714-V718 WeakPolarHBondContact O-CG2 3.05Å; M714-V718 PolarHBondContact O-N 3.48Å
715	L	59.8	Low	65.6	Low	68 Å²	68	89.1 Å²	89.1	36%	0.356	42%	0.423	S	S	.	.	H	α-helix	trans	-55.6	-47.4	176.8	173.6	56.6	0	0	0	113.4	N713 E717 V718 V719 L846	N713-L715 PolarHBondContact O-N 3.42Å; N713-L715 VanDerWaalsContact O-N 3.12Å; L715-E717 PolarHBondContact O-N 2.85Å; L715-V718 PolarHBondContact O-N 2.89Å; L715-V719 HydrophobicContact CD1-CG2 4.25Å; L715-V719 WeakPolarHBondContact O-CG2 3.26Å; L715-V719 PolarHBondContact O-N 2.75Å; L715-V719 VanDerWaalsContact O-N 3.1Å; L715-L846 HydrophobicContact CD1-CD1 3.21Å; L715-L846 HydrophobicContact CD1-CD2 3.13Å; L715-L846 HydrophobicContact CD1-CG 3.7Å; L715-L846 HydrophobicContact CD2-CD1 3.5Å; L715-L846 HydrophobicContact CG-CD1 3.96Å
716	N	66.1	Low	66.7	Low	74 Å²	74	83.3 Å²	83.3	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-34.2	179.4	-78.4	-34.6	0	0	0	111.3	N713 M714 K720	N713-N716 PolarHBondContact O-N 3.11Å; M714-N716 PolarHBondContact O-N 3.32Å; N716-K720 WeakPolarHBondContact O-CB 3.35Å; N716-K720 WeakPolarHBondContact O-CG 3.41Å; N716-K720 PolarHBondContact O-N 3.22Å
717	E	70	Confident	68.3	Low	22 Å²	22	87 Å²	87	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-70.3	-36.8	175.8	-71.1	-52.1	125.5	0	0	112.9	P706 N713 M714 L715 K720 S721 R724	P706-E717 HydrophobicContact CB-CB 4.48Å; N713-E717 PolarHBondContact O-N 3.5Å; M714-E717 PolarHBondContact O-N 3.09Å; M714-E717 VanDerWaalsContact O-N 3.08Å; L715-E717 PolarHBondContact O-N 2.85Å; E717-K720 PolarHBondContact O-N 3.32Å; E717-K720 VanDerWaalsContact OE1-CD 3.31Å; E717-K720 WeakPolarHBondContact OE1-CD 3.45Å; E717-K720 WeakPolarHBondContact OE1-CE 3.48Å; E717-K720 IonicContact OE1-NZ 3.7Å; E717-K720 PolarHBondContact OE1-NZ 2.92Å; E717-S721 WeakPolarHBondContact O-CB 3.16Å; E717-S721 PolarHBondContact O-N 3.1Å; E717-R724 IonicContact OE2-NH2 2.72Å
718	V	68.6	Low	69.6	Low	25 Å²	25	83.9 Å²	83.9	15%	0.152	39%	0.388	C	S	.	.	H	α-helix	trans	-59.6	-53.9	172.8	175.3	0	0	0	0	110.6	P706 M714 L715 K720 S721 Y722	P706-V718 HydrophobicContact CB-CG2 3.92Å; P706-V718 HydrophobicContact CG-CG2 4.04Å; M714-V718 WeakPolarHBondContact O-CG2 3.05Å; M714-V718 PolarHBondContact O-N 3.48Å; L715-V718 PolarHBondContact O-N 2.89Å; V718-K720 VanDerWaalsContact C-N 3.31Å; V718-K720 PolarHBondContact O-N 3.12Å; V718-S721 WeakPolarHBondContact O-CA 3.3Å; V718-S721 WeakPolarHBondContact O-CB 3.3Å; V718-S721 PolarHBondContact O-N 2.75Å; V718-Y722 HydrophobicContact CG1-CD1 4.49Å; V718-Y722 HydrophobicContact CG1-CE1 3.83Å; V718-Y722 HydrophobicContact CG1-CE2 3.89Å; V718-Y722 VanDerWaalsContact CG1-CZ 3.5Å; V718-Y722 PolarHBondContact O-N 3.09Å
719	V	71.4	Confident	71.5	Confident	17 Å²	17	76.8 Å²	76.8	10%	0.103	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-38.2	-179.7	-177.4	0	0	0	0	111.3	L715 S721 Y722 R723 I750	L715-V719 HydrophobicContact CD1-CG2 4.25Å; L715-V719 WeakPolarHBondContact O-CG2 3.26Å; L715-V719 PolarHBondContact O-N 2.75Å; L715-V719 VanDerWaalsContact O-N 3.1Å; V719-S721 VanDerWaalsContact C-N 3.25Å; V719-S721 PolarHBondContact O-N 3.46Å; V719-Y722 PolarHBondContact O-N 3.02Å; V719-R723 PolarHBondContact O-N 3.29Å; V719-I750 HydrophobicContact CG1-CG2 4.15Å
720	K	76.2	Confident	73.5	Confident	100 Å²	100	75.8 Å²	75.8	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-35.4	172.1	-78	172.7	-170.3	173.9	0	111.9	N716 E717 V718 R724	N716-K720 WeakPolarHBondContact O-CB 3.35Å; N716-K720 WeakPolarHBondContact O-CG 3.41Å; N716-K720 PolarHBondContact O-N 3.22Å; E717-K720 PolarHBondContact O-N 3.32Å; E717-K720 VanDerWaalsContact OE1-CD 3.31Å; E717-K720 WeakPolarHBondContact OE1-CD 3.45Å; E717-K720 WeakPolarHBondContact OE1-CE 3.48Å; E717-K720 IonicContact OE1-NZ 3.7Å; E717-K720 PolarHBondContact OE1-NZ 2.92Å; V718-K720 VanDerWaalsContact C-N 3.31Å; V718-K720 PolarHBondContact O-N 3.12Å; K720-R724 WeakPolarHBondContact O-CG 3.34Å; K720-R724 PolarHBondContact O-N 3.18Å; K720-R724 PolarHBondContact O-NE 3.35Å
721	S	73	Confident	75.5	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-45	177.2	-147.1	0	0	0	0	111.7	C704 L705 E717 V718 V719 R723 R724 N725	C704-S721 PolarHBondContact O-OG 2.98Å; L705-S721 PolarHBondContact N-OG 3.44Å; L705-S721 PolarHBondContact O-OG 2.86Å; E717-S721 WeakPolarHBondContact O-CB 3.16Å; E717-S721 PolarHBondContact O-N 3.1Å; V718-S721 WeakPolarHBondContact O-CA 3.3Å; V718-S721 WeakPolarHBondContact O-CB 3.3Å; V718-S721 PolarHBondContact O-N 2.75Å; V719-S721 VanDerWaalsContact C-N 3.25Å; V719-S721 PolarHBondContact O-N 3.46Å; S721-R723 PolarHBondContact O-N 2.71Å; S721-R724 WeakPolarHBondContact O-CB 3.32Å; S721-R724 PolarHBondContact O-N 2.95Å; S721-N725 PolarHBondContact O-N 3.04Å
722	Y	84.6	Confident	77.4	Confident	50 Å²	50	59.7 Å²	59.7	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-45.2	176.6	-63.2	-4.2	0	0	0	111.2	T683 V718 V719 R724 N725 L726	T683-Y722 HydrophobicContact CG2-CE1 4.17Å; T683-Y722 HydrophobicContact CG2-CE2 4.06Å; V718-Y722 HydrophobicContact CG1-CD1 4.49Å; V718-Y722 HydrophobicContact CG1-CE1 3.83Å; V718-Y722 HydrophobicContact CG1-CE2 3.89Å; V718-Y722 VanDerWaalsContact CG1-CZ 3.5Å; V718-Y722 PolarHBondContact O-N 3.09Å; V719-Y722 PolarHBondContact O-N 3.02Å; Y722-R724 VanDerWaalsContact C-N 3.28Å; Y722-R724 PolarHBondContact O-N 2.82Å; Y722-N725 PolarHBondContact O-N 2.81Å; Y722-L726 PolarHBondContact O-N 2.96Å
723	R	85.6	Confident	79.2	Confident	54 Å²	54	51.6 Å²	51.6	20%	0.204	24%	0.243	C	C	.	.	H	α-helix	trans	-55.8	-41.2	171.9	-76.1	-172.8	-178.7	113.3	-0.5	112.5	V719 S721 R727 E747 I750	V719-R723 PolarHBondContact O-N 3.29Å; S721-R723 PolarHBondContact O-N 2.71Å; R723-R727 WeakPolarHBondContact O-CB 3.4Å; R723-R727 WeakPolarHBondContact O-CG 3.49Å; R723-R727 PolarHBondContact O-N 2.95Å; R723-R727 VanDerWaalsContact O-N 3.13Å; R723-E747 IonicContact CZ-OE1 3.66Å; R723-E747 IonicContact CZ-OE2 3.48Å; R723-E747 IonicContact NE-OE1 3.71Å; R723-E747 IonicContact NE-OE2 3.76Å; R723-E747 PolarHBondContact NE-OE2 3.41Å; R723-E747 IonicContact NH2-OE1 2.77Å; R723-E747 PolarHBondContact NH2-OE1 2.98Å; R723-E747 IonicContact NH2-OE2 2.89Å; R723-E747 PolarHBondContact NH2-OE2 3.32Å; R723-I750 HydrophobicContact CB-CD1 3.94Å; R723-I750 HydrophobicContact CG-CD1 3.19Å
724	R	83.8	Confident	80.7	Confident	76 Å²	76	51.2 Å²	51.2	29%	0.287	24%	0.235	S	C	.	.	H	α-helix	trans	-67.3	-42.5	178.1	-78.5	179.9	-94.7	138.2	-10.4	111.6	C704 E717 K720 S721 Y722 R728	C704-R724 HydrophobicContact CB-CB 4.04Å; E717-R724 IonicContact OE2-NH2 2.72Å; K720-R724 WeakPolarHBondContact O-CG 3.34Å; K720-R724 PolarHBondContact O-N 3.18Å; K720-R724 PolarHBondContact O-NE 3.35Å; S721-R724 WeakPolarHBondContact O-CB 3.32Å; S721-R724 PolarHBondContact O-N 2.95Å; Y722-R724 VanDerWaalsContact C-N 3.28Å; Y722-R724 PolarHBondContact O-N 2.82Å; R724-R728 WeakPolarHBondContact O-CG 3.26Å; R724-R728 PolarHBondContact O-N 3.24Å; R724-R728 VanDerWaalsContact O-N 3.14Å
725	N	84.8	Confident	81.9	Confident	2 Å²	2	56 Å²	56	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-52.7	177.1	-70.5	-19	0	0	0	111.7	T683 I688 C704 S721 Y722 R727 R728 C729	T683-N725 WeakPolarHBondContact O-CB 2.97Å; T683-N725 PolarHBondContact O-ND2 3.22Å; T683-N725 VanDerWaalsContact O-ND2 3.13Å; I688-N725 HydrophobicContact CD1-CB 3.79Å; C704-N725 WeakPolarHBondContact CA-OD1 3.37Å; C704-N725 VanDerWaalsContact CB-OD1 3.25Å; C704-N725 WeakPolarHBondContact CB-OD1 3.4Å; C704-N725 PolarHBondContact N-OD1 2.83Å; C704-N725 PolarHBondContact O-ND2 3.08Å; S721-N725 PolarHBondContact O-N 3.04Å; Y722-N725 PolarHBondContact O-N 2.81Å; N725-R727 VanDerWaalsContact C-N 3.33Å; N725-R727 PolarHBondContact O-N 2.96Å; N725-R728 WeakPolarHBondContact O-CB 3.14Å; N725-R728 PolarHBondContact O-N 3.24Å; N725-C729 PolarHBondContact O-N 3.1Å; N725-C729 PolarHBondContact O-SG 2.72Å
726	L	90.9	Very high	82.9	Confident	0 Å²	0	57 Å²	57	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-35.7	-179	-70.8	176.3	0	0	0	113.1	S682 L687 Y722 R728 C729 R730 F744 T746 I749 I750	S682-L726 WeakPolarHBondContact O-CD1 3.31Å; L687-L726 HydrophobicContact CD1-CD2 3.62Å; Y722-L726 PolarHBondContact O-N 2.96Å; L726-R728 VanDerWaalsContact C-N 3.31Å; L726-R728 PolarHBondContact O-N 3.4Å; L726-C729 PolarHBondContact O-N 3.12Å; L726-R730 WeakPolarHBondContact O-CB 3.28Å; L726-R730 PolarHBondContact O-N 2.96Å; L726-F744 HydrophobicContact CB-CE2 4.35Å; L726-F744 HydrophobicContact CD2-CE2 4.31Å; L726-T746 HydrophobicContact CB-CG2 3.86Å; L726-I749 HydrophobicContact CD1-CB 4.04Å; L726-I749 HydrophobicContact CD1-CG2 3.64Å; L726-I749 HydrophobicContact CD2-CG2 4.35Å; L726-I750 HydrophobicContact CD1-CD1 3.84Å; L726-I750 HydrophobicContact CD1-CG1 3.47Å; L726-I750 VanDerWaalsContact CD1-CG1 3.47Å
727	R	92.6	Very high	83.7	Confident	129 Å²	129	55.4 Å²	55.4	49%	0.487	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-37.3	172.6	-75.6	180	-161.7	122.7	-2	112.3	R723 N725 A731 T746	R723-R727 WeakPolarHBondContact O-CB 3.4Å; R723-R727 WeakPolarHBondContact O-CG 3.49Å; R723-R727 PolarHBondContact O-N 2.95Å; R723-R727 VanDerWaalsContact O-N 3.13Å; N725-R727 VanDerWaalsContact C-N 3.33Å; N725-R727 PolarHBondContact O-N 2.96Å; R727-A731 WeakPolarHBondContact O-CB 3.41Å; R727-A731 PolarHBondContact O-N 3.05Å; R727-T746 HydrophobicContact CG-CG2 4.02Å
728	R	89.7	Confident	84.4	Confident	109 Å²	109	54.4 Å²	54.4	41%	0.411	24%	0.243	S	C	.	.	H	α-helix	trans	-66.4	-46.1	174.9	-73.4	179.3	172.3	-175.6	-1	111.1	I701 K702 C704 R724 N725 L726 R730 A731 T732	I701-R728 HydrophobicContact CG2-CB 3.72Å; I701-R728 HydrophobicContact CG2-CG 4.45Å; K702-R728 PolarHBondContact O-NH1 3.15Å; C704-R728 PolarHBondContact SG-NH1 2.89Å; C704-R728 VanDerWaalsContact SG-NH1 3.41Å; R724-R728 WeakPolarHBondContact O-CG 3.26Å; R724-R728 PolarHBondContact O-N 3.24Å; R724-R728 VanDerWaalsContact O-N 3.14Å; N725-R728 WeakPolarHBondContact O-CB 3.14Å; N725-R728 PolarHBondContact O-N 3.24Å; L726-R728 VanDerWaalsContact C-N 3.31Å; L726-R728 PolarHBondContact O-N 3.4Å; R728-R730 PolarHBondContact O-N 3.01Å; R728-A731 PolarHBondContact O-N 3.27Å; R728-T732 PolarHBondContact O-N 3.45Å; R728-T732 PolarHBondContact O-OG1 3.33Å; R728-T732 VanDerWaalsContact O-OG1 3.09Å
729	C	90.7	Very high	85.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.7	-53.2	173.6	-62.2	0	0	0	0	111	L687 I688 L691 N725 L726 A731 T732 I733 F744	L687-C729 HydrophobicContact CB-CB 4.41Å; I688-C729 WeakPolarHBondContact CG1-SG 3.49Å; L691-C729 HydrophobicContact CD1-CB 3.67Å; N725-C729 PolarHBondContact O-N 3.1Å; N725-C729 PolarHBondContact O-SG 2.72Å; L726-C729 PolarHBondContact O-N 3.12Å; C729-A731 VanDerWaalsContact C-N 3.32Å; C729-A731 PolarHBondContact O-N 3.32Å; C729-T732 PolarHBondContact O-N 3.27Å; C729-T732 VanDerWaalsContact O-N 3.15Å; C729-I733 VanDerWaalsContact O-CG1 3.29Å; C729-I733 WeakPolarHBondContact O-CG1 3.47Å; C729-I733 PolarHBondContact O-N 3.47Å; C729-F744 HydrophobicContact CB-CZ 4.19Å
730	R	93.2	Very high	85.9	Confident	64 Å²	64	61.5 Å²	61.5	24%	0.242	27%	0.274	C	S	.	.	H	α-helix	trans	-56.3	-43.7	179	-175.7	-179.3	163.6	98.2	8.3	112.4	L726 R728 Y734 L743 F744 T746	L726-R730 WeakPolarHBondContact O-CB 3.28Å; L726-R730 PolarHBondContact O-N 2.96Å; R728-R730 PolarHBondContact O-N 3.01Å; R730-Y734 WeakPolarHBondContact O-CB 3.23Å; R730-Y734 PolarHBondContact O-N 3.07Å; R730-L743 HydrophobicContact CG-CB 4.2Å; R730-L743 HydrophobicContact CG-CD1 4.14Å; R730-L743 HydrophobicContact CG-CD2 4.44Å; R730-L743 PolarHBondContact NH1-O 3.27Å; R730-F744 HydrophobicContact CB-CE1 4.04Å; R730-F744 HydrophobicContact CB-CE2 4.34Å; R730-F744 HydrophobicContact CB-CZ 3.79Å; R730-F744 VanDerWaalsContact NH1-C 3.25Å; R730-F744 PolarHBondContact NH1-O 2.85Å; R730-T746 HydrophobicContact CB-CG2 4.5Å
731	A	88.7	Confident	86.4	Confident	59 Å²	59	60.6 Å²	60.6	49%	0.488	27%	0.272	S	S	.	.	H	α-helix	trans	-65.9	-39.3	178.7	0	0	0	0	0	112.5	R727 R728 C729 Y734 R735	R727-A731 WeakPolarHBondContact O-CB 3.41Å; R727-A731 PolarHBondContact O-N 3.05Å; R728-A731 PolarHBondContact O-N 3.27Å; C729-A731 VanDerWaalsContact C-N 3.32Å; C729-A731 PolarHBondContact O-N 3.32Å; A731-Y734 PolarHBondContact O-N 2.97Å; A731-R735 PolarHBondContact O-N 3.29Å
732	T	87.8	Confident	87.1	Confident	23 Å²	23	61.6 Å²	61.6	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-46.1	176	-57	0	0	0	0	111.3	I695 I701 R728 C729 Y734 R735 Y736	I695-T732 HydrophobicContact CD1-CG2 3.51Å; I701-T732 HydrophobicContact CD1-CG2 3.91Å; I701-T732 WeakPolarHBondContact CD1-OG1 3.38Å; I701-T732 WeakPolarHBondContact CG1-OG1 3.35Å; R728-T732 PolarHBondContact O-N 3.45Å; R728-T732 PolarHBondContact O-OG1 3.33Å; R728-T732 VanDerWaalsContact O-OG1 3.09Å; C729-T732 PolarHBondContact O-N 3.27Å; C729-T732 VanDerWaalsContact O-N 3.15Å; T732-Y734 VanDerWaalsContact C-N 3.27Å; T732-Y734 PolarHBondContact O-N 3.42Å; T732-R735 WeakPolarHBondContact O-CB 3.14Å; T732-R735 PolarHBondContact O-N 2.82Å; T732-Y736 HydrophobicContact CG2-CD2 4.06Å; T732-Y736 HydrophobicContact CG2-CE2 4.36Å; T732-Y736 WeakPolarHBondContact O-CD2 3.26Å; T732-Y736 PolarHBondContact O-N 2.95Å
733	I	88.7	Confident	87.3	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-57.5	-42.3	176.8	-65.8	177.4	0	0	0	110.9	L691 C729 Y736 V738 L743 F744 I765 L768	L691-I733 HydrophobicContact CD1-CD1 4.47Å; L691-I733 HydrophobicContact CD1-CG1 4.11Å; L691-I733 HydrophobicContact CD2-CD1 4.36Å; L691-I733 HydrophobicContact CD2-CG1 3.77Å; C729-I733 VanDerWaalsContact O-CG1 3.29Å; C729-I733 WeakPolarHBondContact O-CG1 3.47Å; C729-I733 PolarHBondContact O-N 3.47Å; I733-Y736 PolarHBondContact O-N 3.02Å; I733-V738 HydrophobicContact CG2-CB 3.67Å; I733-V738 HydrophobicContact CG2-CG1 4.12Å; I733-V738 HydrophobicContact CG2-CG2 3.49Å; I733-V738 VanDerWaalsContact CG2-CG2 3.49Å; I733-V738 PolarHBondContact O-N 3.31Å; I733-L743 HydrophobicContact CB-CD2 4.12Å; I733-L743 HydrophobicContact CG2-CD2 3.64Å; I733-F744 HydrophobicContact CD1-CD1 4.38Å; I733-F744 HydrophobicContact CD1-CE1 3.82Å; I733-I765 HydrophobicContact CD1-CD1 3.71Å; I733-L768 HydrophobicContact CG1-CD2 4.15Å
734	Y	88.4	Confident	87.6	Confident	88 Å²	88	57.3 Å²	57.3	35%	0.345	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-41.6	174.7	-177.2	-126.9	0	0	0	112.9	R620 R730 A731 T732 Y736 G737 V738 K740 L743	R620-Y734 PolarHBondContact NH1-OH 3.06Å; R620-Y734 VanDerWaalsContact NH1-OH 3.09Å; R730-Y734 WeakPolarHBondContact O-CB 3.23Å; R730-Y734 PolarHBondContact O-N 3.07Å; A731-Y734 PolarHBondContact O-N 2.97Å; T732-Y734 VanDerWaalsContact C-N 3.27Å; T732-Y734 PolarHBondContact O-N 3.42Å; Y734-Y736 PolarHBondContact O-N 3.02Å; Y734-G737 PolarHBondContact O-N 3.44Å; Y734-G737 VanDerWaalsContact O-N 3.13Å; Y734-V738 WeakPolarHBondContact CD2-O 3.26Å; Y734-K740 HydrophobicContact CE2-CB 4.16Å; Y734-L743 HydrophobicContact CD2-CD1 3.91Å; Y734-L743 HydrophobicContact CG-CD1 4.03Å
735	R	84.7	Confident	87.8	Confident	213 Å²	213	56.3 Å²	56.3	80%	0.804	27%	0.265	S	S	*	.	H	α-helix	trans	-64.4	-28.1	177.3	-172	178.2	179.9	-175	-0.4	112.2	A731 T732 G737	A731-R735 PolarHBondContact O-N 3.29Å; T732-R735 WeakPolarHBondContact O-CB 3.14Å; T732-R735 PolarHBondContact O-N 2.82Å; R735-G737 PolarHBondContact O-N 3.12Å
736	Y	82.1	Confident	88	Confident	90 Å²	90	57.3 Å²	57.3	35%	0.353	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	2.7	175.7	-94.3	-93	0	0	0	114.6	I695 T698 T732 I733 Y734 L768	I695-Y736 HydrophobicContact CB-CE1 4.3Å; I695-Y736 HydrophobicContact CB-CE2 4.13Å; I695-Y736 HydrophobicContact CD1-CD1 4.34Å; I695-Y736 HydrophobicContact CD1-CD2 3.48Å; I695-Y736 VanDerWaalsContact CD1-CD2 3.48Å; I695-Y736 HydrophobicContact CD1-CE1 4.48Å; I695-Y736 HydrophobicContact CD1-CE2 3.67Å; I695-Y736 HydrophobicContact CD1-CG 3.89Å; I695-Y736 HydrophobicContact CG1-CD1 4Å; I695-Y736 HydrophobicContact CG1-CD2 3.94Å; I695-Y736 HydrophobicContact CG1-CE1 3.86Å; I695-Y736 HydrophobicContact CG1-CE2 3.82Å; I695-Y736 HydrophobicContact CG1-CG 4.07Å; I695-Y736 HydrophobicContact CG2-CD2 4.23Å; I695-Y736 HydrophobicContact CG2-CE1 3.89Å; I695-Y736 HydrophobicContact CG2-CE2 3.27Å; I695-Y736 WeakPolarHBondContact CG2-OH 3.49Å; T698-Y736 PolarHBondContact OG1-OH 2.88Å; T732-Y736 HydrophobicContact CG2-CD2 4.06Å; T732-Y736 HydrophobicContact CG2-CE2 4.36Å; T732-Y736 WeakPolarHBondContact O-CD2 3.26Å; T732-Y736 PolarHBondContact O-N 2.95Å; I733-Y736 PolarHBondContact O-N 3.02Å; Y734-Y736 PolarHBondContact O-N 3.02Å; Y736-L768 HydrophobicContact CG-CD1 4.21Å
737	G	82.1	Confident	87.7	Confident	41 Å²	41	61 Å²	61	42%	0.423	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.6	-2.6	170.4	0	0	0	0	0	115.2	Y734 R735 P739	Y734-G737 PolarHBondContact O-N 3.44Å; Y734-G737 VanDerWaalsContact O-N 3.13Å; R735-G737 PolarHBondContact O-N 3.12Å; G737-P739 WeakPolarHBondContact O-CD 3.32Å
738	V	85.8	Confident	87.4	Confident	1 Å²	1	56 Å²	56	1%	0.006	27%	0.273	C	S	.	.			trans	-67.5	123.7	175.5	-179.6	0	0	0	0	109.6	I733 Y734 L743 I767 L768 L771	I733-V738 HydrophobicContact CG2-CB 3.67Å; I733-V738 HydrophobicContact CG2-CG1 4.12Å; I733-V738 HydrophobicContact CG2-CG2 3.49Å; I733-V738 VanDerWaalsContact CG2-CG2 3.49Å; I733-V738 PolarHBondContact O-N 3.31Å; Y734-V738 WeakPolarHBondContact CD2-O 3.26Å; V738-L743 HydrophobicContact CB-CD2 4.21Å; V738-L743 HydrophobicContact CG1-CD2 3.99Å; V738-I767 HydrophobicContact CG1-CB 4.48Å; V738-I767 HydrophobicContact CG1-CG2 4.24Å; V738-I767 HydrophobicContact CG2-CG2 4.13Å; V738-L768 HydrophobicContact CG2-CB 4Å; V738-L768 HydrophobicContact CG2-CD1 4.2Å; V738-L771 HydrophobicContact CG2-CD1 4.04Å
739	P	84.1	Confident	87.2	Confident	40 Å²	40	50.9 Å²	50.9	26%	0.26	25%	0.253	S	S	.	.			trans	-63.2	148.2	-177.3	-20.2	30.8	0	0	0	112.8	I627 G737 E741 Y742	I627-P739 HydrophobicContact CD1-CG 4.42Å; G737-P739 WeakPolarHBondContact O-CD 3.32Å; P739-E741 HydrophobicContact CB-CG 4.11Å; P739-E741 PolarHBondContact O-N 3Å; P739-Y742 HydrophobicContact CB-CD2 4Å; P739-Y742 HydrophobicContact CB-CE2 4.5Å; P739-Y742 HydrophobicContact CG-CD2 4.08Å; P739-Y742 HydrophobicContact CG-CE2 4.44Å; P739-Y742 PolarHBondContact O-N 3.35Å
740	K	87	Confident	86.5	Confident	150 Å²	150	52.3 Å²	52.3	65%	0.652	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-54.2	-32.1	-172.5	-175.7	-179.1	176.2	-174.3	0	114	Y734 L743	Y734-K740 HydrophobicContact CE2-CB 4.16Å; K740-L743 WeakPolarHBondContact O-CB 3.33Å; K740-L743 PolarHBondContact O-N 2.96Å
741	E	85.1	Confident	85.8	Confident	82 Å²	82	51.7 Å²	51.7	38%	0.383	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-75	-19.8	-178.2	55.8	-157.5	-136	0	0	115.4	K634 P739	K634-E741 VanDerWaalsContact CE-OE1 3.3Å; K634-E741 WeakPolarHBondContact CE-OE1 3.35Å; K634-E741 WeakPolarHBondContact CE-OE2 2.92Å; K634-E741 HydrophobicContact CG-CB 4.44Å; K634-E741 IonicContact NZ-OE1 2.78Å; K634-E741 PolarHBondContact NZ-OE1 2.7Å; K634-E741 IonicContact NZ-OE2 2.8Å; K634-E741 PolarHBondContact NZ-OE2 2.85Å; P739-E741 HydrophobicContact CB-CG 4.11Å; P739-E741 PolarHBondContact O-N 3Å
742	Y	87.7	Confident	85.3	Confident	21 Å²	21	50.8 Å²	50.8	8%	0.082	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-98.3	-3	174.5	-63.4	-81.2	0	0	0	113	T629 K634 P739 S764 I767	T629-Y742 WeakPolarHBondContact CB-OH 3.18Å; T629-Y742 HydrophobicContact CG2-CE2 3.93Å; T629-Y742 PolarHBondContact OG1-OH 3.46Å; K634-Y742 HydrophobicContact CB-CE1 4.29Å; P739-Y742 HydrophobicContact CB-CD2 4Å; P739-Y742 HydrophobicContact CB-CE2 4.5Å; P739-Y742 HydrophobicContact CG-CD2 4.08Å; P739-Y742 HydrophobicContact CG-CE2 4.44Å; P739-Y742 PolarHBondContact O-N 3.35Å; Y742-S764 PolarHBondContact O-OG 3.18Å; Y742-I767 HydrophobicContact CD1-CD1 3.63Å; Y742-I767 HydrophobicContact CD2-CD1 4.16Å; Y742-I767 HydrophobicContact CE1-CD1 4.38Å; Y742-I767 HydrophobicContact CG-CD1 3.51Å
743	L	89.4	Confident	84.8	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.073	27%	0.271	C	S	.	.	S	Bend	trans	-73.1	134.7	178.6	-65.4	174	0	0	0	111.2	R730 I733 Y734 V738 K740 S764	R730-L743 HydrophobicContact CG-CB 4.2Å; R730-L743 HydrophobicContact CG-CD1 4.14Å; R730-L743 HydrophobicContact CG-CD2 4.44Å; R730-L743 PolarHBondContact NH1-O 3.27Å; I733-L743 HydrophobicContact CB-CD2 4.12Å; I733-L743 HydrophobicContact CG2-CD2 3.64Å; Y734-L743 HydrophobicContact CD2-CD1 3.91Å; Y734-L743 HydrophobicContact CG-CD1 4.03Å; V738-L743 HydrophobicContact CB-CD2 4.21Å; V738-L743 HydrophobicContact CG1-CD2 3.99Å; K740-L743 WeakPolarHBondContact O-CB 3.33Å; K740-L743 PolarHBondContact O-N 2.96Å; L743-S764 VanDerWaalsContact CA-OG 3.27Å; L743-S764 WeakPolarHBondContact CA-OG 3.32Å
744	F	92.8	Very high	84.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-64.9	144.3	178.7	71.2	-95.9	0	0	0	115	L726 C729 R730 I733 T746 I749 S760 L761 S764	L726-F744 HydrophobicContact CB-CE2 4.35Å; L726-F744 HydrophobicContact CD2-CE2 4.31Å; C729-F744 HydrophobicContact CB-CZ 4.19Å; R730-F744 HydrophobicContact CB-CE1 4.04Å; R730-F744 HydrophobicContact CB-CE2 4.34Å; R730-F744 HydrophobicContact CB-CZ 3.79Å; R730-F744 VanDerWaalsContact NH1-C 3.25Å; R730-F744 PolarHBondContact NH1-O 2.85Å; I733-F744 HydrophobicContact CD1-CD1 4.38Å; I733-F744 HydrophobicContact CD1-CE1 3.82Å; F744-T746 HydrophobicContact CE2-CG2 4Å; F744-T746 PolarHBondContact O-N 2.99Å; F744-I749 HydrophobicContact CB-CD1 4.28Å; F744-I749 HydrophobicContact CD2-CD1 3.11Å; F744-I749 HydrophobicContact CD2-CG1 4.23Å; F744-I749 HydrophobicContact CE2-CD1 3.49Å; F744-I749 VanDerWaalsContact CE2-CD1 3.49Å; F744-I749 HydrophobicContact CG-CD1 3.86Å; F744-I749 HydrophobicContact CZ-CD1 4.47Å; F744-S760 WeakPolarHBondContact CA-OG 3.33Å; F744-L761 HydrophobicContact CB-CB 4.01Å; F744-L761 HydrophobicContact CB-CD1 4.28Å; F744-L761 HydrophobicContact CD1-CD1 3.48Å; F744-L761 VanDerWaalsContact CD1-CD1 3.48Å; F744-L761 HydrophobicContact CD2-CD1 4.28Å; F744-L761 HydrophobicContact CE1-CD1 3.74Å; F744-L761 HydrophobicContact CG-CB 4.37Å; F744-L761 HydrophobicContact CG-CD1 3.76Å; F744-L761 HydrophobicContact CZ-CD1 4.25Å; F744-S764 PolarHBondContact N-OG 3.4Å
745	S	87.4	Confident	84.5	Confident	56 Å²	56	52.1 Å²	52.1	39%	0.392	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-76.4	126.2	174.6	168	0	0	0	0	110.9	E747 S748 I749	S745-E747 VanDerWaalsContact C-N 3.26Å; S745-E747 PolarHBondContact O-N 2.95Å; S745-E747 PolarHBondContact OG-N 3.26Å; S745-S748 VanDerWaalsContact CB-OG 3.23Å; S745-S748 WeakPolarHBondContact CB-OG 3.49Å; S745-S748 PolarHBondContact O-OG 3.39Å; S745-S748 VanDerWaalsContact O-OG 3.14Å; S745-S748 PolarHBondContact OG-N 3.48Å; S745-S748 PolarHBondContact OG-OG 2.91Å; S745-I749 PolarHBondContact O-N 3.37Å
746	T	89.3	Confident	84.5	Confident	22 Å²	22	43.8 Å²	43.8	14%	0.135	23%	0.231	C	C	.	.	H	α-helix	trans	-67.6	-29.7	179	58.6	0	0	0	0	112.1	L726 R727 R730 F744 I750	L726-T746 HydrophobicContact CB-CG2 3.86Å; R727-T746 HydrophobicContact CG-CG2 4.02Å; R730-T746 HydrophobicContact CB-CG2 4.5Å; F744-T746 HydrophobicContact CE2-CG2 4Å; F744-T746 PolarHBondContact O-N 2.99Å; T746-I750 WeakPolarHBondContact O-CG1 3.28Å; T746-I750 PolarHBondContact O-N 3.19Å
747	E	85	Confident	84.8	Confident	78 Å²	78	39.5 Å²	39.5	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-78.9	-35	-176.2	-164.4	63.6	-160.1	0	0	111.6	R723 S745 I749 I750 N751	R723-E747 IonicContact CZ-OE1 3.66Å; R723-E747 IonicContact CZ-OE2 3.48Å; R723-E747 IonicContact NE-OE1 3.71Å; R723-E747 IonicContact NE-OE2 3.76Å; R723-E747 PolarHBondContact NE-OE2 3.41Å; R723-E747 IonicContact NH2-OE1 2.77Å; R723-E747 PolarHBondContact NH2-OE1 2.98Å; R723-E747 IonicContact NH2-OE2 2.89Å; R723-E747 PolarHBondContact NH2-OE2 3.32Å; S745-E747 VanDerWaalsContact C-N 3.26Å; S745-E747 PolarHBondContact O-N 2.95Å; S745-E747 PolarHBondContact OG-N 3.26Å; E747-I749 VanDerWaalsContact C-N 3.29Å; E747-I749 PolarHBondContact O-N 2.96Å; E747-I750 PolarHBondContact O-N 3.12Å; E747-N751 PolarHBondContact O-N 3.14Å
748	S	85.5	Confident	85.2	Confident	25 Å²	25	37.5 Å²	37.5	18%	0.175	19%	0.194	C	C	.	.	H	α-helix	trans	-72.8	-21.8	176.2	56.6	0	0	0	0	113.1	S745 P752 G757	S745-S748 VanDerWaalsContact CB-OG 3.23Å; S745-S748 WeakPolarHBondContact CB-OG 3.49Å; S745-S748 PolarHBondContact O-OG 3.39Å; S745-S748 VanDerWaalsContact O-OG 3.14Å; S745-S748 PolarHBondContact OG-N 3.48Å; S745-S748 PolarHBondContact OG-OG 2.91Å; S748-P752 VanDerWaalsContact O-CA 3.29Å; S748-P752 WeakPolarHBondContact O-CA 3.43Å; S748-G757 WeakPolarHBondContact OG-CA 3.27Å
749	I	85.4	Confident	85.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-75.5	-44.5	171.1	-68.7	177	0	0	0	111.6	I678 L726 F744 S745 E747 L761	I678-I749 HydrophobicContact CG1-CG2 4.42Å; L726-I749 HydrophobicContact CD1-CB 4.04Å; L726-I749 HydrophobicContact CD1-CG2 3.64Å; L726-I749 HydrophobicContact CD2-CG2 4.35Å; F744-I749 HydrophobicContact CB-CD1 4.28Å; F744-I749 HydrophobicContact CD2-CD1 3.11Å; F744-I749 HydrophobicContact CD2-CG1 4.23Å; F744-I749 HydrophobicContact CE2-CD1 3.49Å; F744-I749 VanDerWaalsContact CE2-CD1 3.49Å; F744-I749 HydrophobicContact CG-CD1 3.86Å; F744-I749 HydrophobicContact CZ-CD1 4.47Å; S745-I749 PolarHBondContact O-N 3.37Å; E747-I749 VanDerWaalsContact C-N 3.29Å; E747-I749 PolarHBondContact O-N 2.96Å; I749-L761 HydrophobicContact CD1-CB 4.05Å; I749-L761 HydrophobicContact CD1-CD1 4.08Å; I749-L761 HydrophobicContact CD1-CD2 3.97Å; I749-L761 HydrophobicContact CD1-CG 4.26Å
750	I	76.5	Confident	85.7	Confident	31 Å²	31	36.3 Å²	36.3	16%	0.159	19%	0.187	C	C	.	.	H	α-helix	trans	-73.5	-36.1	-177.1	-67.7	171.7	0	0	0	111.4	V719 R723 L726 T746 E747 P752	V719-I750 HydrophobicContact CG1-CG2 4.15Å; R723-I750 HydrophobicContact CB-CD1 3.94Å; R723-I750 HydrophobicContact CG-CD1 3.19Å; L726-I750 HydrophobicContact CD1-CD1 3.84Å; L726-I750 HydrophobicContact CD1-CG1 3.47Å; L726-I750 VanDerWaalsContact CD1-CG1 3.47Å; T746-I750 WeakPolarHBondContact O-CG1 3.28Å; T746-I750 PolarHBondContact O-N 3.19Å; E747-I750 PolarHBondContact O-N 3.12Å; I750-P752 VanDerWaalsContact C-CD 3.41Å; I750-P752 WeakPolarHBondContact O-CD 3.38Å
751	N	77.9	Confident	86	Confident	50 Å²	50	29.2 Å²	29.2	27%	0.267	16%	0.156	S	C	.	.	S	Bend	trans	-121.8	76.5	177.4	-171.7	10	0	0	0	109.8	E747 Q753	E747-N751 PolarHBondContact O-N 3.14Å; N751-Q753 PolarHBondContact O-N 2.78Å; N751-Q753 PolarHBondContact OD1-NE2 2.9Å
752	P	78.5	Confident	86.4	Confident	41 Å²	41	25.4 Å²	25.4	27%	0.266	14%	0.139	S	C	.	.			trans	-72.6	91.9	-177	27.7	-32.2	0	0	0	111.4	W644 I678 S748 I750	W644-P752 HydrophobicContact CZ2-CB 3.94Å; I678-P752 HydrophobicContact CD1-CB 3.76Å; I678-P752 HydrophobicContact CG1-CB 4.12Å; I678-P752 HydrophobicContact CG1-CG 4.43Å; I678-P752 HydrophobicContact CG2-CB 3.99Å; I678-P752 HydrophobicContact CG2-CG 4.07Å; S748-P752 VanDerWaalsContact O-CA 3.29Å; S748-P752 WeakPolarHBondContact O-CA 3.43Å; I750-P752 VanDerWaalsContact C-CD 3.41Å; I750-P752 WeakPolarHBondContact O-CD 3.38Å
753	Q	78.4	Confident	86.5	Confident	117 Å²	117	24.7 Å²	24.7	55%	0.547	14%	0.136	S	C	.	.	S	Bend	trans	-80.3	-23.9	170.5	-62.4	-63.5	-46.9	0	0	112	N751	N751-Q753 PolarHBondContact O-N 2.78Å; N751-Q753 PolarHBondContact OD1-NE2 2.9Å
754	N	83.6	Confident	86.6	Confident	23 Å²	23	24 Å²	24	12%	0.123	13%	0.133	C	C	.	.	S	Bend	trans	-152.1	177.9	-172	64.7	19.5	0	0	0	109.4	I641 V642 W644 D756	I641-N754 HydrophobicContact CG2-CB 3.89Å; I641-N754 WeakPolarHBondContact CG2-ND2 3.11Å; V642-N754 WeakPolarHBondContact O-CB 3.2Å; W644-N754 VanDerWaalsContact CZ2-O 3.23Å; W644-N754 WeakPolarHBondContact CZ2-O 3.23Å; N754-D756 VanDerWaalsContact C-N 3.34Å; N754-D756 VanDerWaalsContact CG-OD2 3.32Å; N754-D756 PolarHBondContact ND2-OD2 2.9Å; N754-D756 WeakPolarHBondContact OD1-CB 3.5Å; N754-D756 PolarHBondContact OD1-N 3.49Å; N754-D756 PolarHBondContact OD1-OD2 2.69Å
755	A	85.4	Confident	86.6	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-80.8	-11.6	-176.4	0	0	0	0	0	114.1	V642 W644 L647 G757 L758 L759	V642-A755 HydrophobicContact CG1-CB 4.3Å; V642-A755 PolarHBondContact O-N 2.77Å; W644-A755 HydrophobicContact CD2-CB 4.27Å; W644-A755 HydrophobicContact CE3-CB 3.89Å; W644-A755 HydrophobicContact CH2-CB 4.43Å; W644-A755 HydrophobicContact CZ3-CB 3.98Å; L647-A755 HydrophobicContact CD1-CB 4.35Å; L647-A755 HydrophobicContact CD2-CB 3.74Å; L647-A755 HydrophobicContact CG-CB 4.16Å; A755-G757 PolarHBondContact O-N 3.01Å; A755-G757 VanDerWaalsContact O-N 3.14Å; A755-L758 PolarHBondContact O-N 3.45Å; A755-L759 HydrophobicContact CB-CD1 3.98Å; A755-L759 HydrophobicContact CB-CG 4.4Å; A755-L759 WeakPolarHBondContact O-CG 3.29Å; A755-L759 PolarHBondContact O-N 3.47Å
756	D	86.1	Confident	86.7	Confident	37 Å²	37	22.4 Å²	22.4	20%	0.198	12%	0.121	C	C	.	.	H	α-helix	trans	-54.7	-38.4	-174.1	-57.3	-21.5	0	0	0	112.8	V642 N754 S760	V642-D756 WeakPolarHBondContact CB-OD1 3.21Å; V642-D756 PolarHBondContact N-OD1 3.02Å; N754-D756 VanDerWaalsContact C-N 3.34Å; N754-D756 VanDerWaalsContact CG-OD2 3.32Å; N754-D756 PolarHBondContact ND2-OD2 2.9Å; N754-D756 WeakPolarHBondContact OD1-CB 3.5Å; N754-D756 PolarHBondContact OD1-N 3.49Å; N754-D756 PolarHBondContact OD1-OD2 2.69Å; D756-S760 WeakPolarHBondContact O-CB 3.23Å; D756-S760 PolarHBondContact O-N 3.39Å; D756-S760 PolarHBondContact O-OG 2.84Å
757	G	88.5	Confident	86.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-42.7	177	0	0	0	0	0	112.9	S748 A755 S760 L761	S748-G757 WeakPolarHBondContact OG-CA 3.27Å; A755-G757 PolarHBondContact O-N 3.01Å; A755-G757 VanDerWaalsContact O-N 3.14Å; G757-S760 PolarHBondContact O-OG 2.97Å; G757-S760 VanDerWaalsContact O-OG 3.12Å; G757-L761 WeakPolarHBondContact O-CB 3.49Å; G757-L761 PolarHBondContact O-N 3.46Å
758	L	90.1	Very high	86.8	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-74.4	-41.7	179.8	-172.7	61.3	0	0	0	111.4	W644 I655 L658 P674 L677 I678 L681 A755 L761 A762	W644-L758 HydrophobicContact CH2-CB 4.22Å; W644-L758 HydrophobicContact CH2-CD2 4.15Å; W644-L758 HydrophobicContact CZ3-CD2 4.03Å; I655-L758 HydrophobicContact CD1-CD2 3.95Å; I655-L758 HydrophobicContact CG1-CD2 3.98Å; I655-L758 HydrophobicContact CG1-CG 4.19Å; I655-L758 HydrophobicContact CG2-CD2 3.9Å; L658-L758 HydrophobicContact CD2-CD1 4.06Å; P674-L758 HydrophobicContact CB-CD2 3.72Å; P674-L758 WeakPolarHBondContact O-CD2 3.16Å; L677-L758 HydrophobicContact CD2-CD1 4.19Å; L677-L758 HydrophobicContact CD2-CD2 4.39Å; L677-L758 HydrophobicContact CG-CD1 4.27Å; I678-L758 HydrophobicContact CB-CB 4.45Å; I678-L758 HydrophobicContact CB-CD1 4.21Å; I678-L758 HydrophobicContact CD1-CB 3.78Å; L681-L758 HydrophobicContact CD1-CD1 4.15Å; A755-L758 PolarHBondContact O-N 3.45Å; L758-L761 WeakPolarHBondContact O-CB 3.5Å; L758-L761 PolarHBondContact O-N 3.45Å; L758-A762 WeakPolarHBondContact O-CB 3.29Å; L758-A762 PolarHBondContact O-N 3.14Å
759	L	90.5	Very high	86.7	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.2	-42.3	-179.9	-66.7	168	0	0	0	111.7	M635 V642 L647 D651 I655 A755 L761 A762 N763	M635-L759 HydrophobicContact CE-CB 3.4Å; M635-L759 HydrophobicContact CE-CD1 3.77Å; M635-L759 HydrophobicContact CE-CG 4.11Å; M635-L759 HydrophobicContact SD-CB 3.73Å; V642-L759 HydrophobicContact CB-CD1 4.21Å; V642-L759 HydrophobicContact CG1-CD1 4.08Å; V642-L759 HydrophobicContact CG2-CD1 4.39Å; L647-L759 HydrophobicContact CD2-CD1 3.94Å; L647-L759 HydrophobicContact CD2-CD2 4.25Å; L647-L759 HydrophobicContact CD2-CG 4.4Å; D651-L759 HydrophobicContact CB-CD1 4.47Å; D651-L759 HydrophobicContact CB-CD2 3.73Å; I655-L759 HydrophobicContact CD1-CD2 3.86Å; I655-L759 HydrophobicContact CG1-CD2 3.9Å; A755-L759 HydrophobicContact CB-CD1 3.98Å; A755-L759 HydrophobicContact CB-CG 4.4Å; A755-L759 WeakPolarHBondContact O-CG 3.29Å; A755-L759 PolarHBondContact O-N 3.47Å; L759-L761 VanDerWaalsContact C-N 3.28Å; L759-L761 PolarHBondContact O-N 3.45Å; L759-A762 PolarHBondContact O-N 2.78Å; L759-N763 PolarHBondContact O-N 3.22Å
760	S	90.1	Very high	86.5	Confident	15 Å²	15	21.4 Å²	21.4	11%	0.105	11%	0.113	C	C	.	.	H	α-helix	trans	-64.2	-34.1	174.1	64	0	0	0	0	112.3	F744 D756 G757 S764	F744-S760 WeakPolarHBondContact CA-OG 3.33Å; D756-S760 WeakPolarHBondContact O-CB 3.23Å; D756-S760 PolarHBondContact O-N 3.39Å; D756-S760 PolarHBondContact O-OG 2.84Å; G757-S760 PolarHBondContact O-OG 2.97Å; G757-S760 VanDerWaalsContact O-OG 3.12Å; S760-S764 WeakPolarHBondContact O-CB 3.48Å; S760-S764 PolarHBondContact O-N 2.62Å; S760-S764 PolarHBondContact O-OG 2.88Å
761	L	93.8	Very high	86.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-66.4	-46.6	171.5	-178.3	66.8	0	0	0	112.1	L658 L681 L687 F744 I749 G757 L758 L759 N763 S764 I765	L658-L761 HydrophobicContact CD2-CD2 4.21Å; L658-L761 HydrophobicContact CD2-CG 4.26Å; L681-L761 HydrophobicContact CB-CD2 4.31Å; L681-L761 HydrophobicContact CD1-CD2 3.75Å; L687-L761 HydrophobicContact CD1-CD1 3.85Å; L687-L761 HydrophobicContact CD1-CD2 4.07Å; L687-L761 HydrophobicContact CD2-CD1 4.19Å; L687-L761 HydrophobicContact CD2-CD2 4.31Å; F744-L761 HydrophobicContact CB-CB 4.01Å; F744-L761 HydrophobicContact CB-CD1 4.28Å; F744-L761 HydrophobicContact CD1-CD1 3.48Å; F744-L761 VanDerWaalsContact CD1-CD1 3.48Å; F744-L761 HydrophobicContact CD2-CD1 4.28Å; F744-L761 HydrophobicContact CE1-CD1 3.74Å; F744-L761 HydrophobicContact CG-CB 4.37Å; F744-L761 HydrophobicContact CG-CD1 3.76Å; F744-L761 HydrophobicContact CZ-CD1 4.25Å; I749-L761 HydrophobicContact CD1-CB 4.05Å; I749-L761 HydrophobicContact CD1-CD1 4.08Å; I749-L761 HydrophobicContact CD1-CD2 3.97Å; I749-L761 HydrophobicContact CD1-CG 4.26Å; G757-L761 WeakPolarHBondContact O-CB 3.49Å; G757-L761 PolarHBondContact O-N 3.46Å; L758-L761 WeakPolarHBondContact O-CB 3.5Å; L758-L761 PolarHBondContact O-N 3.45Å; L759-L761 VanDerWaalsContact C-N 3.28Å; L759-L761 PolarHBondContact O-N 3.45Å; L761-N763 VanDerWaalsContact C-N 3.29Å; L761-N763 PolarHBondContact O-N 2.77Å; L761-S764 WeakPolarHBondContact O-CB 3.32Å; L761-S764 PolarHBondContact O-N 3.5Å; L761-I765 HydrophobicContact CD1-CG1 4.12Å; L761-I765 HydrophobicContact CG-CG1 4.45Å; L761-I765 WeakPolarHBondContact O-CG1 3.32Å; L761-I765 PolarHBondContact O-N 3.4Å
762	A	91.6	Very high	86.6	Confident	3 Å²	3	20.9 Å²	20.9	3%	0.025	11%	0.109	C	C	.	.	H	α-helix	trans	-57	-45.2	176.7	0	0	0	0	0	111.1	R654 L658 L758 L759 I765 S766	R654-A762 HydrophobicContact CB-CB 4.48Å; L658-A762 HydrophobicContact CB-CB 3.92Å; L658-A762 HydrophobicContact CD2-CB 4Å; L658-A762 HydrophobicContact CG-CB 4.49Å; L758-A762 WeakPolarHBondContact O-CB 3.29Å; L758-A762 PolarHBondContact O-N 3.14Å; L759-A762 PolarHBondContact O-N 2.78Å; A762-I765 PolarHBondContact O-N 2.89Å; A762-S766 VanDerWaalsContact O-CB 3.26Å; A762-S766 WeakPolarHBondContact O-CB 3.49Å; A762-S766 PolarHBondContact O-N 2.93Å
763	N	90.8	Very high	86.4	Confident	6 Å²	6	21.7 Å²	21.7	3%	0.032	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-46.3	176	-72.4	-12.9	0	0	0	112.3	L759 L761 I765 S766 I767	L759-N763 PolarHBondContact O-N 3.22Å; L761-N763 VanDerWaalsContact C-N 3.29Å; L761-N763 PolarHBondContact O-N 2.77Å; N763-I765 VanDerWaalsContact C-N 3.33Å; N763-I765 PolarHBondContact O-N 3.37Å; N763-S766 PolarHBondContact O-N 2.92Å; N763-I767 WeakPolarHBondContact O-CG1 3.38Å; N763-I767 PolarHBondContact O-N 2.98Å
764	S	92.4	Very high	85.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55.6	-47	176.9	-69.4	0	0	0	0	112.6	Y742 L743 F744 S760 L761 L768	Y742-S764 PolarHBondContact O-OG 3.18Å; L743-S764 VanDerWaalsContact CA-OG 3.27Å; L743-S764 WeakPolarHBondContact CA-OG 3.32Å; F744-S764 PolarHBondContact N-OG 3.4Å; S760-S764 WeakPolarHBondContact O-CB 3.48Å; S760-S764 PolarHBondContact O-N 2.62Å; S760-S764 PolarHBondContact O-OG 2.88Å; L761-S764 WeakPolarHBondContact O-CB 3.32Å; L761-S764 PolarHBondContact O-N 3.5Å; S764-L768 WeakPolarHBondContact O-CB 3.43Å; S764-L768 PolarHBondContact O-N 2.9Å; S764-L768 VanDerWaalsContact O-N 3.13Å
765	I	91.7	Very high	84.6	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-74.3	-36.7	-177.1	-64.2	-66.4	0	0	0	111.1	L658 I661 L687 L690 I733 L761 A762 N763 L768 Y769	L658-I765 HydrophobicContact CD1-CB 3.68Å; L658-I765 HydrophobicContact CD1-CG1 3.83Å; L658-I765 HydrophobicContact CD1-CG2 3.71Å; I661-I765 HydrophobicContact CG2-CG2 4.36Å; L687-I765 HydrophobicContact CD2-CD1 4.46Å; L690-I765 HydrophobicContact CD2-CD1 4.12Å; L690-I765 HydrophobicContact CD2-CG2 4.23Å; I733-I765 HydrophobicContact CD1-CD1 3.71Å; L761-I765 HydrophobicContact CD1-CG1 4.12Å; L761-I765 HydrophobicContact CG-CG1 4.45Å; L761-I765 WeakPolarHBondContact O-CG1 3.32Å; L761-I765 PolarHBondContact O-N 3.4Å; A762-I765 PolarHBondContact O-N 2.89Å; N763-I765 VanDerWaalsContact C-N 3.33Å; N763-I765 PolarHBondContact O-N 3.37Å; I765-L768 HydrophobicContact CD1-CD2 4.48Å; I765-L768 WeakPolarHBondContact O-CB 3.27Å; I765-L768 PolarHBondContact O-N 3.12Å; I765-Y769 WeakPolarHBondContact O-CB 3.45Å; I765-Y769 PolarHBondContact O-N 3.06Å
766	S	89.5	Confident	82.6	Confident	18 Å²	18	28.2 Å²	28.2	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-45.9	175.8	-174.2	0	0	0	0	111.8	Y632 A762 N763 L768 Y769 N770	Y632-S766 WeakPolarHBondContact CE1-OG 3.22Å; Y632-S766 PolarHBondContact OH-OG 3.41Å; A762-S766 VanDerWaalsContact O-CB 3.26Å; A762-S766 WeakPolarHBondContact O-CB 3.49Å; A762-S766 PolarHBondContact O-N 2.93Å; N763-S766 PolarHBondContact O-N 2.92Å; S766-L768 VanDerWaalsContact C-N 3.35Å; S766-L768 PolarHBondContact O-N 2.64Å; S766-Y769 PolarHBondContact O-N 3.1Å; S766-N770 PolarHBondContact O-N 3.21Å
767	I	88.6	Confident	80.4	Confident	1 Å²	1	33 Å²	33	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-42.7	175.7	-64.4	165.8	0	0	0	110.8	I627 Y632 V738 Y742 N763 Y769 N770 L771	I627-I767 HydrophobicContact CD1-CG2 4.48Å; Y632-I767 HydrophobicContact CD1-CD1 4.34Å; Y632-I767 HydrophobicContact CD1-CG1 3.89Å; Y632-I767 HydrophobicContact CD2-CD1 4.37Å; Y632-I767 HydrophobicContact CD2-CG1 3.82Å; Y632-I767 HydrophobicContact CE1-CG1 3.98Å; Y632-I767 HydrophobicContact CE2-CG1 3.91Å; Y632-I767 HydrophobicContact CG-CD1 4.05Å; Y632-I767 HydrophobicContact CG-CG1 3.79Å; V738-I767 HydrophobicContact CG1-CB 4.48Å; V738-I767 HydrophobicContact CG1-CG2 4.24Å; V738-I767 HydrophobicContact CG2-CG2 4.13Å; Y742-I767 HydrophobicContact CD1-CD1 3.63Å; Y742-I767 HydrophobicContact CD2-CD1 4.16Å; Y742-I767 HydrophobicContact CE1-CD1 4.38Å; Y742-I767 HydrophobicContact CG-CD1 3.51Å; N763-I767 WeakPolarHBondContact O-CG1 3.38Å; N763-I767 PolarHBondContact O-N 2.98Å; I767-Y769 VanDerWaalsContact C-N 3.32Å; I767-Y769 PolarHBondContact O-N 3.36Å; I767-N770 PolarHBondContact O-N 3Å; I767-L771 HydrophobicContact CG2-CD1 4.31Å; I767-L771 WeakPolarHBondContact O-CB 3.38Å; I767-L771 WeakPolarHBondContact O-CG 3.47Å; I767-L771 PolarHBondContact O-N 3.2Å
768	L	87.2	Confident	77.7	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-43.7	175.3	-178.3	73	0	0	0	111.6	L691 F694 I733 Y736 V738 S764 I765 S766 N770 L771 H772	L691-L768 HydrophobicContact CD2-CD2 3.53Å; F694-L768 HydrophobicContact CD1-CD2 4.16Å; F694-L768 HydrophobicContact CD1-CG 4.34Å; F694-L768 HydrophobicContact CE1-CD2 4.37Å; F694-L768 HydrophobicContact CE1-CG 4.09Å; I733-L768 HydrophobicContact CG1-CD2 4.15Å; Y736-L768 HydrophobicContact CG-CD1 4.21Å; V738-L768 HydrophobicContact CG2-CB 4Å; V738-L768 HydrophobicContact CG2-CD1 4.2Å; S764-L768 WeakPolarHBondContact O-CB 3.43Å; S764-L768 PolarHBondContact O-N 2.9Å; S764-L768 VanDerWaalsContact O-N 3.13Å; I765-L768 HydrophobicContact CD1-CD2 4.48Å; I765-L768 WeakPolarHBondContact O-CB 3.27Å; I765-L768 PolarHBondContact O-N 3.12Å; S766-L768 VanDerWaalsContact C-N 3.35Å; S766-L768 PolarHBondContact O-N 2.64Å; L768-N770 VanDerWaalsContact C-N 3.34Å; L768-L771 PolarHBondContact O-N 3.06Å; L768-H772 PolarHBondContact O-N 3.37Å; L768-H772 VanDerWaalsContact O-N 3.11Å
769	Y	84	Confident	74.6	Confident	37 Å²	37	46.5 Å²	46.5	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-41.8	-179.7	-160.6	-102.4	0	0	0	111.3	I661 E665 F694 I765 S766 I767 H772 N773	I661-Y769 HydrophobicContact CD1-CD1 4.38Å; I661-Y769 HydrophobicContact CD1-CG 4.16Å; I661-Y769 HydrophobicContact CG1-CD2 4.46Å; I661-Y769 HydrophobicContact CG1-CG 4.44Å; I661-Y769 HydrophobicContact CG2-CD2 3.71Å; I661-Y769 HydrophobicContact CG2-CE2 3.87Å; I661-Y769 HydrophobicContact CG2-CG 4.4Å; E665-Y769 HydrophobicContact CG-CE2 4.27Å; E665-Y769 PolarHBondContact OE1-OH 3.11Å; E665-Y769 VanDerWaalsContact OE1-OH 3.1Å; F694-Y769 HydrophobicContact CD2-CD2 4.19Å; F694-Y769 HydrophobicContact CD2-CE2 4.15Å; F694-Y769 HydrophobicContact CE1-CD2 4.24Å; F694-Y769 AromaticContact CE2-CD2 3.27Å; F694-Y769 HydrophobicContact CE2-CD2 3.27Å; F694-Y769 AromaticContact CE2-CE2 3.3Å; F694-Y769 HydrophobicContact CE2-CE2 3.3Å; F694-Y769 HydrophobicContact CE2-CG 4.35Å; F694-Y769 AromaticContact CZ-CD2 3.29Å; F694-Y769 HydrophobicContact CZ-CD2 3.29Å; F694-Y769 AromaticContact CZ-CE2 3.82Å; F694-Y769 HydrophobicContact CZ-CE2 3.82Å; F694-Y769 HydrophobicContact CZ-CG 4.02Å; I765-Y769 WeakPolarHBondContact O-CB 3.45Å; I765-Y769 PolarHBondContact O-N 3.06Å; S766-Y769 PolarHBondContact O-N 3.1Å; I767-Y769 VanDerWaalsContact C-N 3.32Å; I767-Y769 PolarHBondContact O-N 3.36Å; Y769-H772 PolarHBondContact O-N 3.34Å; Y769-N773 WeakPolarHBondContact CD1-ND2 3.5Å; Y769-N773 WeakPolarHBondContact CE1-ND2 3.4Å; Y769-N773 VanDerWaalsContact O-CG 3.28Å; Y769-N773 PolarHBondContact O-N 2.96Å; Y769-N773 PolarHBondContact O-ND2 2.84Å
770	N	82.3	Confident	71.6	Confident	60 Å²	60	50.9 Å²	50.9	32%	0.321	27%	0.272	S	S	.	.	H	α-helix	trans	-68.5	-41.4	177.1	-80.5	4.8	0	0	0	113	Y632 S766 I767 L768 H772 N773 N774	Y632-N770 PolarHBondContact OH-ND2 3.22Å; S766-N770 PolarHBondContact O-N 3.21Å; I767-N770 PolarHBondContact O-N 3Å; L768-N770 VanDerWaalsContact C-N 3.34Å; N770-H772 VanDerWaalsContact C-N 3.29Å; N770-H772 PolarHBondContact O-N 3.48Å; N770-N773 PolarHBondContact O-N 3.32Å; N770-N774 WeakPolarHBondContact O-CB 3.36Å; N770-N774 VanDerWaalsContact O-CG 3.23Å; N770-N774 PolarHBondContact O-N 3.13Å; N770-N774 PolarHBondContact O-ND2 2.86Å
771	L	80.1	Confident	68.6	Low	13 Å²	13	55.7 Å²	55.7	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-55.4	-45.7	172.9	-84.4	175.3	0	0	0	111.9	I627 V738 I767 L768 N775	I627-L771 HydrophobicContact CD1-CD1 3.75Å; I627-L771 HydrophobicContact CD1-CD2 3.53Å; I627-L771 HydrophobicContact CD1-CG 3.9Å; I627-L771 HydrophobicContact CG1-CD2 3.59Å; I627-L771 HydrophobicContact CG1-CG 4.4Å; V738-L771 HydrophobicContact CG2-CD1 4.04Å; I767-L771 HydrophobicContact CG2-CD1 4.31Å; I767-L771 WeakPolarHBondContact O-CB 3.38Å; I767-L771 WeakPolarHBondContact O-CG 3.47Å; I767-L771 PolarHBondContact O-N 3.2Å; L768-L771 PolarHBondContact O-N 3.06Å; L771-N775 PolarHBondContact O-N 2.86Å; L771-N775 VanDerWaalsContact O-N 3.12Å; L771-N775 PolarHBondContact O-ND2 3.01Å
772	H	76.1	Confident	65.4	Low	58 Å²	58	63 Å²	63	27%	0.269	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-46.6	178.9	177	-81.9	0	0	0	112.3	F694 L768 Y769 N770 N774 N775 N776	F694-H772 HydrophobicContact CE1-CB 3.48Å; F694-H772 VanDerWaalsContact CE1-CB 3.48Å; F694-H772 AromaticContact CE1-CG 3.69Å; F694-H772 HydrophobicContact CE2-CB 4.43Å; F694-H772 AromaticContact CE2-ND1 3.87Å; F694-H772 HydrophobicContact CZ-CB 3.36Å; F694-H772 AromaticContact CZ-CD2 3.99Å; F694-H772 AromaticContact CZ-CG 3.37Å; F694-H772 AromaticContact CZ-ND1 3.6Å; L768-H772 PolarHBondContact O-N 3.37Å; L768-H772 VanDerWaalsContact O-N 3.11Å; Y769-H772 PolarHBondContact O-N 3.34Å; N770-H772 VanDerWaalsContact C-N 3.29Å; N770-H772 PolarHBondContact O-N 3.48Å; H772-N774 VanDerWaalsContact C-N 3.29Å; H772-N774 PolarHBondContact O-N 3.26Å; H772-N775 PolarHBondContact O-N 2.81Å; H772-N776 PolarHBondContact CE1-ND2 2.9Å; H772-N776 VanDerWaalsContact CE1-ND2 3.26Å; H772-N776 PolarHBondContact O-N 3.4Å; H772-N776 VanDerWaalsContact O-N 3.14Å
773	N	73.8	Confident	62.2	Low	58 Å²	58	69 Å²	69	31%	0.31	37%	0.372	S	S	.	.	H	α-helix	trans	-64.8	-34.1	179.9	-69.6	-17.9	0	0	0	112.5	Y769 N770 N776	Y769-N773 WeakPolarHBondContact CD1-ND2 3.5Å; Y769-N773 WeakPolarHBondContact CE1-ND2 3.4Å; Y769-N773 VanDerWaalsContact O-CG 3.28Å; Y769-N773 PolarHBondContact O-N 2.96Å; Y769-N773 PolarHBondContact O-ND2 2.84Å; N770-N773 PolarHBondContact O-N 3.32Å; N773-N776 PolarHBondContact O-N 3.21Å
774	N	68.4	Low	59.4	Low	106 Å²	106	73.7 Å²	73.7	57%	0.567	41%	0.411	S	S	*	.	H	α-helix	trans	-67.7	-39.5	173.7	-72.1	-17.2	0	0	0	112	N770 H772 N776 N777	N770-N774 WeakPolarHBondContact O-CB 3.36Å; N770-N774 VanDerWaalsContact O-CG 3.23Å; N770-N774 PolarHBondContact O-N 3.13Å; N770-N774 PolarHBondContact O-ND2 2.86Å; H772-N774 VanDerWaalsContact C-N 3.29Å; H772-N774 PolarHBondContact O-N 3.26Å; N774-N776 VanDerWaalsContact C-N 3.3Å; N774-N776 PolarHBondContact O-N 2.87Å; N774-N777 WeakPolarHBondContact O-CB 3.36Å; N774-N777 PolarHBondContact O-N 3.31Å
775	N	55.7	Low	56.3	Low	69 Å²	69	79 Å²	79	37%	0.369	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-29.9	177	-76.8	-24.8	0	0	0	113	Q625 L771 H772 N777 T778	Q625-N775 PolarHBondContact NE2-OD1 2.98Å; L771-N775 PolarHBondContact O-N 2.86Å; L771-N775 VanDerWaalsContact O-N 3.12Å; L771-N775 PolarHBondContact O-ND2 3.01Å; H772-N775 PolarHBondContact O-N 2.81Å; N775-N777 PolarHBondContact O-N 2.8Å; N775-T778 CarbonylContact O-C 3.3Å; N775-T778 PolarHBondContact O-N 2.78Å; N775-T778 VanDerWaalsContact O-O 3.05Å; N775-T778 PolarHBondContact O-OG1 3.16Å; N775-T778 VanDerWaalsContact O-OG1 3.09Å
776	N	44.1	Very low	53.2	Low	101 Å²	101	84.3 Å²	84.3	54%	0.54	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.8	175.5	-75.4	-21.6	0	0	0	113.5	H772 N773 N774 T778	H772-N776 PolarHBondContact CE1-ND2 2.9Å; H772-N776 VanDerWaalsContact CE1-ND2 3.26Å; H772-N776 PolarHBondContact O-N 3.4Å; H772-N776 VanDerWaalsContact O-N 3.14Å; N773-N776 PolarHBondContact O-N 3.21Å; N774-N776 VanDerWaalsContact C-N 3.3Å; N774-N776 PolarHBondContact O-N 2.87Å; N776-T778 VanDerWaalsContact C-N 3.33Å
777	N	39.8	Very low	50.3	Low	139 Å²	139	87.3 Å²	87.3	74%	0.743	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.9	172.7	-68.9	-21.1	0	0	0	113.1	N774 N775	N774-N777 WeakPolarHBondContact O-CB 3.36Å; N774-N777 PolarHBondContact O-N 3.31Å; N775-N777 PolarHBondContact O-N 2.8Å
778	T	30.4	Very low	47.5	Very low	91 Å²	91	93.7 Å²	93.7	56%	0.558	54%	0.541	S	S	*	.	S	Bend	trans	-111.4	90.5	173.7	55.6	0	0	0	0	109.3	N775 N776 S780	N775-T778 CarbonylContact O-C 3.3Å; N775-T778 PolarHBondContact O-N 2.78Å; N775-T778 VanDerWaalsContact O-O 3.05Å; N775-T778 PolarHBondContact O-OG1 3.16Å; N775-T778 VanDerWaalsContact O-OG1 3.09Å; N776-T778 VanDerWaalsContact C-N 3.33Å; T778-S780 VanDerWaalsContact C-N 3.31Å; T778-S780 PolarHBondContact O-N 3.36Å
779	K	26.2	Very low	44.9	Very low	191 Å²	191	102.8 Å²	102.8	83%	0.83	58%	0.581	S	S	*	*			trans	-60.5	82.5	176.7	-72.3	179.6	177.8	174.3	0	112.1
780	S	26.2	Very low	42.3	Very low	93 Å²	93	107.4 Å²	107.4	65%	0.65	61%	0.606	S	S	*	*			trans	178.6	124	149.8	40.5	0	0	0	0	110.7	T778 I782	T778-S780 VanDerWaalsContact C-N 3.31Å; T778-S780 PolarHBondContact O-N 3.36Å; S780-I782 PolarHBondContact O-N 3.33Å
781	P	28.5	Very low	39.7	Very low	115 Å²	115	111 Å²	111	75%	0.747	62%	0.621	S	S	*	*			trans	-68	134.3	172.6	29.1	-30.5	0	0	0	108.9	N783	P781-N783 PolarHBondContact O-N 3.28Å
782	I	25.2	Very low	37.4	Very low	155 Å²	155	118.2 Å²	118.2	80%	0.795	65%	0.654	S	S	*	*			trans	-58	98.3	179.1	-59.8	167.5	0	0	0	108.6	S780 A784	S780-I782 PolarHBondContact O-N 3.33Å; I782-A784 PolarHBondContact O-N 3.42Å
783	N	25.8	Very low	35.3	Very low	130 Å²	130	121.7 Å²	121.7	70%	0.695	68%	0.675	S	S	*	*			trans	-74.9	117.5	167.9	-88.7	-18.5	0	0	0	107.9	P781 S785	P781-N783 PolarHBondContact O-N 3.28Å; N783-S785 PolarHBondContact O-N 3.41Å
784	A	30.7	Very low	33.1	Very low	103 Å²	103	125.5 Å²	125.5	85%	0.851	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	33.5	-171.5	0	0	0	0	0	115.3	I782	I782-A784 PolarHBondContact O-N 3.42Å
785	S	29	Very low	31.2	Very low	112 Å²	112	124 Å²	124	78%	0.783	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130	14.2	-173.9	59.1	0	0	0	0	116	N783	N783-S785 PolarHBondContact O-N 3.41Å
786	S	25.6	Very low	30.1	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	70%	0.699	S	S	*	*			trans	-125.1	53.1	172.6	65	0	0	0	0	112.7
787	S	28.3	Very low	29.6	Very low	82 Å²	82	125.7 Å²	125.7	57%	0.573	70%	0.7	S	S	*	*			trans	-98.8	-7.9	175.2	69.6	0	0	0	0	114.9
788	N	30	Very low	29	Very low	135 Å²	135	123.9 Å²	123.9	72%	0.722	69%	0.689	S	S	*	*	S	Bend	trans	-92.5	-0.9	-162.6	-75	1.2	0	0	0	116.7
789	K	32.1	Very low	29	Very low	196 Å²	196	124.8 Å²	124.8	85%	0.852	69%	0.691	S	S	*	*	S	Bend	trans	-113.3	-0.5	-174.4	-122.5	-177.8	-178.2	-175.7	0	117.2
790	I	29.1	Very low	29.4	Very low	134 Å²	134	121.1 Å²	121.1	69%	0.687	68%	0.68	S	S	*	*	S	Bend	trans	-112.8	-9.2	178.4	-59.2	174.7	0	0	0	111.1	E792	I790-E792 PolarHBondContact O-N 2.84Å
791	Q	28	Very low	29.6	Very low	134 Å²	134	123.7 Å²	123.7	63%	0.626	68%	0.682	S	S	*	*	H	α-helix	trans	-76.3	-21.5	-177.4	-148	170.4	-4.9	0	0	113.6
792	E	32.6	Very low	29.4	Very low	165 Å²	165	125.9 Å²	125.9	77%	0.771	68%	0.676	S	S	*	*	H	α-helix	trans	-74.2	-34.3	177.3	-79.3	-173.6	154.8	0	0	112.9	I790 F794	I790-E792 PolarHBondContact O-N 2.84Å; E792-F794 PolarHBondContact O-N 2.89Å
793	D	31.2	Very low	29.8	Very low	131 Å²	131	124 Å²	124	70%	0.701	67%	0.668	S	S	*	*	H	α-helix	trans	-82	-15.8	-174.1	-73.9	-19.6	0	0	0	113.9
794	F	29	Very low	30.2	Very low	138 Å²	138	122 Å²	122	61%	0.605	66%	0.66	S	S	*	*	H	α-helix	trans	-99.4	-22.7	-177.5	-100.9	-85.7	0	0	0	115.1	E792 T796 N797	E792-F794 PolarHBondContact O-N 2.89Å; F794-T796 VanDerWaalsContact C-N 3.26Å; F794-T796 PolarHBondContact O-N 3.3Å; F794-N797 PolarHBondContact O-N 3.49Å
795	S	26.9	Very low	30	Very low	76 Å²	76	119.5 Å²	119.5	53%	0.531	64%	0.637	S	S	.	*	H	α-helix	trans	-66.4	-26.9	179.8	-76.5	0	0	0	0	113.3	N797	S795-N797 VanDerWaalsContact C-N 3.32Å; S795-N797 PolarHBondContact O-N 3.5Å
796	T	34.3	Very low	29.9	Very low	99 Å²	99	117.6 Å²	117.6	61%	0.607	62%	0.62	S	S	*	*	H	α-helix	trans	-74.5	-19.6	-179.3	50.9	0	0	0	0	113.7	F794 N800	F794-T796 VanDerWaalsContact C-N 3.26Å; F794-T796 PolarHBondContact O-N 3.3Å; T796-N800 PolarHBondContact O-ND2 2.98Å
797	N	32.6	Very low	30.4	Very low	105 Å²	105	116.1 Å²	116.1	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-95	-24.9	-174.3	-117.5	-24.2	0	0	0	114.1	F794 S795	F794-N797 PolarHBondContact O-N 3.49Å; S795-N797 VanDerWaalsContact C-N 3.32Å; S795-N797 PolarHBondContact O-N 3.5Å
798	I	28.2	Very low	30.6	Very low	102 Å²	102	119.6 Å²	119.6	52%	0.523	62%	0.617	S	S	.	*	H	α-helix	trans	-83.3	-34.8	-176.6	-62.2	177.4	0	0	0	112	N800 Q801 Y802	I798-N800 PolarHBondContact O-N 2.96Å; I798-Q801 PolarHBondContact O-N 3.32Å; I798-Q801 VanDerWaalsContact O-N 3.11Å; I798-Y802 PolarHBondContact O-N 3.22Å; I798-Y802 VanDerWaalsContact O-N 3.11Å
799	D	29	Very low	30.6	Very low	110 Å²	110	119.8 Å²	119.8	59%	0.588	62%	0.617	S	S	*	*	H	α-helix	trans	-64	-26.1	176.7	-75.7	-18	0	0	0	112.2	N803	D799-N803 PolarHBondContact O-ND2 3.08Å
800	N	34.5	Very low	30.5	Very low	114 Å²	114	118.8 Å²	118.8	61%	0.61	62%	0.615	S	S	*	*	H	α-helix	trans	-77.3	-29.4	175.5	-73.1	-29.2	0	0	0	113.4	T796 I798 T804	T796-N800 PolarHBondContact O-ND2 2.98Å; I798-N800 PolarHBondContact O-N 2.96Å; N800-T804 PolarHBondContact O-OG1 3.15Å
801	Q	30.1	Very low	30.4	Very low	147 Å²	147	116.8 Å²	116.8	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-85.6	-30.7	179.5	-82	-172.2	-16.7	0	0	113.6	I798 T804 S805	I798-Q801 PolarHBondContact O-N 3.32Å; I798-Q801 VanDerWaalsContact O-N 3.11Å; Q801-T804 WeakPolarHBondContact CA-OG1 3.43Å; Q801-T804 PolarHBondContact O-OG1 3.06Å; Q801-T804 VanDerWaalsContact O-OG1 3.08Å; Q801-S805 PolarHBondContact O-OG 2.99Å
802	Y	25.5	Very low	30.4	Very low	160 Å²	160	116.2 Å²	116.2	63%	0.627	62%	0.619	S	S	*	*	H	α-helix	trans	-73.5	-37.9	-179.5	-149.9	-94.6	0	0	0	112.2	I798 T804 S805 V806	I798-Y802 PolarHBondContact O-N 3.22Å; I798-Y802 VanDerWaalsContact O-N 3.11Å; Y802-T804 VanDerWaalsContact C-N 3.27Å; Y802-T804 PolarHBondContact O-N 3.07Å; Y802-S805 PolarHBondContact O-N 3.3Å; Y802-S805 PolarHBondContact O-OG 2.87Å; Y802-V806 HydrophobicContact CD1-CG2 3.87Å; Y802-V806 HydrophobicContact CE1-CG2 3.66Å; Y802-V806 PolarHBondContact O-N 3.18Å
803	N	32.5	Very low	30.3	Very low	117 Å²	117	113.6 Å²	113.6	63%	0.626	62%	0.619	S	S	*	*	H	α-helix	trans	-67	-25.1	178	-74.6	-37.5	0	0	0	113.6	D799 S807	D799-N803 PolarHBondContact O-ND2 3.08Å; N803-S807 PolarHBondContact O-OG 3.43Å; N803-S807 VanDerWaalsContact O-OG 3.05Å
804	T	34	Very low	30.4	Very low	86 Å²	86	113.5 Å²	113.5	53%	0.528	63%	0.625	S	S	.	*	H	α-helix	trans	-76.3	-30.1	175.1	15.2	0	0	0	0	112.7	N800 Q801 Y802 S807	N800-T804 PolarHBondContact O-OG1 3.15Å; Q801-T804 WeakPolarHBondContact CA-OG1 3.43Å; Q801-T804 PolarHBondContact O-OG1 3.06Å; Q801-T804 VanDerWaalsContact O-OG1 3.08Å; Y802-T804 VanDerWaalsContact C-N 3.27Å; Y802-T804 PolarHBondContact O-N 3.07Å; T804-S807 PolarHBondContact O-OG 3.39Å
805	S	27.7	Very low	30.1	Very low	52 Å²	52	112 Å²	112	36%	0.364	63%	0.632	S	S	.	*	H	α-helix	trans	-84.3	-31	-179.5	55.2	0	0	0	0	114.9	Q801 Y802 Q808	Q801-S805 PolarHBondContact O-OG 2.99Å; Y802-S805 PolarHBondContact O-N 3.3Å; Y802-S805 PolarHBondContact O-OG 2.87Å; S805-Q808 PolarHBondContact O-N 3.21Å
806	V	26.8	Very low	30	Very low	71 Å²	71	117 Å²	117	43%	0.43	65%	0.652	S	S	.	*	H	α-helix	trans	-77.4	-29	-179	178.1	0	0	0	0	112.2	Y802 Q808	Y802-V806 HydrophobicContact CD1-CG2 3.87Å; Y802-V806 HydrophobicContact CE1-CG2 3.66Å; Y802-V806 PolarHBondContact O-N 3.18Å; V806-Q808 PolarHBondContact O-N 3.41Å
807	S	36.8	Very low	29.5	Very low	85 Å²	85	120.9 Å²	120.9	59%	0.594	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-18.1	174	48.1	0	0	0	0	113.4	N803 T804	N803-S807 PolarHBondContact O-OG 3.43Å; N803-S807 VanDerWaalsContact O-OG 3.05Å; T804-S807 PolarHBondContact O-OG 3.39Å
808	Q	32.1	Very low	29	Very low	155 Å²	155	123.6 Å²	123.6	72%	0.724	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-12.3	-179.4	-74.2	-169.6	-21	0	0	115.1	S805 V806	S805-Q808 PolarHBondContact O-N 3.21Å; V806-Q808 PolarHBondContact O-N 3.41Å
809	I	30.1	Very low	29	Very low	138 Å²	138	127.3 Å²	127.3	71%	0.708	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-6.7	-173.2	-59.6	175.9	0	0	0	113	S811	I809-S811 VanDerWaalsContact C-N 3.35Å; I809-S811 PolarHBondContact O-N 2.87Å
810	Q	29.1	Very low	28.8	Very low	176 Å²	176	129.6 Å²	129.6	82%	0.822	70%	0.698	S	S	*	*	S	Bend	trans	-87.6	10	177	-74.2	-170.7	-13.8	0	0	115.3
811	S	28.4	Very low	28.3	Very low	92 Å²	92	129.1 Å²	129.1	64%	0.643	70%	0.704	S	S	*	*			trans	-129.8	48.5	-177.3	66.8	0	0	0	0	115.1	I809	I809-S811 VanDerWaalsContact C-N 3.35Å; I809-S811 PolarHBondContact O-N 2.87Å
812	T	27.7	Very low	28.1	Very low	121 Å²	121	125.7 Å²	125.7	74%	0.742	71%	0.708	S	S	*	*	S	Bend	trans	-147.5	93.6	161.6	51.2	0	0	0	0	113
813	S	28.8	Very low	28.1	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	72%	0.72	S	S	*	*			trans	58.8	127.2	145.5	57.8	0	0	0	0	122.8
814	P	33.5	Very low	27.9	Very low	129 Å²	129	131 Å²	131	84%	0.838	73%	0.732	S	S	*	*			trans	-96.3	120.4	177.2	36.1	-28.5	0	0	0	112.8
815	S	23.8	Very low	27.6	Very low	107 Å²	107	135.6 Å²	135.6	75%	0.748	75%	0.747	S	S	*	*			trans	-168.7	100.7	155.7	44.3	0	0	0	0	108.8
816	L	24.1	Very low	27.7	Very low	182 Å²	182	138.8 Å²	138.8	95%	0.953	77%	0.766	S	S	*	*			trans	167.5	54.5	151.1	-87.7	156.6	0	0	0	108.2
817	Q	23.1	Very low	27.9	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	78%	0.778	S	S	*	*			trans	-95.8	139.1	151	-77.6	-173.5	-5.6	0	0	107.1
818	Q	24	Very low	27.8	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	79%	0.786	S	S	*	*			trans	81.2	97.8	172.5	-54.6	177.3	-0	0	0	115.8
819	I	27.4	Very low	27.9	Very low	180 Å²	180	144.7 Å²	144.7	92%	0.923	79%	0.789	S	S	*	*				-149.2	139.1	114.5	-87.2	145.4	0	0	0	107.8
820	H	24.7	Very low	28.3	Very low	157 Å²	157	142.7 Å²	142.7	73%	0.727	78%	0.784	S	S	*	*			trans	-83	146.8	-154.9	-95	-83.6	0	0	0	115.9
821	S	24.2	Very low	28.5	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	76%	0.764	S	S	*	*			trans	14.3	114.4	137.8	56.9	0	0	0	0	119.7
822	G	25	Very low	28.6	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	76%	0.76	S	S	*	*			trans	-128.3	102.3	155.6	0	0	0	0	0	110.3
823	K	26.1	Very low	28.9	Very low	201 Å²	201	138.6 Å²	138.6	87%	0.874	76%	0.758	S	S	*	*			trans	-79.4	113.9	175.4	-73.8	176.6	176.8	175.4	0	109.6
824	H	27.9	Very low	29.1	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.875	76%	0.755	S	S	*	*			trans	-113.3	105.7	157.9	-83.3	-65.9	0	0	0	109
825	Q	29	Very low	28.9	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-76.5	130.9	169.1	-85.1	-179.5	-30.2	0	0	109.7
826	P	29.2	Very low	29.3	Very low	119 Å²	119	144.7 Å²	144.7	77%	0.773	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.7	132.5	173.3	31	-30	0	0	0	110.1
827	T	31.4	Very low	29.6	Very low	111 Å²	111	142.3 Å²	142.3	68%	0.681	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-78.7	135.7	-173.1	49.9	0	0	0	0	112.5	K829 T830	T827-K829 PolarHBondContact O-N 3.11Å; T827-T830 PolarHBondContact O-OG1 3.22Å
828	D	34.8	Very low	30	Very low	143 Å²	143	139 Å²	139	77%	0.765	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-3.4	-172.8	-93.6	-37.9	0	0	0	117	T830	D828-T830 VanDerWaalsContact C-N 3.3Å; D828-T830 PolarHBondContact O-N 3.11Å
829	K	33.9	Very low	30.2	Very low	180 Å²	180	138.3 Å²	138.3	78%	0.783	71%	0.705	S	S	*	*	H	α-helix	trans	-76.4	-14.4	179.7	-72.9	-172.4	176.7	-178.8	0	114.1	T827	T827-K829 PolarHBondContact O-N 3.11Å
830	T	38.3	Very low	30.3	Very low	97 Å²	97	134 Å²	134	60%	0.595	69%	0.687	S	S	*	*	H	α-helix	trans	-85.8	-23.6	177	51.1	0	0	0	0	113.6	T827 D828 R834	T827-T830 PolarHBondContact O-OG1 3.22Å; D828-T830 VanDerWaalsContact C-N 3.3Å; D828-T830 PolarHBondContact O-N 3.11Å; T830-R834 PolarHBondContact O-N 3.01Å
831	A	33.1	Very low	30.6	Very low	50 Å²	50	129.3 Å²	129.3	41%	0.413	67%	0.667	S	S	.	*	H	α-helix	trans	-71.8	-37.5	-179	0	0	0	0	0	112.9	R834 R835	A831-R834 PolarHBondContact O-N 3.41Å; A831-R835 PolarHBondContact O-N 2.87Å
832	N	31.7	Very low	30.8	Very low	104 Å²	104	128.9 Å²	128.9	56%	0.556	65%	0.649	S	S	*	*	H	α-helix	trans	-73	-34.1	178.1	-87.3	-13	0	0	0	113	R835 I836	N832-R835 PolarHBondContact O-N 2.76Å; N832-I836 WeakPolarHBondContact O-CG1 3.42Å; N832-I836 PolarHBondContact O-N 2.83Å
833	H	32.4	Very low	30.9	Very low	149 Å²	149	130 Å²	130	69%	0.69	65%	0.645	S	S	*	*	H	α-helix	trans	-65.4	-40.2	172.1	-89.1	78.2	0	0	0	111.5	I836 H837	H833-I836 PolarHBondContact O-N 3.08Å; H833-H837 WeakPolarHBondContact O-CB 3.34Å; H833-H837 PolarHBondContact O-N 3.49Å
834	R	32.9	Very low	30.9	Very low	191 Å²	191	126.9 Å²	126.9	72%	0.721	64%	0.638	S	S	*	*	H	α-helix	trans	-64.4	-38.1	172.6	-83.8	-174.9	177.9	178.2	0	113	T830 A831 H837 Q838	T830-R834 PolarHBondContact O-N 3.01Å; A831-R834 PolarHBondContact O-N 3.41Å; R834-H837 PolarHBondContact O-N 2.96Å; R834-Q838 VanDerWaalsContact O-CB 3.32Å; R834-Q838 WeakPolarHBondContact O-CB 3.3Å; R834-Q838 VanDerWaalsContact O-CG 3.26Å; R834-Q838 WeakPolarHBondContact O-CG 3.12Å; R834-Q838 PolarHBondContact O-N 3.27Å
835	R	30	Very low	31	Very low	169 Å²	169	126 Å²	126	64%	0.638	63%	0.628	S	S	*	*	H	α-helix	trans	-67.3	-42.9	176.9	-96.6	-178.3	171	160.1	-2.2	112.8	A831 N832 H837 Q838 M839	A831-R835 PolarHBondContact O-N 2.87Å; N832-R835 PolarHBondContact O-N 2.76Å; R835-H837 VanDerWaalsContact C-N 3.33Å; R835-Q838 PolarHBondContact O-N 3.21Å; R835-M839 WeakPolarHBondContact O-CB 3.32Å; R835-M839 VanDerWaalsContact O-CG 3.29Å; R835-M839 WeakPolarHBondContact O-CG 3.26Å; R835-M839 PolarHBondContact O-N 3.32Å
836	I	31.9	Very low	30.9	Very low	113 Å²	113	121.5 Å²	121.5	58%	0.579	61%	0.609	S	S	*	*	H	α-helix	trans	-66.9	-38	177.3	-66.8	169.5	0	0	0	110.6	N832 H833 M839 T840	N832-I836 WeakPolarHBondContact O-CG1 3.42Å; N832-I836 PolarHBondContact O-N 2.83Å; H833-I836 PolarHBondContact O-N 3.08Å; I836-M839 PolarHBondContact O-N 2.88Å; I836-T840 PolarHBondContact O-N 3.05Å; I836-T840 PolarHBondContact O-OG1 3.37Å
837	H	30.7	Very low	30.8	Very low	133 Å²	133	122.1 Å²	122.1	62%	0.616	62%	0.615	S	S	*	*	H	α-helix	trans	-70.9	-30.6	175.9	-141.9	-32.2	0	0	0	112.9	H833 R834 R835 T840 I841	H833-H837 WeakPolarHBondContact O-CB 3.34Å; H833-H837 PolarHBondContact O-N 3.49Å; R834-H837 PolarHBondContact O-N 2.96Å; R835-H837 VanDerWaalsContact C-N 3.33Å; H837-T840 WeakPolarHBondContact CA-OG1 3.33Å; H837-T840 PolarHBondContact O-OG1 3.42Å; H837-I841 VanDerWaalsContact O-CD1 3.32Å; H837-I841 WeakPolarHBondContact O-CD1 3.5Å; H837-I841 WeakPolarHBondContact O-CG1 3.36Å
838	Q	30.8	Very low	30.6	Very low	110 Å²	110	120.9 Å²	120.9	51%	0.514	61%	0.611	S	S	.	*	H	α-helix	trans	-75.1	-34.3	172.9	-78.2	177.2	-12.2	0	0	112.5	R834 R835 I841	R834-Q838 VanDerWaalsContact O-CB 3.32Å; R834-Q838 WeakPolarHBondContact O-CB 3.3Å; R834-Q838 VanDerWaalsContact O-CG 3.26Å; R834-Q838 WeakPolarHBondContact O-CG 3.12Å; R834-Q838 PolarHBondContact O-N 3.27Å; R835-Q838 PolarHBondContact O-N 3.21Å; Q838-I841 PolarHBondContact O-N 3.35Å
839	M	28.1	Very low	30.2	Very low	148 Å²	148	120.2 Å²	120.2	73%	0.729	61%	0.607	S	S	*	*	H	α-helix	trans	-72.1	-29.4	178.4	-73.1	179.9	85.4	0	0	112.9	R835 I836 I841	R835-M839 WeakPolarHBondContact O-CB 3.32Å; R835-M839 VanDerWaalsContact O-CG 3.29Å; R835-M839 WeakPolarHBondContact O-CG 3.26Å; R835-M839 PolarHBondContact O-N 3.32Å; I836-M839 PolarHBondContact O-N 2.88Å; M839-I841 VanDerWaalsContact C-N 3.31Å; M839-I841 PolarHBondContact O-N 3.27Å
840	T	30.7	Very low	30	Very low	89 Å²	89	120.4 Å²	120.4	55%	0.546	62%	0.623	S	S	.	*	H	α-helix	trans	-73.2	-20.5	175.1	23.6	0	0	0	0	113.6	I836 H837	I836-T840 PolarHBondContact O-N 3.05Å; I836-T840 PolarHBondContact O-OG1 3.37Å; H837-T840 WeakPolarHBondContact CA-OG1 3.33Å; H837-T840 PolarHBondContact O-OG1 3.42Å
841	I	29.8	Very low	29.6	Very low	59 Å²	59	121.6 Å²	121.6	30%	0.303	62%	0.624	S	S	.	*	H	α-helix	trans	-80.6	-21.2	178.8	-65.5	166.9	0	0	0	111.5	H837 Q838 M839	H837-I841 VanDerWaalsContact O-CD1 3.32Å; H837-I841 WeakPolarHBondContact O-CD1 3.5Å; H837-I841 WeakPolarHBondContact O-CG1 3.36Å; Q838-I841 PolarHBondContact O-N 3.35Å; M839-I841 VanDerWaalsContact C-N 3.31Å; M839-I841 PolarHBondContact O-N 3.27Å
842	W	28.5	Very low	29.4	Very low	95 Å²	95	125.3 Å²	125.3	36%	0.36	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-84.4	-19	-167.5	-82.6	41.2	0	0	0	115.4	N844	W842-N844 PolarHBondContact O-N 3.45Å
843	S	27.8	Very low	29.3	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-73	-15	179.8	53.5	0	0	0	0	113.9
844	N	27	Very low	29.1	Very low	134 Å²	134	125.2 Å²	125.2	72%	0.717	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-96	-9.4	-173.2	-70.8	-6.7	0	0	0	115.2	W842	W842-N844 PolarHBondContact O-N 3.45Å
845	Y	29.2	Very low	28.9	Very low	172 Å²	172	121.1 Å²	121.1	68%	0.675	63%	0.632	S	S	*	*	S	Bend	trans	-115	12.1	-166.8	-78.1	-77.9	0	0	0	115.9
846	L	26.4	Very low	28.8	Very low	86 Å²	86	117.9 Å²	117.9	45%	0.45	63%	0.631	S	S	.	*			trans	-114.9	19.7	-170	-89.6	148.9	0	0	0	116.9	L715	L715-L846 HydrophobicContact CD1-CD1 3.21Å; L715-L846 HydrophobicContact CD1-CD2 3.13Å; L715-L846 HydrophobicContact CD1-CG 3.7Å; L715-L846 HydrophobicContact CD2-CD1 3.5Å; L715-L846 HydrophobicContact CG-CD1 3.96Å
847	C	27.1	Very low	28.6	Very low	132 Å²	132	118.2 Å²	118.2	89%	0.892	64%	0.635	S	S	*	*			trans	-110.7	69	173.9	-83.3	0	0	0	0	112.1
848	S	26.8	Very low	28.5	Very low	85 Å²	85	117.1 Å²	117.1	59%	0.594	64%	0.637	S	S	*	*	S	Bend	trans	-128.6	1.1	166.4	69.6	0	0	0	0	116.5
849	D	28.1	Very low	28.3	Very low	130 Å²	130	117.7 Å²	117.7	70%	0.695	65%	0.647	S	S	*	*			trans	-133	25.5	-179	-76	-37.6	0	0	0	115.2
850	V	29.7	Very low	28.3	Very low	183 Å²	183	114.9 Å²	114.9	100%	1.109	64%	0.639	S	S	*	*			trans	-133	0	165.6	-172.3	0	0	0	0	108.4

Retrieved 850 of 850 residues in 666 ms (Link to these results)

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