A0A5K4F1L0_SCHMA Loading...

Serine/threonine-protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F1L0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,280 aa.

						>A0A5K4F1L0_SCHMA|A0A5K4F1L0
MNDLSKINPLLKRPKVKELEKSNRISKIILPGINHRDNICTNLKIISSVKHNLNAKDFSSVTNKLDVNSVSRVAVNNGQLIGIDCNTNKTLNNKNTIKITKILRLLPSDNQKYGGRKITVVRCNPGGKGRTSLTVMMARRSVHTLGQVMCELTEAFGSRWHNDPIRNLYSLTGREIKSVNELFRKDKVFIASGLHKMFGNIHIELNKSNNVDSNTTRANNYINNCIHQSMSCNNCQKSFHHGFLSNQDKNGNIVRSNATELKPEDIRAILSEFWPDHPDPSSVVYQWERRLRNRGFGMKTSQQFDVNKHLLFEIPRPKQKLSLKTNNIISNIKYSSNESFIENEKKDSGFDELTINNNILPKIDEEQIHGEQSILFTNNSINFMKDQPNKLSSVESHSKLLKQVNSPQHLEYVKPNHNYSNFKLDSSSPSTIEENNFFHSEKFFEELSLTNKSSIKLHENTFNTKRLLKPQVLKPDNINNDMNNTLLHANSVTSFSPFYYSVYQQNLSKNQQKSYQIPVYPFHSPFLLSTSLFQQQHRNQQLKKSDSLSKLLSRYHNCLQIGERVLQRTENRRHELAMKENKLPENHHVDKVVNRNSLEIKTHEKNLSKLTNYQEDKVQNLNNNPTKLTMSTYTTTIDNNDAQINKIGPHTGESKQHSSKLTDQSFIAQQFKLNQQLKTNTSVTNNNTSSITKNKDSNTSSVINKTQGNLSNITFGKQSHQTLQSNHNVKRNDNTNPCNNKGFIEKGKSLVDINKPVLINDKSKIDENHIINDQDNNIQIETKLQKMDNVSDATKSDHSPGIQKEISSEKKSLPAERAVLNAQQNSPKLPMNKTYDKDVNQIPKENNNDITRCNANVNITTQQNLNSNAPDVVTNNIITTAATNNNHTSSVKLLDVSDGAQQKLIGNCFTVSGLKKPNNDKLKSVYTAVGVTYVSDPDYLSKRYQIGRKLGDGNFAIVKLGKRRDTNDQYALKIIEKSKLTGKEAMLLNEIHILHHCRHPNIVRLYEEFETASEIWLVMEFIKDGDLFDGITQATKFTEPIAAGIVSDLASALFYLHCRSIVHRDLKPENILLLRQKNGQIRVKLADFGLALVVKKSMYTVCGTPTYIAPEILEESGYGLEVDMWALGIITYIMLCGFAPFRSTDRRQSKLFESIKRGHFVFLSPYWDNISSHAKDLITALLVITPKSRLTARETLAHPWVFGSGLPNLSEEFEKRRLDYRNELEKKHNEFKQSMNEKNPIDLYDKKNNNNKDNVNQNNKFIDMKKLELPRITKIKELYN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	30.7	Very low	225 Å²	225	152.7 Å²	152.7	100%	1.108	80%	0.803	S	S	*	*				0	86.9	0	-64.4	175.9	-179.1	0	0	105.9
2	N	27.1	Very low	30.6	Very low	155 Å²	155	157.7 Å²	157.7	83%	0.829	81%	0.813	S	S	*	*				76.6	118.7	90.9	-59.1	17.8	0	0	0	108.3
3	D	30.8	Very low	30.5	Very low	131 Å²	131	163.8 Å²	163.8	70%	0.701	82%	0.82	S	S	*	*			cis	-133.4	153.3	35.8	-138.7	-60.4	0	0	0	115.2	S5	D3-S5 WeakPolarHBondContact OD1-CB 3.45Å; D3-S5 PolarHBondContact OD1-OG 3.37Å
4	L	30.6	Very low	30.4	Very low	171 Å²	171	160.4 Å²	160.4	90%	0.895	81%	0.814	S	S	*	*			trans	-139.7	61.5	-174.3	-120.6	176.7	0	0	0	110.1
5	S	28.4	Very low	30.2	Very low	68 Å²	68	163 Å²	163	48%	0.476	82%	0.818	S	S	.	*			trans	-134.3	6.1	-158.9	50.8	0	0	0	0	118.3	D3	D3-S5 WeakPolarHBondContact OD1-CB 3.45Å; D3-S5 PolarHBondContact OD1-OG 3.37Å
6	K	36.5	Very low	29.8	Very low	202 Å²	202	160.9 Å²	160.9	88%	0.878	82%	0.816	S	S	*	*			trans	-144.1	81.4	176.1	-62.4	-177.7	-175.1	175	0	110.1
7	I	29.6	Very low	29.7	Very low	145 Å²	145	163.2 Å²	163.2	74%	0.744	82%	0.819	S	S	*	*			cis	72.6	113	38.9	-57.9	179.6	0	0	0	113.4
8	N	35.6	Very low	29.4	Very low	152 Å²	152	163.2 Å²	163.2	81%	0.813	82%	0.816	S	S	*	*			trans	-54.8	150.1	171.1	-91.3	-54.6	0	0	0	112.3
9	P	34.4	Very low	29.2	Very low	108 Å²	108	163.2 Å²	163.2	70%	0.701	82%	0.818	S	S	*	*				-149.1	-178.4	83.1	40.1	-19.4	0	0	0	113.5
10	L	27.6	Very low	28.9	Very low	162 Å²	162	164 Å²	164	85%	0.848	82%	0.819	S	S	*	*			cis	-138.1	136.7	20.7	-81.4	163.3	0	0	0	114.3
11	L	25.6	Very low	28.9	Very low	161 Å²	161	165.6 Å²	165.6	84%	0.843	82%	0.821	S	S	*	*			trans	-53.1	140.1	154.8	-71	142.4	0	0	0	113.4
12	K	29.2	Very low	28.6	Very low	212 Å²	212	159.6 Å²	159.6	92%	0.922	80%	0.801	S	S	*	*			trans	-162.9	113	141.3	-110.9	162.2	-172.7	176.5	0	112.5
13	R	28.9	Very low	28.8	Very low	238 Å²	238	157.9 Å²	157.9	90%	0.898	79%	0.792	S	S	*	*			trans	-81.1	164.4	160.1	-66.8	178.7	171.3	176.8	-3.5	109
14	P	30.2	Very low	28.7	Very low	115 Å²	115	162.7 Å²	162.7	75%	0.747	80%	0.8	S	S	*	*				-148.9	149.4	99.2	35.8	-18.5	0	0	0	117.8
15	K	26.5	Very low	28.6	Very low	200 Å²	200	161.4 Å²	161.4	87%	0.87	79%	0.793	S	S	*	*			trans	56.3	97.2	139.7	-62.3	179.6	180	-177.3	0	121.4
16	V	24.8	Very low	28.5	Very low	130 Å²	130	162.7 Å²	162.7	79%	0.788	80%	0.802	S	S	*	*				-2.3	131.7	129.7	-176.8	0	0	0	0	117.9
17	K	28	Very low	27.9	Very low	199 Å²	199	162 Å²	162	87%	0.865	80%	0.799	S	S	*	*			trans	-143.4	153.1	130.5	-85.5	-158.7	174	-173.6	0	109.4
18	E	23.7	Very low	27.7	Very low	163 Å²	163	162 Å²	162	76%	0.762	80%	0.799	S	S	*	*			trans	-80.5	153.5	-174.3	-52.5	107	126.7	0	0	114.4
19	L	25.1	Very low	27.1	Very low	164 Å²	164	161.6 Å²	161.6	86%	0.859	80%	0.795	S	S	*	*				-156.5	135.3	122.1	-138.7	74.5	0	0	0	111.5
20	E	24.3	Very low	26.7	Very low	179 Å²	179	162.3 Å²	162.3	84%	0.836	79%	0.793	S	S	*	*			trans	-80.3	138	-179.6	-56.2	-176.3	113	0	0	112.8
21	K	28.4	Very low	26.6	Very low	198 Å²	198	160.9 Å²	160.9	86%	0.861	79%	0.793	S	S	*	*			trans	-162.9	103.9	149.3	-105.6	139.1	-168	170.9	0	111.7	N23	K21-N23 PolarHBondContact O-N 3.16Å
22	S	26	Very low	26.6	Very low	99 Å²	99	156.7 Å²	156.7	69%	0.692	79%	0.789	S	S	*	*			trans	-70.1	118.6	-177.7	154.7	0	0	0	0	113.1
23	N	31	Very low	26.5	Very low	119 Å²	119	151 Å²	151	64%	0.636	77%	0.767	S	S	*	*			trans	-125.5	113.5	151.6	-96.6	-36.1	0	0	0	109.3	K21 I25	K21-N23 PolarHBondContact O-N 3.16Å; N23-I25 PolarHBondContact O-N 3.42Å
24	R	28.5	Very low	26.4	Very low	232 Å²	232	145.2 Å²	145.2	88%	0.875	75%	0.754	S	S	*	*			trans	-77.3	91.6	-172.7	-71.7	-178.4	174.7	177.2	-2.8	112	S26	R24-S26 PolarHBondContact O-N 3.19Å
25	I	27.9	Very low	26.3	Very low	143 Å²	143	145.5 Å²	145.5	73%	0.733	75%	0.746	S	S	*	*			trans	-73.8	90.6	166.1	-56.3	177.9	0	0	0	108.9	N23 K27	N23-I25 PolarHBondContact O-N 3.42Å; I25-K27 VanDerWaalsContact C-N 3.3Å; I25-K27 HydrophobicContact CG2-CG 4.42Å; I25-K27 PolarHBondContact O-N 2.85Å
26	S	26.5	Very low	26.4	Very low	95 Å²	95	144.3 Å²	144.3	66%	0.664	74%	0.736	S	S	*	*			trans	-76.2	76.2	178.2	60.1	0	0	0	0	112.1	R24 I28	R24-S26 PolarHBondContact O-N 3.19Å; S26-I28 PolarHBondContact O-N 3.06Å
27	K	24.6	Very low	26.5	Very low	187 Å²	187	142.7 Å²	142.7	81%	0.813	72%	0.722	S	S	*	*			trans	-66.5	105.2	158.7	-76.2	-178.9	177.9	176.6	0	108.1	I25	I25-K27 VanDerWaalsContact C-N 3.3Å; I25-K27 HydrophobicContact CG2-CG 4.42Å; I25-K27 PolarHBondContact O-N 2.85Å
28	I	24.6	Very low	26.5	Very low	147 Å²	147	139.6 Å²	139.6	75%	0.754	72%	0.715	S	S	*	*			trans	-114.4	130.4	174.9	-62.1	176.9	0	0	0	108.2	S26	S26-I28 PolarHBondContact O-N 3.06Å
29	I	23.7	Very low	26.5	Very low	142 Å²	142	139 Å²	139	73%	0.728	72%	0.716	S	S	*	*			trans	-128.3	108	-173.4	-62	177.5	0	0	0	109.1
30	L	25.3	Very low	26.4	Very low	124 Å²	124	136.8 Å²	136.8	65%	0.649	71%	0.713	S	S	*	*			trans	62.3	176.1	165.3	-51	174.5	0	0	0	113.2	I33	L30-I33 HydrophobicContact CD1-CD1 3.83Å; L30-I33 HydrophobicContact CD1-CG1 4.14Å
31	P	26.2	Very low	26.5	Very low	131 Å²	131	134.7 Å²	134.7	85%	0.851	71%	0.712	S	S	*	*			cis	-103.1	164	29.8	39.4	-34.7	0	0	0	115.4
32	G	26.2	Very low	26.2	Very low	74 Å²	74	132.3 Å²	132.3	76%	0.763	71%	0.709	S	S	*	*			trans	161.3	42.9	176.9	0	0	0	0	0	112.8
33	I	26.3	Very low	26.1	Very low	92 Å²	92	134.6 Å²	134.6	47%	0.472	71%	0.713	S	S	.	*			trans	-110.6	114.3	-160.4	-53.4	171.6	0	0	0	111.7	L30 H35	L30-I33 HydrophobicContact CD1-CD1 3.83Å; L30-I33 HydrophobicContact CD1-CG1 4.14Å; I33-H35 WeakPolarHBondContact CG2-CD2 3.43Å
34	N	27.1	Very low	25.7	Very low	117 Å²	117	137.3 Å²	137.3	63%	0.626	72%	0.719	S	S	*	*			trans	-106	121.2	144.1	-95	38	0	0	0	107.5	E580 K582	N34-E580 VanDerWaalsContact ND2-CD 3.33Å; N34-E580 PolarHBondContact ND2-OE1 2.96Å; N34-E580 PolarHBondContact ND2-OE2 2.92Å; N34-K582 VanDerWaalsContact CG-NZ 3.3Å; N34-K582 PolarHBondContact OD1-NZ 3.03Å
35	H	26.9	Very low	25.4	Very low	121 Å²	121	132.7 Å²	132.7	56%	0.56	71%	0.71	S	S	*	*			trans	-78.2	129.8	175.6	-98.4	-91.1	0	0	0	110.2	I33 D37	I33-H35 WeakPolarHBondContact CG2-CD2 3.43Å; H35-D37 IonicContact CE1-OD1 2.96Å; H35-D37 IonicContact CG-OD1 3.59Å; H35-D37 IonicContact ND1-OD1 2.76Å; H35-D37 PolarHBondContact ND1-OD1 3.31Å
36	R	28.7	Very low	25.4	Very low	175 Å²	175	133 Å²	133	66%	0.66	71%	0.712	S	S	*	*				-179.9	141.1	120.4	-100.2	172.1	-178.4	153.7	6.7	111.5	K579	R36-K579 PolarHBondContact NH1-O 3.28Å; R36-K579 PolarHBondContact NH2-O 3.23Å
37	D	27.2	Very low	25.2	Very low	95 Å²	95	133.3 Å²	133.3	51%	0.508	71%	0.714	S	S	.	*			cis	-164.8	166.3	-41.3	-101.6	-20.1	0	0	0	106.6	H35	H35-D37 IonicContact CE1-OD1 2.96Å; H35-D37 IonicContact CG-OD1 3.59Å; H35-D37 IonicContact ND1-OD1 2.76Å; H35-D37 PolarHBondContact ND1-OD1 3.31Å
38	N	27.6	Very low	25.2	Very low	134 Å²	134	129.5 Å²	129.5	72%	0.717	71%	0.711	S	S	*	*			trans	57.2	119.5	161.7	-61	-21.1	0	0	0	117.9
39	I	25	Very low	25.4	Very low	150 Å²	150	128.8 Å²	128.8	77%	0.769	71%	0.713	S	S	*	*				53.9	110.4	81	-59.5	177.9	0	0	0	111.7	T41	I39-T41 PolarHBondContact O-N 2.82Å
40	C	23.2	Very low	25.5	Very low	119 Å²	119	127 Å²	127	80%	0.804	70%	0.7	S	S	*	*			trans	-50.7	116.3	-177.7	-164.6	0	0	0	0	113.9
41	T	25.5	Very low	25.7	Very low	134 Å²	134	126.5 Å²	126.5	82%	0.822	69%	0.694	S	S	*	*			trans	-134.3	160.4	147.1	35.8	0	0	0	0	109.7	I39	I39-T41 PolarHBondContact O-N 2.82Å
42	N	22.9	Very low	25.8	Very low	149 Å²	149	125.5 Å²	125.5	80%	0.797	68%	0.682	S	S	*	*			trans	-73.8	173.5	-162	-65.4	-57.9	0	0	0	115.2
43	L	23.3	Very low	25.9	Very low	146 Å²	146	130.4 Å²	130.4	76%	0.764	69%	0.69	S	S	*	*			trans	95.7	102.3	156	-59.6	163.8	0	0	0	119.4
44	K	22.7	Very low	26.1	Very low	176 Å²	176	133.4 Å²	133.4	77%	0.765	71%	0.706	S	S	*	*				68.4	133.3	120.4	-80	-176.2	177.6	178	0	122
45	I	23.2	Very low	26.1	Very low	135 Å²	135	133 Å²	133	69%	0.692	72%	0.719	S	S	*	*			trans	92.4	132.5	132.6	-76	170.4	0	0	0	120
46	I	26	Very low	26.2	Very low	149 Å²	149	135.7 Å²	135.7	76%	0.764	73%	0.73	S	S	*	*			trans	61.1	114.9	168.4	-70.5	158.8	0	0	0	115.9
47	S	23.5	Very low	26.2	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	73%	0.732	S	S	*	*			cis	84.1	140.2	40.7	-165.3	0	0	0	0	114.8
48	S	24.5	Very low	26.3	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	75%	0.753	S	S	*	*			trans	59.4	145.6	-175.9	42.4	0	0	0	0	115.3
49	V	29.5	Very low	26.3	Very low	133 Å²	133	138.6 Å²	138.6	81%	0.806	76%	0.757	S	S	*	*			cis	-132.6	146	19.6	171.8	0	0	0	0	110.7
50	K	25.2	Very low	26.4	Very low	104 Å²	104	136.2 Å²	136.2	45%	0.452	75%	0.754	S	S	.	*			trans	-102.8	149.8	156.5	-63.7	-169.6	-174.8	71	0	109.1	S978	K50-S978 WeakPolarHBondContact CD-O 3.45Å; K50-S978 WeakPolarHBondContact CE-O 3.41Å; K50-S978 VanDerWaalsContact NZ-C 3.31Å; K50-S978 PolarHBondContact NZ-O 3.11Å; K50-S978 PolarHBondContact NZ-OG 3.39Å; K50-S978 VanDerWaalsContact NZ-OG 3.08Å
51	H	28.7	Very low	26.7	Very low	113 Å²	113	137 Å²	137	52%	0.523	76%	0.755	S	S	.	*			trans	-177.5	149.4	131.8	-101.9	-64.4	0	0	0	114	T981	H51-T981 PolarHBondContact CE1-O 2.82Å; H51-T981 VanDerWaalsContact CE1-O 3.24Å; H51-T981 VanDerWaalsContact NE2-CG2 3.33Å; H51-T981 WeakPolarHBondContact NE2-CG2 3.5Å
52	N	28.2	Very low	26.8	Very low	110 Å²	110	136.6 Å²	136.6	59%	0.588	75%	0.752	S	S	*	*			trans	38.7	100.6	142.7	-54.7	-1.7	0	0	0	119.9
53	L	29.3	Very low	27	Very low	178 Å²	178	135.7 Å²	135.7	93%	0.932	75%	0.748	S	S	*	*				-127.9	124.5	128.6	-75.7	176.7	0	0	0	108.1
54	N	29.6	Very low	27.2	Very low	154 Å²	154	138.7 Å²	138.7	82%	0.824	75%	0.754	S	S	*	*			trans	-91	143.9	170.3	-89.5	-23.1	0	0	0	108.9	K56	N54-K56 PolarHBondContact O-N 2.98Å
55	A	27.9	Very low	27.6	Very low	108 Å²	108	138.8 Å²	138.8	89%	0.893	76%	0.762	S	S	*	*	S	Bend	trans	-72.3	97.1	174.4	0	0	0	0	0	110.9
56	K	28.9	Very low	27.7	Very low	179 Å²	179	138.5 Å²	138.5	78%	0.778	76%	0.762	S	S	*	*			trans	-133.3	169	149.6	-73.2	-160.5	169.6	-162.5	0	107.8	N54	N54-K56 PolarHBondContact O-N 2.98Å
57	D	28.7	Very low	27.9	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	76%	0.761	S	S	*	*			trans	66.6	60.7	170.2	-46.5	-24.9	0	0	0	115.7
58	F	29.6	Very low	28	Very low	214 Å²	214	139.4 Å²	139.4	94%	0.939	77%	0.765	S	S	*	*			trans	-132.1	53.6	160.1	-101.1	-73.3	0	0	0	112.4
59	S	26	Very low	28.2	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	76%	0.763	S	S	*	*	S	Bend	trans	-138.3	35.9	176.2	53.7	0	0	0	0	113.1
60	S	29.1	Very low	28.3	Very low	100 Å²	100	139 Å²	139	70%	0.699	76%	0.762	S	S	*	*			trans	-152.6	172.1	167.6	62.1	0	0	0	0	111.5
61	V	29.3	Very low	28.6	Very low	135 Å²	135	138.6 Å²	138.6	82%	0.818	77%	0.772	S	S	*	*			trans	65.1	72.4	179.6	-162.3	0	0	0	0	115.1
62	T	26.8	Very low	28.4	Very low	126 Å²	126	144.8 Å²	144.8	77%	0.773	79%	0.791	S	S	*	*			trans	-98.8	166.1	137.2	48.9	0	0	0	0	109.5
63	N	27.8	Very low	28.4	Very low	130 Å²	130	146.8 Å²	146.8	70%	0.695	81%	0.807	S	S	*	*			trans	68.6	93.7	175.5	-57.6	-9.5	0	0	0	117.4
64	K	27.2	Very low	28.4	Very low	208 Å²	208	142.5 Å²	142.5	90%	0.904	80%	0.798	S	S	*	*				-175.8	117.3	124	-103	171.2	-177.2	-178.4	0	110.7
65	L	29.8	Very low	28.5	Very low	178 Å²	178	141.6 Å²	141.6	93%	0.932	80%	0.797	S	S	*	*			trans	176.9	117.2	139.8	-99.6	163.8	0	0	0	109
66	D	26.6	Very low	28.7	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	79%	0.788	S	S	*	*			trans	-118.9	138.5	175	168.1	38.9	0	0	0	108.3	N68	D66-N68 PolarHBondContact OD1-ND2 3.34Å
67	V	30.9	Very low	28.7	Very low	120 Å²	120	141.4 Å²	141.4	73%	0.727	79%	0.79	S	S	*	*			trans	-155.1	134.5	149.6	-162.6	0	0	0	0	109
68	N	25.1	Very low	28.8	Very low	150 Å²	150	138.6 Å²	138.6	80%	0.802	79%	0.793	S	S	*	*			trans	-108.2	117.9	164.5	-78.7	-89.2	0	0	0	111.2	D66	D66-N68 PolarHBondContact OD1-ND2 3.34Å
69	S	29.2	Very low	28.8	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	79%	0.787	S	S	*	*			trans	-170.5	138.5	166.8	55.3	0	0	0	0	107.2
70	V	31.2	Very low	28.7	Very low	129 Å²	129	137.6 Å²	137.6	78%	0.782	78%	0.782	S	S	*	*			cis	-144.4	163.2	40.3	167.7	0	0	0	0	111.8
71	S	30.6	Very low	28.5	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	79%	0.788	S	S	*	*			trans	-41.2	141.5	173.6	37.7	0	0	0	0	116.4
72	R	25.4	Very low	28.3	Very low	242 Å²	242	136.9 Å²	136.9	91%	0.913	78%	0.778	S	S	*	*				63.8	108.6	65.5	-74.5	-169.7	-179.1	-175.4	1.9	115.7
73	V	28.1	Very low	28.3	Very low	152 Å²	152	139.3 Å²	139.3	92%	0.921	78%	0.784	S	S	*	*			trans	-149.3	155.3	133.8	-177.5	0	0	0	0	107.1
74	A	27.7	Very low	28.1	Very low	89 Å²	89	140.5 Å²	140.5	74%	0.736	79%	0.791	S	S	*	*			trans	-146.7	169.4	177.8	0	0	0	0	0	111.1
75	V	33.5	Very low	28	Very low	134 Å²	134	135.9 Å²	135.9	81%	0.812	78%	0.783	S	S	*	*			trans	-171.6	119.1	148.4	136.5	0	0	0	0	113.5
76	N	31.3	Very low	27.8	Very low	130 Å²	130	133.9 Å²	133.9	70%	0.695	77%	0.774	S	S	*	*			trans	36.4	119	140.8	-52	-8	0	0	0	125.8
77	N	29.7	Very low	27.7	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	78%	0.777	S	S	*	*				64.5	126.3	114.2	-52.9	-8.5	0	0	0	125.2
78	G	30.7	Very low	27.4	Very low	77 Å²	77	135.6 Å²	135.6	79%	0.794	78%	0.783	S	S	*	*			trans	90.7	154.2	143.4	0	0	0	0	0	118.5
79	Q	28.2	Very low	27.5	Very low	175 Å²	175	138.3 Å²	138.3	82%	0.818	79%	0.788	S	S	*	*			cis	-162.7	144.2	-24.3	-141.7	-174.1	-42.7	0	0	111.1
80	L	24.8	Very low	27.3	Very low	133 Å²	133	140.1 Å²	140.1	70%	0.696	80%	0.795	S	S	*	*			trans	65	133.1	157.8	-71.9	162.7	0	0	0	123.6
81	I	25.2	Very low	27	Very low	162 Å²	162	141.5 Å²	141.5	83%	0.831	80%	0.797	S	S	*	*			trans	63.6	125.3	143.1	-59.7	163.6	0	0	0	120.8
82	G	24.3	Very low	26.9	Very low	59 Å²	59	142.9 Å²	142.9	61%	0.608	80%	0.797	S	S	*	*			trans	139	119.6	132.1	0	0	0	0	0	119.1
83	I	27.4	Very low	27	Very low	177 Å²	177	138.4 Å²	138.4	91%	0.908	79%	0.791	S	S	*	*			trans	73.4	141	151.9	-53.8	172	0	0	0	117.5
84	D	23.5	Very low	27	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	79%	0.785	S	S	*	*			trans	-76.6	140.6	-178.7	-74.2	-74.4	0	0	0	114.2
85	C	24.6	Very low	27.1	Very low	111 Å²	111	140.7 Å²	140.7	75%	0.75	78%	0.777	S	S	*	*				-172.2	153.1	109.9	53.9	0	0	0	0	114.3
86	N	25.3	Very low	26.8	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	77%	0.769	S	S	*	*			trans	50.9	107.4	150.3	-66.4	-23	0	0	0	122.2
87	T	24.9	Very low	26.8	Very low	125 Å²	125	139.8 Å²	139.8	77%	0.767	77%	0.77	S	S	*	*				60.1	59.6	129.4	63.4	0	0	0	0	119.9
88	N	25.1	Very low	26.8	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	76%	0.763	S	S	*	*			trans	-154.5	75	149.9	-99.5	-40.1	0	0	0	112.7
89	K	26.1	Very low	26.8	Very low	206 Å²	206	142.3 Å²	142.3	90%	0.896	76%	0.757	S	S	*	*			trans	-99.4	94.9	172.2	-86.6	-175.9	175.8	173.3	0	112.4	L91	K89-L91 PolarHBondContact O-N 3.44Å
90	T	25	Very low	26.8	Very low	140 Å²	140	139.9 Å²	139.9	86%	0.859	75%	0.754	S	S	*	*			trans	-47.1	108.7	171.2	-48.3	0	0	0	0	112.3
91	L	25.3	Very low	27.2	Very low	157 Å²	157	141.4 Å²	141.4	82%	0.822	76%	0.755	S	S	*	*			trans	-111.1	85.7	-175.4	-154.5	80.2	0	0	0	113.4	K89	K89-L91 PolarHBondContact O-N 3.44Å
92	N	28.6	Very low	27.7	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	73%	0.729	S	S	*	*			trans	46.1	103.6	157.2	-73.7	-37.8	0	0	0	118.9	K94	N92-K94 PolarHBondContact O-N 2.94Å
93	N	27	Very low	27.9	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	60.6	169.8	-79.5	-29.9	0	0	0	114.2
94	K	29.7	Very low	28.3	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.787	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-10.6	172.5	-73.2	-176.4	176.2	175.9	0	114.5	N92	N92-K94 PolarHBondContact O-N 2.94Å
95	N	28.6	Very low	29	Very low	108 Å²	108	130 Å²	130	58%	0.578	67%	0.674	S	S	*	*	S	Bend	trans	-95.7	-21.7	178.5	-75.4	-33.3	0	0	0	114.3	I97	N95-I97 VanDerWaalsContact C-N 3.26Å; N95-I97 PolarHBondContact O-N 3.35Å
96	T	28.5	Very low	29.4	Very low	105 Å²	105	128.8 Å²	128.8	64%	0.644	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-17.2	-171.6	-30.8	0	0	0	0	114.5
97	I	29.3	Very low	29.8	Very low	141 Å²	141	125.4 Å²	125.4	72%	0.723	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-6	-171.1	-64.8	173.4	0	0	0	113.1	N95	N95-I97 VanDerWaalsContact C-N 3.26Å; N95-I97 PolarHBondContact O-N 3.35Å
98	K	29.7	Very low	30.4	Very low	151 Å²	151	125.6 Å²	125.6	66%	0.657	65%	0.652	S	S	*	*	S	Bend	trans	-84.5	-19.9	-173.3	-79.3	-175.1	174	179	0	116.1	T100 K101	K98-T100 PolarHBondContact O-N 3.1Å; K98-K101 PolarHBondContact O-N 2.87Å
99	I	30.8	Very low	31	Very low	132 Å²	132	123.3 Å²	123.3	68%	0.677	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-71	-33.4	-167.3	-62.1	178.1	0	0	0	112.5	K101 I102	I99-K101 PolarHBondContact O-N 3.2Å; I99-I102 PolarHBondContact O-N 3.04Å
100	T	29.8	Very low	31.3	Very low	123 Å²	123	122.2 Å²	122.2	76%	0.755	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-67.3	-6.3	-178.4	-19.5	0	0	0	0	114.9	K98	K98-T100 PolarHBondContact O-N 3.1Å
101	K	31.7	Very low	31.9	Very low	166 Å²	166	120 Å²	120	72%	0.722	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-98.6	-6.4	179.3	-80.1	179.5	176	171.9	0	114.7	K98 I99	K98-K101 PolarHBondContact O-N 2.87Å; I99-K101 PolarHBondContact O-N 3.2Å
102	I	35.7	Very low	32.4	Very low	54 Å²	54	123.1 Å²	123.1	28%	0.277	63%	0.63	S	S	.	*	S	Bend	trans	-105.1	40.1	-174.2	-37.4	-179.2	0	0	0	111.5	I99 A155	I99-I102 PolarHBondContact O-N 3.04Å; I102-A155 HydrophobicContact CG2-CB 4Å
103	L	29.9	Very low	33.1	Very low	130 Å²	130	120.5 Å²	120.5	68%	0.681	61%	0.611	S	S	*	*			trans	-125.2	27	179	-70.2	174.6	0	0	0	113.1	L105	L103-L105 PolarHBondContact O-N 3.13Å
104	R	35.1	Very low	34.2	Very low	111 Å²	111	117.3 Å²	117.3	42%	0.419	61%	0.613	S	S	.	*			trans	-84.3	51.9	175.8	-64.2	-161	-170.4	119.6	1.6	113.3	D1145 R1146	R104-D1145 PolarHBondContact NH1-O 3.2Å; R104-R1146 VanDerWaalsContact NH1-C 3.28Å; R104-R1146 VanDerWaalsContact NH1-CB 3.28Å; R104-R1146 PolarHBondContact NH1-O 2.58Å; R104-R1146 PolarHBondContact O-NH1 3.08Å
105	L	37.6	Very low	35.8	Very low	18 Å²	18	109.9 Å²	109.9	9%	0.094	59%	0.589	C	S	.	*	S	Bend	trans	-114.4	17.7	173.1	-71	166.4	0	0	0	112.3	L103 M136 M137 A138 S141 V142	L103-L105 PolarHBondContact O-N 3.13Å; L105-M136 WeakPolarHBondContact CB-O 3.47Å; L105-M136 VanDerWaalsContact CD1-O 3.29Å; L105-M136 WeakPolarHBondContact CD1-O 3.29Å; L105-M137 HydrophobicContact CD1-CG 4.15Å; L105-A138 VanDerWaalsContact O-CB 3.28Å; L105-A138 WeakPolarHBondContact O-CB 3.47Å; L105-A138 PolarHBondContact O-N 3.39Å; L105-S141 WeakPolarHBondContact CD2-OG 3.4Å; L105-S141 PolarHBondContact O-OG 3.21Å; L105-V142 HydrophobicContact CD2-CG2 3.9Å
106	L	33.2	Very low	37.9	Very low	86 Å²	86	107.4 Å²	107.4	45%	0.45	57%	0.571	S	S	.	*	S	Bend	trans	-131.6	141.8	165.6	-65.8	173.4	0	0	0	108	M136 A138	L106-M136 HydrophobicContact CD1-SD 4.35Å; L106-A138 HydrophobicContact CD2-CB 4.41Å
107	P	33.6	Very low	40.3	Very low	65 Å²	65	109.5 Å²	109.5	42%	0.422	57%	0.571	S	S	.	*			trans	-59.5	157.4	167.3	-21.2	33.7	0	0	0	111.4	D109 Y113	P107-D109 PolarHBondContact O-N 3.04Å; P107-Y113 HydrophobicContact CG-CD2 4.14Å; P107-Y113 HydrophobicContact CG-CE2 4.15Å
108	S	38.1	Very low	42.9	Very low	128 Å²	128	102.9 Å²	102.9	90%	0.895	54%	0.537	S	S	*	.	S	Bend	trans	-79	7.9	179.6	-57.2	0	0	0	0	114.6
109	D	37.8	Very low	45.6	Very low	113 Å²	113	96.8 Å²	96.8	60%	0.604	51%	0.513	S	S	*	.	S	Bend	trans	-99.3	138.9	178.2	-64.9	-52.4	0	0	0	111.5	P107 Q111	P107-D109 PolarHBondContact O-N 3.04Å; D109-Q111 PolarHBondContact O-N 3.05Å
110	N	32.5	Very low	48.3	Very low	183 Å²	183	90.5 Å²	90.5	98%	0.979	48%	0.48	S	S	*	.			trans	-72.9	46.6	-174.4	-78.9	-30.9	0	0	0	115.1
111	Q	36.5	Very low	51	Low	93 Å²	93	84.6 Å²	84.6	44%	0.435	44%	0.444	S	S	.	.			trans	-102.8	137.3	173.9	-69.2	174.6	-7.6	0	0	110.6	D109 Y113 N954	D109-Q111 PolarHBondContact O-N 3.05Å; Q111-Y113 VanDerWaalsContact C-N 3.29Å; Q111-Y113 HydrophobicContact CB-CD2 4.04Å; Q111-Y113 HydrophobicContact CB-CE2 3.6Å; Q111-Y113 WeakPolarHBondContact O-CD2 3.33Å; Q111-Y113 PolarHBondContact O-N 3.01Å; Q111-Y113 PolarHBondContact OE1-OH 3.46Å; Q111-N954 PolarHBondContact NE2-OD1 3.45Å
112	K	35.9	Very low	53.5	Low	223 Å²	223	76.9 Å²	76.9	97%	0.97	41%	0.411	S	S	*	.			trans	-69.2	77.5	178.7	-79.4	-175.4	173.6	177.8	0	112
113	Y	44.6	Very low	55.5	Low	71 Å²	71	75.4 Å²	75.4	28%	0.278	41%	0.405	S	S	.	.			trans	-77.8	123.2	169.7	-73	-71.6	0	0	0	111.1	P107 Q111 G115	P107-Y113 HydrophobicContact CG-CD2 4.14Å; P107-Y113 HydrophobicContact CG-CE2 4.15Å; Q111-Y113 VanDerWaalsContact C-N 3.29Å; Q111-Y113 HydrophobicContact CB-CD2 4.04Å; Q111-Y113 HydrophobicContact CB-CE2 3.6Å; Q111-Y113 WeakPolarHBondContact O-CD2 3.33Å; Q111-Y113 PolarHBondContact O-N 3.01Å; Q111-Y113 PolarHBondContact OE1-OH 3.46Å; Y113-G115 PolarHBondContact O-N 3.4Å
114	G	48.7	Very low	57.4	Low	81 Å²	81	70.7 Å²	70.7	84%	0.835	38%	0.38	S	S	*	.			trans	-69.6	85.5	178.8	0	0	0	0	0	112.9
115	G	64.4	Low	58.5	Low	26 Å²	26	69 Å²	69	27%	0.268	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-74.2	132.1	175.4	0	0	0	0	0	112.6	Y113	Y113-G115 PolarHBondContact O-N 3.4Å
116	R	73.5	Confident	59.5	Low	56 Å²	56	70.3 Å²	70.3	21%	0.211	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121	174.5	-174.8	-170.1	-176.7	95.6	-1.6	110.1	I118 M136 M137 L182 F183 R184 K185 D186	R116-I118 HydrophobicContact CG-CG2 3.98Å; R116-M136 CarbonylContact O-C 3.58Å; R116-M136 WeakPolarHBondContact O-CA 3.38Å; R116-M137 PolarHBondContact N-O 2.82Å; R116-M137 PolarHBondContact O-N 3.35Å; R116-L182 VanDerWaalsContact CD-O 3.32Å; R116-L182 WeakPolarHBondContact CD-O 3.49Å; R116-L182 PolarHBondContact NE-O 3.32Å; R116-F183 HydrophobicContact CB-CD1 3.95Å; R116-F183 HydrophobicContact CB-CE1 3.77Å; R116-F183 HydrophobicContact CG-CD1 4.44Å; R116-F183 VanDerWaalsContact NH1-C 3.3Å; R116-F183 PolarHBondContact NH1-O 2.88Å; R116-R184 PolarHBondContact NH1-O 3.48Å; R116-R184 PolarHBondContact NH2-O 3.06Å; R116-K185 PolarHBondContact NH2-O 2.99Å; R116-D186 PolarHBondContact NH2-O 3.45Å
117	K	77.5	Confident	60.7	Low	149 Å²	149	68.1 Å²	68.1	65%	0.648	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.1	169.6	-172.2	178.6	-179	-179.3	0	109.9	T134 V135	K117-T134 HydrophobicContact CD-CG2 4.17Å; K117-T134 VanDerWaalsContact CE-CG2 3.4Å; K117-T134 HydrophobicContact CG-CG2 3.68Å; K117-V135 WeakPolarHBondContact CA-O 3.24Å
118	I	83.5	Confident	61.6	Low	1 Å²	1	74.2 Å²	74.2	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157	172	66.7	156.7	0	0	0	110.5	R116 V120 T134 V135 M137 K187 F189	R116-I118 HydrophobicContact CG-CG2 3.98Å; I118-V120 HydrophobicContact CD1-CG2 4.09Å; I118-T134 CarbonylContact O-C 3.51Å; I118-T134 VanDerWaalsContact O-CA 3.3Å; I118-T134 WeakPolarHBondContact O-CA 3.36Å; I118-T134 WeakPolarHBondContact O-CG2 3.43Å; I118-V135 HydrophobicContact CD1-CG2 3.97Å; I118-V135 HydrophobicContact CG1-CG2 3.55Å; I118-V135 PolarHBondContact N-O 3.12Å; I118-V135 PolarHBondContact O-N 3.02Å; I118-M137 HydrophobicContact CD1-CE 3.48Å; I118-M137 VanDerWaalsContact CD1-CE 3.48Å; I118-M137 HydrophobicContact CD1-SD 3.92Å; I118-M137 HydrophobicContact CG1-CE 3.89Å; I118-M137 HydrophobicContact CG1-SD 4.4Å; I118-M137 HydrophobicContact CG2-CE 4.1Å; I118-K187 CarbonylContact C-O 3.54Å; I118-K187 WeakPolarHBondContact CA-O 3.41Å; I118-F189 HydrophobicContact CB-CD2 4.3Å; I118-F189 HydrophobicContact CB-CE2 3.97Å; I118-F189 HydrophobicContact CD1-CD2 3.99Å; I118-F189 HydrophobicContact CD1-CE2 4.02Å; I118-F189 HydrophobicContact CG2-CE2 3.91Å
119	T	86.6	Confident	62.9	Low	23 Å²	23	69.9 Å²	69.9	14%	0.141	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135	171.9	-63.5	0	0	0	0	110.3	V121 L133 T134 K187 V188 F189 F273	T119-V121 HydrophobicContact CG2-CG2 4.28Å; T119-L133 WeakPolarHBondContact CA-O 3.44Å; T119-T134 PolarHBondContact OG1-OG1 3.1Å; T119-K187 PolarHBondContact N-O 2.89Å; T119-V188 CarbonylContact O-C 3.6Å; T119-V188 VanDerWaalsContact O-CA 3.28Å; T119-V188 WeakPolarHBondContact O-CA 3.33Å; T119-F189 PolarHBondContact O-N 2.98Å; T119-F273 HydrophobicContact CG2-CE1 4.08Å; T119-F273 HydrophobicContact CG2-CZ 4.34Å
120	V	88	Confident	64.6	Low	0 Å²	0	67.7 Å²	67.7	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.5	175.8	-175.9	0	0	0	0	108.7	I118 S132 L133 L152 F156 L168 F189 A191	I118-V120 HydrophobicContact CD1-CG2 4.09Å; V120-S132 CarbonylContact O-C 3.14Å; V120-S132 WeakPolarHBondContact O-CA 3.48Å; V120-L133 PolarHBondContact N-O 3.21Å; V120-L133 PolarHBondContact O-N 3.23Å; V120-L152 HydrophobicContact CB-CD2 4.29Å; V120-L152 HydrophobicContact CG1-CD1 4.36Å; V120-L152 HydrophobicContact CG2-CD1 3.91Å; V120-L152 HydrophobicContact CG2-CD2 3.8Å; V120-F156 HydrophobicContact CB-CE2 4.29Å; V120-F156 HydrophobicContact CB-CZ 4.22Å; V120-F156 HydrophobicContact CG1-CE2 3.84Å; V120-F156 HydrophobicContact CG1-CZ 3.97Å; V120-L168 HydrophobicContact CG1-CD2 3.67Å; V120-F189 CarbonylContact C-O 3.18Å; V120-F189 VanDerWaalsContact CA-O 3.31Å; V120-F189 WeakPolarHBondContact CA-O 3.31Å; V120-A191 HydrophobicContact CG1-CB 3.76Å
121	V	87.8	Confident	66.8	Low	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.5	-173.9	-170.6	0	0	0	0	109.8	T119 R130 V188 F189 I190 A191 I269 F273	T119-V121 HydrophobicContact CG2-CG2 4.28Å; V121-R130 HydrophobicContact CG1-CB 4.46Å; V121-V188 HydrophobicContact CG2-CG1 3.95Å; V121-F189 PolarHBondContact N-O 3.26Å; V121-I190 WeakPolarHBondContact O-CA 3.32Å; V121-A191 PolarHBondContact O-N 2.98Å; V121-I269 HydrophobicContact CG1-CD1 4.05Å; V121-I269 HydrophobicContact CG1-CG1 4.09Å; V121-I269 HydrophobicContact CG1-CG2 4.33Å; V121-F273 HydrophobicContact CB-CE2 4.43Å; V121-F273 HydrophobicContact CG1-CE2 4.11Å; V121-F273 HydrophobicContact CG2-CD2 4Å; V121-F273 HydrophobicContact CG2-CE1 4.43Å; V121-F273 HydrophobicContact CG2-CE2 3.43Å; V121-F273 VanDerWaalsContact CG2-CE2 3.43Å; V121-F273 HydrophobicContact CG2-CZ 3.69Å
122	R	84	Confident	69	Low	4 Å²	4	59.1 Å²	59.1	2%	0.015	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	129.8	-179.3	-157.4	174	-176.9	-175.2	2.9	111.6	T131 F156 W160 D163 A191	R122-T131 PolarHBondContact N-O 2.96Å; R122-T131 PolarHBondContact O-N 2.72Å; R122-F156 HydrophobicContact CB-CE1 4.02Å; R122-F156 HydrophobicContact CB-CE2 4.46Å; R122-F156 HydrophobicContact CB-CZ 3.92Å; R122-W160 HydrophobicContact CB-CH2 3.82Å; R122-W160 HydrophobicContact CB-CZ2 4.21Å; R122-W160 HydrophobicContact CB-CZ3 4.45Å; R122-W160 HydrophobicContact CG-CE3 4.4Å; R122-W160 HydrophobicContact CG-CH2 3.44Å; R122-W160 VanDerWaalsContact CG-CH2 3.44Å; R122-W160 HydrophobicContact CG-CZ2 4.2Å; R122-W160 HydrophobicContact CG-CZ3 3.59Å; R122-W160 VanDerWaalsContact CZ-CE3 3.43Å; R122-W160 VanDerWaalsContact NE-CZ3 3.31Å; R122-D163 IonicContact CZ-OD2 3.38Å; R122-D163 PolarHBondContact NH1-O 2.92Å; R122-D163 PolarHBondContact NH2-O 3.07Å; R122-D163 IonicContact NH2-OD1 2.7Å; R122-D163 PolarHBondContact NH2-OD1 2.98Å; R122-D163 IonicContact NH2-OD2 3.86Å; R122-D163 PolarHBondContact NH2-OD2 2.68Å; R122-A191 HydrophobicContact CB-CB 4.29Å; R122-A191 HydrophobicContact CG-CB 4.15Å
123	C	76.3	Confident	71.2	Confident	22 Å²	22	50 Å²	50	15%	0.149	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	132.6	176.9	-70.4	0	0	0	0	111.3	W160 L261	C123-W160 WeakPolarHBondContact O-CH2 3.37Å; C123-L261 HydrophobicContact CB-CD2 3.86Å; C123-L261 HydrophobicContact CB-CG 4.22Å; C123-L261 VanDerWaalsContact SG-CD2 3.59Å
124	N	71.1	Confident	73	Confident	32 Å²	32	50 Å²	50	17%	0.171	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-64.8	142.3	-169.5	-65.3	-27.9	0	0	0	111.5	G126 G127 K128 G129 T131 R159	N124-G126 PolarHBondContact O-N 2.89Å; N124-G126 VanDerWaalsContact O-N 3.14Å; N124-G127 PolarHBondContact O-N 3.33Å; N124-K128 PolarHBondContact ND2-O 3.39Å; N124-G129 VanDerWaalsContact CB-O 3.31Å; N124-G129 WeakPolarHBondContact CB-O 3.39Å; N124-G129 VanDerWaalsContact CG-O 3.23Å; N124-G129 PolarHBondContact N-O 3.41Å; N124-G129 VanDerWaalsContact ND2-C 3.32Å; N124-G129 PolarHBondContact ND2-O 3.33Å; N124-T131 PolarHBondContact OD1-OG1 2.71Å; N124-R159 PolarHBondContact OD1-NH2 2.87Å
125	P	56.9	Low	74.4	Confident	75 Å²	75	47.1 Å²	47.1	49%	0.487	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	119.8	174.7	-17.2	31.9	0	0	0	109.2	W160	P125-W160 HydrophobicContact CG-CD2 4.49Å; P125-W160 HydrophobicContact CG-CE3 3.79Å; P125-W160 HydrophobicContact CG-CH2 4.33Å; P125-W160 HydrophobicContact CG-CZ3 3.69Å
126	G	58.3	Low	74.9	Confident	46 Å²	46	50.2 Å²	50.2	47%	0.474	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	17.3	-171.9	0	0	0	0	0	114.9	N124 K128 T259	N124-G126 PolarHBondContact O-N 2.89Å; N124-G126 VanDerWaalsContact O-N 3.14Å; G126-K128 PolarHBondContact O-N 3.36Å; G126-T259 PolarHBondContact N-OG1 2.83Å
127	G	58.3	Low	74.6	Confident	40 Å²	40	47.7 Å²	47.7	41%	0.412	28%	0.276	S	S	.	.	S	Bend	trans	69.9	-11.1	163.6	0	0	0	0	0	117.5	N124 G129 T259	N124-G127 PolarHBondContact O-N 3.33Å; G127-G129 PolarHBondContact O-N 2.99Å; G127-G129 VanDerWaalsContact O-N 3.08Å; G127-T259 PolarHBondContact N-OG1 3.39Å
128	K	54.2	Low	74	Confident	193 Å²	193	40.9 Å²	40.9	84%	0.839	25%	0.248	S	C	*	.	S	Bend	trans	-84.6	85.5	179.3	-69.6	-171.8	178.1	-178.5	0	111.3	N124 G126	N124-K128 PolarHBondContact ND2-O 3.39Å; G126-K128 PolarHBondContact O-N 3.36Å
129	G	64.1	Low	73.1	Confident	37 Å²	37	46.6 Å²	46.6	38%	0.381	27%	0.27	S	S	.	.			trans	82.4	-174.6	168.9	0	0	0	0	0	115.2	N124 G127	N124-G129 VanDerWaalsContact CB-O 3.31Å; N124-G129 WeakPolarHBondContact CB-O 3.39Å; N124-G129 VanDerWaalsContact CG-O 3.23Å; N124-G129 PolarHBondContact N-O 3.41Å; N124-G129 VanDerWaalsContact ND2-C 3.32Å; N124-G129 PolarHBondContact ND2-O 3.33Å; G127-G129 PolarHBondContact O-N 2.99Å; G127-G129 VanDerWaalsContact O-N 3.08Å
130	R	73.5	Confident	71.7	Confident	66 Å²	66	52.5 Å²	52.5	25%	0.249	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	157.6	-175	55.4	-177.3	165.8	-128.7	1.9	111.8	V121 A268 E272	V121-R130 HydrophobicContact CG1-CB 4.46Å; R130-A268 PolarHBondContact NH1-O 3.16Å; R130-E272 WeakPolarHBondContact CD-OE2 3.37Å; R130-E272 IonicContact CZ-OE1 2.74Å; R130-E272 VanDerWaalsContact CZ-OE1 3.29Å; R130-E272 IonicContact CZ-OE2 3.1Å; R130-E272 VanDerWaalsContact CZ-OE2 3.24Å; R130-E272 IonicContact NE-OE1 2.7Å; R130-E272 PolarHBondContact NE-OE1 2.83Å; R130-E272 IonicContact NE-OE2 3.86Å; R130-E272 PolarHBondContact NE-OE2 3.43Å; R130-E272 IonicContact NH2-OE1 2.7Å; R130-E272 PolarHBondContact NH2-OE1 3.2Å; R130-E272 IonicContact NH2-OE2 2.81Å; R130-E272 PolarHBondContact NH2-OE2 2.82Å
131	T	79	Confident	70.3	Confident	29 Å²	29	53.7 Å²	53.7	18%	0.178	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.2	166.2	-57.6	0	0	0	0	108.4	R122 N124 F156 R159	R122-T131 PolarHBondContact N-O 2.96Å; R122-T131 PolarHBondContact O-N 2.72Å; N124-T131 PolarHBondContact OD1-OG1 2.71Å; T131-F156 HydrophobicContact CG2-CD1 3.79Å; T131-F156 HydrophobicContact CG2-CE1 3.9Å; T131-R159 PolarHBondContact OG1-NH1 2.99Å; T131-R159 PolarHBondContact OG1-NH2 2.84Å
132	S	82.4	Confident	69	Low	67 Å²	67	53.9 Å²	53.9	47%	0.469	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	146.4	169.8	53.5	0	0	0	0	110.3	V120	V120-S132 CarbonylContact O-C 3.14Å; V120-S132 WeakPolarHBondContact O-CA 3.48Å
133	L	83.4	Confident	67.8	Low	33 Å²	33	57.8 Å²	57.8	17%	0.173	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	115.2	-179.1	173.8	71.2	0	0	0	108.2	T119 V120 V135 L152 A155 F156	T119-L133 WeakPolarHBondContact CA-O 3.44Å; V120-L133 PolarHBondContact N-O 3.21Å; V120-L133 PolarHBondContact O-N 3.23Å; L133-V135 HydrophobicContact CD1-CG1 4.47Å; L133-V135 HydrophobicContact CD2-CG1 4.14Å; L133-V135 HydrophobicContact CG-CG1 4.02Å; L133-L152 HydrophobicContact CD2-CD2 3.72Å; L133-A155 HydrophobicContact CD1-CB 4.07Å; L133-A155 HydrophobicContact CD2-CB 3.43Å; L133-A155 VanDerWaalsContact CD2-CB 3.43Å; L133-A155 HydrophobicContact CG-CB 4.38Å; L133-F156 HydrophobicContact CB-CD1 4.16Å; L133-F156 HydrophobicContact CB-CE1 3.67Å; L133-F156 HydrophobicContact CB-CE2 4.15Å; L133-F156 HydrophobicContact CB-CZ 3.67Å; L133-F156 HydrophobicContact CD2-CD2 3.94Å; L133-F156 HydrophobicContact CD2-CE2 3.98Å; L133-F156 HydrophobicContact CD2-CG 4.27Å; L133-F156 HydrophobicContact CD2-CZ 4.36Å
134	T	82.7	Confident	67.7	Low	71 Å²	71	58.3 Å²	58.3	44%	0.436	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.7	175.5	-60.4	0	0	0	0	110	K117 I118 T119	K117-T134 HydrophobicContact CD-CG2 4.17Å; K117-T134 VanDerWaalsContact CE-CG2 3.4Å; K117-T134 HydrophobicContact CG-CG2 3.68Å; I118-T134 CarbonylContact O-C 3.51Å; I118-T134 VanDerWaalsContact O-CA 3.3Å; I118-T134 WeakPolarHBondContact O-CA 3.36Å; I118-T134 WeakPolarHBondContact O-CG2 3.43Å; T119-T134 PolarHBondContact OG1-OG1 3.1Å
135	V	77.8	Confident	68.1	Low	20 Å²	20	58.1 Å²	58.1	12%	0.121	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.2	177.4	-61.5	0	0	0	0	111.1	K117 I118 L133 M137 L152	K117-V135 WeakPolarHBondContact CA-O 3.24Å; I118-V135 HydrophobicContact CD1-CG2 3.97Å; I118-V135 HydrophobicContact CG1-CG2 3.55Å; I118-V135 PolarHBondContact N-O 3.12Å; I118-V135 PolarHBondContact O-N 3.02Å; L133-V135 HydrophobicContact CD1-CG1 4.47Å; L133-V135 HydrophobicContact CD2-CG1 4.14Å; L133-V135 HydrophobicContact CG-CG1 4.02Å; V135-M137 HydrophobicContact CG2-CG 4.15Å; V135-L152 HydrophobicContact CG1-CD2 4.1Å; V135-L152 HydrophobicContact CG2-CD2 4.13Å
136	M	73.7	Confident	69.1	Low	91 Å²	91	56.6 Å²	56.6	45%	0.448	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.1	171.6	-175.2	-173.2	-63.8	0	0	108.4	L105 L106 R116	L105-M136 WeakPolarHBondContact CB-O 3.47Å; L105-M136 VanDerWaalsContact CD1-O 3.29Å; L105-M136 WeakPolarHBondContact CD1-O 3.29Å; L106-M136 HydrophobicContact CD1-SD 4.35Å; R116-M136 CarbonylContact O-C 3.58Å; R116-M136 WeakPolarHBondContact O-CA 3.38Å
137	M	68	Low	69.7	Low	2 Å²	2	56.6 Å²	56.6	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.5	-178.5	-57.9	-175	-55.5	0	0	110.9	L105 R116 I118 V135 V142 V148 L182 F183	L105-M137 HydrophobicContact CD1-CG 4.15Å; R116-M137 PolarHBondContact N-O 2.82Å; R116-M137 PolarHBondContact O-N 3.35Å; I118-M137 HydrophobicContact CD1-CE 3.48Å; I118-M137 VanDerWaalsContact CD1-CE 3.48Å; I118-M137 HydrophobicContact CD1-SD 3.92Å; I118-M137 HydrophobicContact CG1-CE 3.89Å; I118-M137 HydrophobicContact CG1-SD 4.4Å; I118-M137 HydrophobicContact CG2-CE 4.1Å; V135-M137 HydrophobicContact CG2-CG 4.15Å; M137-V142 HydrophobicContact CB-CG2 4.49Å; M137-V148 HydrophobicContact SD-CG1 4.28Å; M137-L182 HydrophobicContact CE-CB 3.89Å; M137-L182 HydrophobicContact CE-CD1 4.16Å; M137-L182 HydrophobicContact SD-CD1 4.38Å; M137-F183 HydrophobicContact CB-CE1 4.33Å; M137-F183 HydrophobicContact CB-CZ 3.83Å; M137-F183 HydrophobicContact CE-CE2 4.35Å; M137-F183 HydrophobicContact CE-CZ 4.2Å
138	A	65.2	Low	70.9	Confident	7 Å²	7	55.1 Å²	55.1	6%	0.058	29%	0.287	C	S	.	.			trans	-86.7	133.5	164	0	0	0	0	0	110.1	L105 L106 R140 S141	L105-A138 VanDerWaalsContact O-CB 3.28Å; L105-A138 WeakPolarHBondContact O-CB 3.47Å; L105-A138 PolarHBondContact O-N 3.39Å; L106-A138 HydrophobicContact CD2-CB 4.41Å; A138-R140 PolarHBondContact O-N 3.26Å; A138-R140 VanDerWaalsContact O-N 3.11Å; A138-S141 PolarHBondContact N-OG 3.5Å; A138-S141 WeakPolarHBondContact O-CB 3.35Å; A138-S141 PolarHBondContact O-N 2.76Å; A138-S141 PolarHBondContact O-OG 3.27Å
139	R	63.5	Low	72.2	Confident	120 Å²	120	46.7 Å²	46.7	45%	0.453	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-55.2	-32.8	-178.5	-178.9	173	171	162.9	-6.2	113.3	S141 F183 D1029	R139-S141 VanDerWaalsContact C-N 3.3Å; R139-S141 PolarHBondContact O-N 3.22Å; R139-F183 HydrophobicContact CB-CE1 4.16Å; R139-F183 HydrophobicContact CB-CE2 4.39Å; R139-F183 HydrophobicContact CB-CZ 4.06Å; R139-D1029 IonicContact CZ-OD1 3.76Å; R139-D1029 VanDerWaalsContact NH2-CG 3.34Å; R139-D1029 IonicContact NH2-OD1 2.66Å; R139-D1029 PolarHBondContact NH2-OD1 2.92Å; R139-D1029 IonicContact NH2-OD2 3.27Å; R139-D1029 PolarHBondContact NH2-OD2 2.93Å; R139-D1029 VanDerWaalsContact NH2-OD2 3.08Å
140	R	57	Low	72.9	Confident	148 Å²	148	48.6 Å²	48.6	56%	0.558	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-78	-4.4	177.4	-54.5	-174.4	-170.1	-174.3	1.7	114.7	A138	A138-R140 PolarHBondContact O-N 3.26Å; A138-R140 VanDerWaalsContact O-N 3.11Å
141	S	58.9	Low	73	Confident	24 Å²	24	46.5 Å²	46.5	17%	0.168	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-105.4	-2.4	-174.1	68.4	0	0	0	0	114.7	L105 A138 R139	L105-S141 WeakPolarHBondContact CD2-OG 3.4Å; L105-S141 PolarHBondContact O-OG 3.21Å; A138-S141 PolarHBondContact N-OG 3.5Å; A138-S141 WeakPolarHBondContact O-CB 3.35Å; A138-S141 PolarHBondContact O-N 2.76Å; A138-S141 PolarHBondContact O-OG 3.27Å; R139-S141 VanDerWaalsContact C-N 3.3Å; R139-S141 PolarHBondContact O-N 3.22Å
142	V	60.6	Low	73.2	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.024	24%	0.243	C	C	.	.			trans	-123.2	119	-172.8	177.4	0	0	0	0	109	L105 M137 V148 V179	L105-V142 HydrophobicContact CD2-CG2 3.9Å; M137-V142 HydrophobicContact CB-CG2 4.49Å; V142-V148 HydrophobicContact CB-CG2 4.48Å; V142-V148 HydrophobicContact CG1-CG2 3.25Å; V142-V148 HydrophobicContact CG2-CG2 4.41Å; V142-V179 HydrophobicContact CB-CG1 4.17Å; V142-V179 HydrophobicContact CG1-CB 4.43Å; V142-V179 HydrophobicContact CG1-CG1 3.65Å; V142-V179 HydrophobicContact CG1-CG2 3.83Å
143	H	59.1	Low	73.3	Confident	86 Å²	86	42.8 Å²	42.8	40%	0.398	22%	0.224	S	C	.	.			trans	-97	-30.5	-175.3	-49.5	-56.6	0	0	0	113.8	Q147 F1028	H143-Q147 PolarHBondContact CD2-OE1 2.94Å; H143-Q147 VanDerWaalsContact CD2-OE1 3.32Å; H143-F1028 AromaticContact ND1-CE2 3.63Å; H143-F1028 AromaticContact ND1-CZ 3.96Å
144	T	73.7	Confident	73	Confident	33 Å²	33	45.6 Å²	45.6	20%	0.202	24%	0.237	C	C	.	.			trans	-146.9	158.9	176.3	60.5	0	0	0	0	112	G146 Q147 V148 G1137	T144-G146 VanDerWaalsContact C-N 3.33Å; T144-Q147 WeakPolarHBondContact O-CB 3.48Å; T144-Q147 PolarHBondContact O-N 3.44Å; T144-Q147 WeakPolarHBondContact OG1-CB 3.39Å; T144-Q147 PolarHBondContact OG1-N 2.91Å; T144-V148 PolarHBondContact O-N 3.17Å; T144-G1137 WeakPolarHBondContact CG2-O 3.19Å
145	L	79.5	Confident	72.7	Confident	29 Å²	29	43.6 Å²	43.6	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-41.9	171.4	-179.8	61.9	0	0	0	110.6	Q147 V148 M149 L168 I176 V179 L182	L145-Q147 VanDerWaalsContact C-N 3.27Å; L145-Q147 PolarHBondContact O-N 3.32Å; L145-V148 WeakPolarHBondContact O-CA 3.43Å; L145-V148 WeakPolarHBondContact O-CB 3.25Å; L145-V148 PolarHBondContact O-N 2.94Å; L145-M149 HydrophobicContact CD1-SD 4.5Å; L145-M149 WeakPolarHBondContact O-CG 3.42Å; L145-M149 PolarHBondContact O-N 3.43Å; L145-L168 HydrophobicContact CD1-CD1 4.49Å; L145-I176 HydrophobicContact CD1-CG2 4.24Å; L145-I176 HydrophobicContact CD2-CG2 4.44Å; L145-I176 WeakPolarHBondContact CD2-O 3.48Å; L145-V179 HydrophobicContact CB-CG2 4.31Å; L145-V179 VanDerWaalsContact N-CG2 3.27Å; L145-L182 HydrophobicContact CD1-CD1 3.94Å
146	G	77.4	Confident	72.7	Confident	42 Å²	42	43.1 Å²	43.1	43%	0.433	22%	0.223	S	C	.	.	H	α-helix	trans	-56.3	-38.7	176.5	0	0	0	0	0	113.2	T144 M149 C150	T144-G146 VanDerWaalsContact C-N 3.33Å; G146-M149 WeakPolarHBondContact O-CB 3.35Å; G146-M149 PolarHBondContact O-N 3Å; G146-C150 PolarHBondContact O-N 3.41Å; G146-C150 PolarHBondContact O-SG 3.1Å; G146-C150 VanDerWaalsContact O-SG 3.38Å
147	Q	72.4	Confident	72.7	Confident	47 Å²	47	39.8 Å²	39.8	22%	0.22	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-45.7	171.7	-179.3	-176.2	-16.9	0	0	111.7	H143 T144 L145 M149 C150 E151	H143-Q147 PolarHBondContact CD2-OE1 2.94Å; H143-Q147 VanDerWaalsContact CD2-OE1 3.32Å; T144-Q147 WeakPolarHBondContact O-CB 3.48Å; T144-Q147 PolarHBondContact O-N 3.44Å; T144-Q147 WeakPolarHBondContact OG1-CB 3.39Å; T144-Q147 PolarHBondContact OG1-N 2.91Å; L145-Q147 VanDerWaalsContact C-N 3.27Å; L145-Q147 PolarHBondContact O-N 3.32Å; Q147-M149 VanDerWaalsContact C-N 3.27Å; Q147-M149 PolarHBondContact O-N 3.43Å; Q147-C150 PolarHBondContact O-N 3.08Å; Q147-E151 HydrophobicContact CG-CG 4.36Å; Q147-E151 VanDerWaalsContact CG-OE1 3.25Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.18Å; Q147-E151 PolarHBondContact NE2-OE1 3.48Å; Q147-E151 WeakPolarHBondContact O-CG 3.48Å; Q147-E151 PolarHBondContact O-N 3.49Å
148	V	81.8	Confident	72.6	Confident	8 Å²	8	43.1 Å²	43.1	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-41.3	174.6	-175.7	0	0	0	0	111.1	M137 V142 T144 L145 C150 E151 L152 L182	M137-V148 HydrophobicContact SD-CG1 4.28Å; V142-V148 HydrophobicContact CB-CG2 4.48Å; V142-V148 HydrophobicContact CG1-CG2 3.25Å; V142-V148 HydrophobicContact CG2-CG2 4.41Å; T144-V148 PolarHBondContact O-N 3.17Å; L145-V148 WeakPolarHBondContact O-CA 3.43Å; L145-V148 WeakPolarHBondContact O-CB 3.25Å; L145-V148 PolarHBondContact O-N 2.94Å; V148-C150 PolarHBondContact O-N 3.29Å; V148-E151 PolarHBondContact O-N 2.89Å; V148-L152 HydrophobicContact CG1-CD1 3.71Å; V148-L152 HydrophobicContact CG1-CG 4.05Å; V148-L152 WeakPolarHBondContact O-CB 3.37Å; V148-L152 VanDerWaalsContact O-CG 3.22Å; V148-L152 WeakPolarHBondContact O-CG 3.43Å; V148-L152 PolarHBondContact O-N 3.03Å; V148-L182 HydrophobicContact CG1-CD1 4.08Å; V148-L182 HydrophobicContact CG2-CD1 4.33Å
149	M	83.1	Confident	72.7	Confident	16 Å²	16	49.1 Å²	49.1	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-43.1	178.2	-58.2	-55.6	-123.2	0	0	112.6	L145 G146 Q147 T153 I165 R166 L168	L145-M149 HydrophobicContact CD1-SD 4.5Å; L145-M149 WeakPolarHBondContact O-CG 3.42Å; L145-M149 PolarHBondContact O-N 3.43Å; G146-M149 WeakPolarHBondContact O-CB 3.35Å; G146-M149 PolarHBondContact O-N 3Å; Q147-M149 VanDerWaalsContact C-N 3.27Å; Q147-M149 PolarHBondContact O-N 3.43Å; M149-T153 VanDerWaalsContact O-CB 3.32Å; M149-T153 WeakPolarHBondContact O-CB 3.37Å; M149-T153 PolarHBondContact O-N 3.5Å; M149-T153 PolarHBondContact O-OG1 3Å; M149-I165 HydrophobicContact CE-CG2 3.76Å; M149-I165 HydrophobicContact SD-CG2 3.76Å; M149-R166 VanDerWaalsContact CE-C 3.43Å; M149-R166 VanDerWaalsContact CE-O 3.28Å; M149-R166 WeakPolarHBondContact CE-O 3.4Å; M149-L168 HydrophobicContact CE-CB 4.15Å; M149-L168 HydrophobicContact CE-CD1 4.21Å; M149-L168 HydrophobicContact CE-CG 3.83Å; M149-L168 HydrophobicContact SD-CB 4.5Å; M149-L168 HydrophobicContact SD-CD1 3.49Å; M149-L168 WeakPolarHBondContact SD-CD1 3.35Å; M149-L168 HydrophobicContact SD-CG 3.66Å
150	C	77.1	Confident	73.1	Confident	78 Å²	78	43.5 Å²	43.5	53%	0.527	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-49	174.3	-65.9	0	0	0	0	111.3	G146 Q147 V148 L152 T153 E154	G146-C150 PolarHBondContact O-N 3.41Å; G146-C150 PolarHBondContact O-SG 3.1Å; G146-C150 VanDerWaalsContact O-SG 3.38Å; Q147-C150 PolarHBondContact O-N 3.08Å; V148-C150 PolarHBondContact O-N 3.29Å; C150-L152 PolarHBondContact O-N 2.83Å; C150-T153 WeakPolarHBondContact O-CB 3.4Å; C150-T153 PolarHBondContact O-N 3.48Å; C150-T153 VanDerWaalsContact O-N 3.12Å; C150-E154 PolarHBondContact O-N 2.63Å
151	E	77	Confident	73.5	Confident	22 Å²	22	42 Å²	42	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-39.8	-179	-68.5	-174.1	-156.9	0	0	112.7	Q147 V148 A155 R1146	Q147-E151 HydrophobicContact CG-CG 4.36Å; Q147-E151 VanDerWaalsContact CG-OE1 3.25Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.18Å; Q147-E151 PolarHBondContact NE2-OE1 3.48Å; Q147-E151 WeakPolarHBondContact O-CG 3.48Å; Q147-E151 PolarHBondContact O-N 3.49Å; V148-E151 PolarHBondContact O-N 2.89Å; E151-A155 VanDerWaalsContact O-CB 3.25Å; E151-A155 WeakPolarHBondContact O-CB 3.48Å; E151-A155 PolarHBondContact O-N 3.37Å; E151-R1146 IonicContact OE1-CZ 3.57Å; E151-R1146 VanDerWaalsContact OE1-CZ 3.27Å; E151-R1146 IonicContact OE1-NE 3.47Å; E151-R1146 IonicContact OE1-NH1 3.54Å; E151-R1146 PolarHBondContact OE1-NH1 3.2Å; E151-R1146 IonicContact OE1-NH2 3.64Å; E151-R1146 IonicContact OE2-CZ 2.64Å; E151-R1146 IonicContact OE2-NH1 2.81Å; E151-R1146 PolarHBondContact OE2-NH1 3.49Å; E151-R1146 IonicContact OE2-NH2 2.92Å; E151-R1146 PolarHBondContact OE2-NH2 2.99Å
152	L	83.9	Confident	73.9	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-43.2	171.9	-71.6	171.3	0	0	0	111.2	V120 L133 V135 V148 C150 E154 A155 F156 I165 L168	V120-L152 HydrophobicContact CB-CD2 4.29Å; V120-L152 HydrophobicContact CG1-CD1 4.36Å; V120-L152 HydrophobicContact CG2-CD1 3.91Å; V120-L152 HydrophobicContact CG2-CD2 3.8Å; L133-L152 HydrophobicContact CD2-CD2 3.72Å; V135-L152 HydrophobicContact CG1-CD2 4.1Å; V135-L152 HydrophobicContact CG2-CD2 4.13Å; V148-L152 HydrophobicContact CG1-CD1 3.71Å; V148-L152 HydrophobicContact CG1-CG 4.05Å; V148-L152 WeakPolarHBondContact O-CB 3.37Å; V148-L152 VanDerWaalsContact O-CG 3.22Å; V148-L152 WeakPolarHBondContact O-CG 3.43Å; V148-L152 PolarHBondContact O-N 3.03Å; C150-L152 PolarHBondContact O-N 2.83Å; L152-E154 VanDerWaalsContact C-N 3.33Å; L152-E154 PolarHBondContact O-N 2.9Å; L152-A155 PolarHBondContact O-N 3.05Å; L152-F156 WeakPolarHBondContact O-CD2 3.49Å; L152-F156 PolarHBondContact O-N 2.91Å; L152-I165 HydrophobicContact CB-CD1 3.65Å; L152-L168 HydrophobicContact CD1-CD1 3.99Å
153	T	82.8	Confident	74.5	Confident	13 Å²	13	50.4 Å²	50.4	8%	0.08	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-44	177.2	-61.4	0	0	0	0	111.5	M149 C150 P164 I165	M149-T153 VanDerWaalsContact O-CB 3.32Å; M149-T153 WeakPolarHBondContact O-CB 3.37Å; M149-T153 PolarHBondContact O-N 3.5Å; M149-T153 PolarHBondContact O-OG1 3Å; C150-T153 WeakPolarHBondContact O-CB 3.4Å; C150-T153 PolarHBondContact O-N 3.48Å; C150-T153 VanDerWaalsContact O-N 3.12Å; T153-P164 HydrophobicContact CG2-CB 4.09Å; T153-I165 WeakPolarHBondContact OG1-CG1 3.4Å; T153-I165 PolarHBondContact OG1-N 3.38Å
154	E	77	Confident	75.4	Confident	93 Å²	93	48.9 Å²	48.9	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-43.9	173.9	-71.5	176.7	-173	0	0	112	C150 L152 G157	C150-E154 PolarHBondContact O-N 2.63Å; L152-E154 VanDerWaalsContact C-N 3.33Å; L152-E154 PolarHBondContact O-N 2.9Å; E154-G157 WeakPolarHBondContact O-CA 3.33Å; E154-G157 PolarHBondContact O-N 3.4Å
155	A	77.7	Confident	75.9	Confident	28 Å²	28	47.8 Å²	47.8	23%	0.231	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-31.7	-178.8	0	0	0	0	0	113.9	I102 L133 E151 L152 G157	I102-A155 HydrophobicContact CG2-CB 4Å; L133-A155 HydrophobicContact CD1-CB 4.07Å; L133-A155 HydrophobicContact CD2-CB 3.43Å; L133-A155 VanDerWaalsContact CD2-CB 3.43Å; L133-A155 HydrophobicContact CG-CB 4.38Å; E151-A155 VanDerWaalsContact O-CB 3.25Å; E151-A155 WeakPolarHBondContact O-CB 3.48Å; E151-A155 PolarHBondContact O-N 3.37Å; L152-A155 PolarHBondContact O-N 3.05Å; A155-G157 PolarHBondContact O-N 3.32Å
156	F	78.3	Confident	76	Confident	10 Å²	10	53.4 Å²	53.4	4%	0.044	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.2	169.9	-84.9	-69.2	0	0	0	113.1	V120 R122 T131 L133 L152 W160 I165	V120-F156 HydrophobicContact CB-CE2 4.29Å; V120-F156 HydrophobicContact CB-CZ 4.22Å; V120-F156 HydrophobicContact CG1-CE2 3.84Å; V120-F156 HydrophobicContact CG1-CZ 3.97Å; R122-F156 HydrophobicContact CB-CE1 4.02Å; R122-F156 HydrophobicContact CB-CE2 4.46Å; R122-F156 HydrophobicContact CB-CZ 3.92Å; T131-F156 HydrophobicContact CG2-CD1 3.79Å; T131-F156 HydrophobicContact CG2-CE1 3.9Å; L133-F156 HydrophobicContact CB-CD1 4.16Å; L133-F156 HydrophobicContact CB-CE1 3.67Å; L133-F156 HydrophobicContact CB-CE2 4.15Å; L133-F156 HydrophobicContact CB-CZ 3.67Å; L133-F156 HydrophobicContact CD2-CD2 3.94Å; L133-F156 HydrophobicContact CD2-CE2 3.98Å; L133-F156 HydrophobicContact CD2-CG 4.27Å; L133-F156 HydrophobicContact CD2-CZ 4.36Å; L152-F156 WeakPolarHBondContact O-CD2 3.49Å; L152-F156 PolarHBondContact O-N 2.91Å; F156-W160 HydrophobicContact CB-CG 4.16Å; F156-W160 PolarHBondContact O-NE1 3.14Å; F156-I165 HydrophobicContact CD2-CD1 3.78Å; F156-I165 HydrophobicContact CE2-CD1 3.82Å
157	G	72.3	Confident	76.4	Confident	22 Å²	22	53.3 Å²	53.3	23%	0.227	28%	0.277	C	S	.	.			trans	94.4	176.1	169.4	0	0	0	0	0	115.9	E154 A155 R159 W160	E154-G157 WeakPolarHBondContact O-CA 3.33Å; E154-G157 PolarHBondContact O-N 3.4Å; A155-G157 PolarHBondContact O-N 3.32Å; G157-R159 PolarHBondContact O-N 3.5Å; G157-W160 PolarHBondContact O-N 3.08Å
158	S	66.2	Low	77.2	Confident	72 Å²	72	51 Å²	51	50%	0.503	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-52.4	-29.5	-174.6	42.7	0	0	0	0	115.3	W160 H161	S158-W160 PolarHBondContact O-N 3.27Å; S158-H161 PolarHBondContact O-N 3.27Å
159	R	67.1	Low	77.5	Confident	132 Å²	132	51 Å²	51	50%	0.498	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-58.9	-9.5	175.5	12.8	179.5	-60.5	-133.8	0	114.9	N124 T131 G157	N124-R159 PolarHBondContact OD1-NH2 2.87Å; T131-R159 PolarHBondContact OG1-NH1 2.99Å; T131-R159 PolarHBondContact OG1-NH2 2.84Å; G157-R159 PolarHBondContact O-N 3.5Å
160	W	71.3	Confident	77.7	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.008	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-123	9.1	-179	-50.1	89.1	0	0	0	114	R122 C123 P125 F156 G157 S158 N162 D163	R122-W160 HydrophobicContact CB-CH2 3.82Å; R122-W160 HydrophobicContact CB-CZ2 4.21Å; R122-W160 HydrophobicContact CB-CZ3 4.45Å; R122-W160 HydrophobicContact CG-CE3 4.4Å; R122-W160 HydrophobicContact CG-CH2 3.44Å; R122-W160 VanDerWaalsContact CG-CH2 3.44Å; R122-W160 HydrophobicContact CG-CZ2 4.2Å; R122-W160 HydrophobicContact CG-CZ3 3.59Å; R122-W160 VanDerWaalsContact CZ-CE3 3.43Å; R122-W160 VanDerWaalsContact NE-CZ3 3.31Å; C123-W160 WeakPolarHBondContact O-CH2 3.37Å; P125-W160 HydrophobicContact CG-CD2 4.49Å; P125-W160 HydrophobicContact CG-CE3 3.79Å; P125-W160 HydrophobicContact CG-CH2 4.33Å; P125-W160 HydrophobicContact CG-CZ3 3.69Å; F156-W160 HydrophobicContact CB-CG 4.16Å; F156-W160 PolarHBondContact O-NE1 3.14Å; G157-W160 PolarHBondContact O-N 3.08Å; S158-W160 PolarHBondContact O-N 3.27Å; W160-N162 PolarHBondContact O-N 3.02Å; W160-D163 CarbonylContact O-C 3.57Å; W160-D163 PolarHBondContact O-N 2.97Å; W160-D163 VanDerWaalsContact O-O 3.09Å
161	H	67.2	Low	78.1	Confident	118 Å²	118	47.3 Å²	47.3	55%	0.546	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-29.1	179.2	-70.1	-4.5	0	0	0	113	S158 D163	S158-H161 PolarHBondContact O-N 3.27Å; H161-D163 VanDerWaalsContact C-N 3.32Å
162	N	67.2	Low	78.3	Confident	162 Å²	162	48.7 Å²	48.7	87%	0.866	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-6.9	175.7	-61.6	11.4	0	0	0	113.1	W160	W160-N162 PolarHBondContact O-N 3.02Å
163	D	72.1	Confident	77.9	Confident	42 Å²	42	48.8 Å²	48.8	23%	0.225	25%	0.253	C	S	.	.	S	Bend	trans	-139.4	73.9	-178.7	-175.3	32.3	0	0	0	109.8	R122 W160 H161 G193 L194	R122-D163 IonicContact CZ-OD2 3.38Å; R122-D163 PolarHBondContact NH1-O 2.92Å; R122-D163 PolarHBondContact NH2-O 3.07Å; R122-D163 IonicContact NH2-OD1 2.7Å; R122-D163 PolarHBondContact NH2-OD1 2.98Å; R122-D163 IonicContact NH2-OD2 3.86Å; R122-D163 PolarHBondContact NH2-OD2 2.68Å; W160-D163 CarbonylContact O-C 3.57Å; W160-D163 PolarHBondContact O-N 2.97Å; W160-D163 VanDerWaalsContact O-O 3.09Å; H161-D163 VanDerWaalsContact C-N 3.32Å; D163-G193 WeakPolarHBondContact OD1-CA 3.49Å; D163-L194 PolarHBondContact OD1-N 3.48Å
164	P	79.3	Confident	77.8	Confident	54 Å²	54	52.6 Å²	52.6	35%	0.351	27%	0.266	S	S	.	.			trans	-66.4	147.5	178.7	28.4	-35.2	0	0	0	111.4	T153 R166 G193	T153-P164 HydrophobicContact CG2-CB 4.09Å; P164-R166 PolarHBondContact O-N 3.2Å; P164-G193 WeakPolarHBondContact O-CA 3.46Å
165	I	83.8	Confident	78.2	Confident	9 Å²	9	49.5 Å²	49.5	5%	0.046	25%	0.252	C	S	.	.			trans	-65.4	126.7	177.6	-57.6	171	0	0	0	109.1	M149 L152 T153 F156 A191	M149-I165 HydrophobicContact CE-CG2 3.76Å; M149-I165 HydrophobicContact SD-CG2 3.76Å; L152-I165 HydrophobicContact CB-CD1 3.65Å; T153-I165 WeakPolarHBondContact OG1-CG1 3.4Å; T153-I165 PolarHBondContact OG1-N 3.38Å; F156-I165 HydrophobicContact CD2-CD1 3.78Å; F156-I165 HydrophobicContact CE2-CD1 3.82Å; I165-A191 HydrophobicContact CD1-CB 3.95Å; I165-A191 HydrophobicContact CG1-CB 4.16Å; I165-A191 HydrophobicContact CG2-CB 3.9Å
166	R	80.6	Confident	78.7	Confident	147 Å²	147	48.5 Å²	48.5	56%	0.555	24%	0.243	S	C	*	.			trans	-109.9	-34.9	178.3	-65	-168.8	169.2	-160.2	-8.4	112.7	M149 P164 S192 G193	M149-R166 VanDerWaalsContact CE-C 3.43Å; M149-R166 VanDerWaalsContact CE-O 3.28Å; M149-R166 WeakPolarHBondContact CE-O 3.4Å; P164-R166 PolarHBondContact O-N 3.2Å; R166-S192 PolarHBondContact N-O 2.89Å; R166-G193 WeakPolarHBondContact CB-O 3.47Å; R166-G193 WeakPolarHBondContact CD-O 3.27Å
167	N	86	Confident	78.9	Confident	40 Å²	40	54.6 Å²	54.6	21%	0.214	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140	-176.6	-58.3	79.2	0	0	0	110.4	Y169 E175 S192	N167-Y169 HydrophobicContact CB-CD2 4.5Å; N167-Y169 HydrophobicContact CB-CE2 3.58Å; N167-E175 PolarHBondContact ND2-OE1 3.5Å; N167-S192 PolarHBondContact N-O 3.17Å; N167-S192 VanDerWaalsContact N-O 3.07Å; N167-S192 PolarHBondContact O-N 3.19Å
168	L	89	Confident	79.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.8	170.5	-83.8	171.8	0	0	0	107.8	V120 L145 M149 L152 E175 I176 L182 F189 I190 A191	V120-L168 HydrophobicContact CG1-CD2 3.67Å; L145-L168 HydrophobicContact CD1-CD1 4.49Å; M149-L168 HydrophobicContact CE-CB 4.15Å; M149-L168 HydrophobicContact CE-CD1 4.21Å; M149-L168 HydrophobicContact CE-CG 3.83Å; M149-L168 HydrophobicContact SD-CB 4.5Å; M149-L168 HydrophobicContact SD-CD1 3.49Å; M149-L168 WeakPolarHBondContact SD-CD1 3.35Å; M149-L168 HydrophobicContact SD-CG 3.66Å; L152-L168 HydrophobicContact CD1-CD1 3.99Å; L168-E175 CarbonylContact O-C 3.45Å; L168-E175 WeakPolarHBondContact O-CA 3.34Å; L168-I176 HydrophobicContact CB-CB 4.02Å; L168-I176 HydrophobicContact CB-CG1 4.09Å; L168-I176 PolarHBondContact O-N 2.86Å; L168-L182 HydrophobicContact CD1-CD2 4.22Å; L168-F189 HydrophobicContact CD2-CB 4.07Å; L168-I190 CarbonylContact C-O 3.5Å; L168-I190 WeakPolarHBondContact CA-O 3.46Å; L168-A191 HydrophobicContact CD2-CB 3.91Å
169	Y	88.1	Confident	79.9	Confident	6 Å²	6	51.5 Å²	51.5	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.6	178.6	-57.2	-91.1	0	0	0	109.8	N167 R174 E175 F189 I190 M197 W287 L291	N167-Y169 HydrophobicContact CB-CD2 4.5Å; N167-Y169 HydrophobicContact CB-CE2 3.58Å; Y169-R174 CarbonylContact C-O 3.59Å; Y169-R174 WeakPolarHBondContact CA-O 3.36Å; Y169-E175 HydrophobicContact CD1-CB 3.91Å; Y169-E175 HydrophobicContact CE1-CB 3.86Å; Y169-E175 HydrophobicContact CE1-CG 4.35Å; Y169-F189 CarbonylContact O-C 3.55Å; Y169-F189 WeakPolarHBondContact O-CA 3.44Å; Y169-F189 WeakPolarHBondContact O-CB 3.43Å; Y169-I190 PolarHBondContact N-O 3.3Å; Y169-I190 PolarHBondContact O-N 3.19Å; Y169-M197 HydrophobicContact CD2-SD 3.61Å; Y169-M197 HydrophobicContact CE2-CG 4.25Å; Y169-M197 HydrophobicContact CE2-SD 3.64Å; Y169-W287 VanDerWaalsContact CB-CH2 3.5Å; Y169-W287 HydrophobicContact CD1-CH2 4.32Å; Y169-W287 HydrophobicContact CD1-CZ3 4.43Å; Y169-W287 HydrophobicContact CD2-CH2 4.03Å; Y169-W287 HydrophobicContact CD2-CZ3 4.36Å; Y169-W287 AromaticContact CG-CH2 3.7Å; Y169-W287 HydrophobicContact CG-CH2 3.7Å; Y169-W287 HydrophobicContact CG-CZ2 4.42Å; Y169-W287 HydrophobicContact CG-CZ3 4.15Å; Y169-L291 HydrophobicContact CE1-CD2 4.29Å
170	S	88.1	Confident	80.3	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	165.5	160.9	66.6	0	0	0	0	110.4	T172 G173 R174 D186 W287	S170-T172 PolarHBondContact O-N 2.96Å; S170-T172 PolarHBondContact OG-N 2.84Å; S170-T172 PolarHBondContact OG-OG1 3.08Å; S170-G173 PolarHBondContact O-N 3.2Å; S170-G173 PolarHBondContact OG-N 2.84Å; S170-R174 PolarHBondContact N-O 3.49Å; S170-R174 WeakPolarHBondContact OG-CB 3.42Å; S170-R174 PolarHBondContact OG-N 3.47Å; S170-R174 PolarHBondContact OG-O 3.19Å; S170-D186 VanDerWaalsContact CB-OD2 3.22Å; S170-D186 WeakPolarHBondContact CB-OD2 3.5Å; S170-W287 WeakPolarHBondContact O-CZ2 3.24Å
171	L	84.3	Confident	80.8	Confident	17 Å²	17	47.5 Å²	47.5	9%	0.089	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.9	170.2	-62.1	178.4	0	0	0	112.2	G173 V188 I190 I269 L270 F273 W274 W287	L171-G173 PolarHBondContact O-N 3.31Å; L171-V188 HydrophobicContact CD1-CB 4.03Å; L171-V188 HydrophobicContact CD1-CG1 4.5Å; L171-V188 HydrophobicContact CD2-CB 4.28Å; L171-V188 HydrophobicContact CD2-CG1 3.99Å; L171-V188 HydrophobicContact CG-CB 4.15Å; L171-V188 HydrophobicContact CG-CG1 4.41Å; L171-I190 HydrophobicContact CD2-CD1 4.31Å; L171-I190 HydrophobicContact CD2-CG1 4.28Å; L171-I269 HydrophobicContact CD2-CG2 4.3Å; L171-L270 HydrophobicContact CB-CD2 4.16Å; L171-F273 HydrophobicContact CD1-CB 4.11Å; L171-F273 HydrophobicContact CD2-CB 4.32Å; L171-W274 HydrophobicContact CB-CE3 3.64Å; L171-W274 HydrophobicContact CB-CZ3 3.87Å; L171-W274 HydrophobicContact CD1-CB 4.16Å; L171-W274 HydrophobicContact CD1-CE3 4.07Å; L171-W287 PolarHBondContact O-NE1 3.13Å
172	T	81.1	Confident	81.5	Confident	52 Å²	52	41.9 Å²	41.9	32%	0.319	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-3.5	173.1	53	0	0	0	0	114.7	S170 R174 W274 R290	S170-T172 PolarHBondContact O-N 2.96Å; S170-T172 PolarHBondContact OG-N 2.84Å; S170-T172 PolarHBondContact OG-OG1 3.08Å; T172-R174 VanDerWaalsContact C-N 3.33Å; T172-W274 HydrophobicContact CG2-CH2 3.56Å; T172-W274 HydrophobicContact CG2-CZ3 3.57Å; T172-R290 PolarHBondContact O-NH1 3.14Å
173	G	77.2	Confident	82	Confident	6 Å²	6	36.1 Å²	36.1	6%	0.062	17%	0.173	C	C	.	.			trans	77.8	16.5	-179.9	0	0	0	0	0	114.1	S170 L171 E175 W287	S170-G173 PolarHBondContact O-N 3.2Å; S170-G173 PolarHBondContact OG-N 2.84Å; L171-G173 PolarHBondContact O-N 3.31Å; G173-E175 PolarHBondContact O-N 3.12Å; G173-W287 VanDerWaalsContact CA-NE1 3.27Å; G173-W287 VanDerWaalsContact N-NE1 3.11Å
174	R	80.9	Confident	82.3	Confident	93 Å²	93	40.5 Å²	40.5	35%	0.351	19%	0.187	S	C	.	.			trans	-74.8	112.1	163.2	-178.7	175.6	178.4	124.2	4.9	107.2	Y169 S170 T172 I176 E181 E441	Y169-R174 CarbonylContact C-O 3.59Å; Y169-R174 WeakPolarHBondContact CA-O 3.36Å; S170-R174 PolarHBondContact N-O 3.49Å; S170-R174 WeakPolarHBondContact OG-CB 3.42Å; S170-R174 PolarHBondContact OG-N 3.47Å; S170-R174 PolarHBondContact OG-O 3.19Å; T172-R174 VanDerWaalsContact C-N 3.33Å; R174-I176 PolarHBondContact O-N 3.42Å; R174-E181 IonicContact CZ-OE1 3.17Å; R174-E181 VanDerWaalsContact CZ-OE1 3.28Å; R174-E181 IonicContact NE-OE1 3.48Å; R174-E181 PolarHBondContact NE-OE1 3.32Å; R174-E181 VanDerWaalsContact NE-OE1 3.07Å; R174-E181 IonicContact NH2-OE1 3.32Å; R174-E181 PolarHBondContact NH2-OE1 2.99Å; R174-E441 IonicContact CZ-OE1 2.71Å; R174-E441 VanDerWaalsContact CZ-OE1 3.3Å; R174-E441 IonicContact NH1-OE1 2.75Å; R174-E441 PolarHBondContact NH1-OE1 3.32Å; R174-E441 IonicContact NH1-OE2 3.51Å; R174-E441 PolarHBondContact NH1-OE2 2.69Å; R174-E441 IonicContact NH2-OE1 2.91Å; R174-E441 PolarHBondContact NH2-OE1 2.88Å
175	E	85.2	Confident	82	Confident	28 Å²	28	44.7 Å²	44.7	13%	0.131	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-58	132.2	167.1	176.6	-176.7	-119.8	0	0	110.1	N167 L168 Y169 G173 K177 R294	N167-E175 PolarHBondContact ND2-OE1 3.5Å; L168-E175 CarbonylContact O-C 3.45Å; L168-E175 WeakPolarHBondContact O-CA 3.34Å; Y169-E175 HydrophobicContact CD1-CB 3.91Å; Y169-E175 HydrophobicContact CE1-CB 3.86Å; Y169-E175 HydrophobicContact CE1-CG 4.35Å; G173-E175 PolarHBondContact O-N 3.12Å; E175-K177 HydrophobicContact CG-CG 4.26Å; E175-K177 WeakPolarHBondContact OE2-CE 3.48Å; E175-K177 IonicContact OE2-NZ 3.83Å; E175-R294 IonicContact OE1-NH1 3.56Å; E175-R294 PolarHBondContact OE1-NH1 2.88Å; E175-R294 IonicContact OE2-CZ 2.8Å; E175-R294 IonicContact OE2-NH1 3.16Å; E175-R294 PolarHBondContact OE2-NH1 2.74Å; E175-R294 IonicContact OE2-NH2 3.37Å; E175-R294 PolarHBondContact OE2-NH2 2.8Å; E175-R294 VanDerWaalsContact OE2-NH2 3.17Å
176	I	86.7	Confident	81.9	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.036	21%	0.211	C	C	.	.			trans	-81.1	118.2	175.6	-54.3	-52.2	0	0	0	108.5	L145 L168 R174 E181 L182 F189	L145-I176 HydrophobicContact CD1-CG2 4.24Å; L145-I176 HydrophobicContact CD2-CG2 4.44Å; L145-I176 WeakPolarHBondContact CD2-O 3.48Å; L168-I176 HydrophobicContact CB-CB 4.02Å; L168-I176 HydrophobicContact CB-CG1 4.09Å; L168-I176 PolarHBondContact O-N 2.86Å; R174-I176 PolarHBondContact O-N 3.42Å; I176-E181 HydrophobicContact CD1-CB 4.38Å; I176-E181 HydrophobicContact CG2-CB 4.05Å; I176-L182 HydrophobicContact CG1-CD2 4.38Å; I176-L182 HydrophobicContact CG2-CD2 3.71Å; I176-L182 HydrophobicContact CG2-CG 3.8Å; I176-F189 HydrophobicContact CD1-CD1 3.85Å; I176-F189 HydrophobicContact CD1-CE1 3.67Å; I176-F189 HydrophobicContact CG1-CD1 3.75Å; I176-F189 HydrophobicContact CG1-CE1 3.99Å
177	K	82.4	Confident	82	Confident	137 Å²	137	47.3 Å²	47.3	60%	0.596	22%	0.217	S	C	*	.			trans	-110	-12.9	-176.1	-65.5	-172	174.5	-172.1	0	114.6	E175 E181	E175-K177 HydrophobicContact CG-CG 4.26Å; E175-K177 WeakPolarHBondContact OE2-CE 3.48Å; E175-K177 IonicContact OE2-NZ 3.83Å; K177-E181 PolarHBondContact N-OE2 3.23Å
178	S	79.9	Confident	82.1	Confident	24 Å²	24	46.4 Å²	46.4	17%	0.168	21%	0.213	C	C	.	.	S	Bend	trans	-144.2	163.3	173.9	73.6	0	0	0	0	112.8	N180 E181	S178-N180 PolarHBondContact O-N 3.13Å; S178-E181 PolarHBondContact O-N 3.16Å; S178-E181 VanDerWaalsContact O-N 3.16Å
179	V	80.4	Confident	82.2	Confident	6 Å²	6	46.4 Å²	46.4	4%	0.036	21%	0.213	C	C	.	.	H	α-helix	trans	-56.1	-40.3	173.9	-179.8	0	0	0	0	110.9	V142 L145 E181 L182 F183 T1032	V142-V179 HydrophobicContact CB-CG1 4.17Å; V142-V179 HydrophobicContact CG1-CB 4.43Å; V142-V179 HydrophobicContact CG1-CG1 3.65Å; V142-V179 HydrophobicContact CG1-CG2 3.83Å; L145-V179 HydrophobicContact CB-CG2 4.31Å; L145-V179 VanDerWaalsContact N-CG2 3.27Å; V179-E181 PolarHBondContact O-N 2.94Å; V179-L182 WeakPolarHBondContact O-CB 3.47Å; V179-L182 PolarHBondContact O-N 3.47Å; V179-L182 VanDerWaalsContact O-N 3.09Å; V179-F183 HydrophobicContact CG1-CD2 4.06Å; V179-F183 HydrophobicContact CG1-CE2 3.75Å; V179-F183 WeakPolarHBondContact O-CD2 3.32Å; V179-T1032 HydrophobicContact CB-CG2 4.23Å
180	N	75.7	Confident	82.2	Confident	36 Å²	36	46.1 Å²	46.1	19%	0.193	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-26.4	-178.6	-76.2	-12.7	0	0	0	113.1	S178 F183	S178-N180 PolarHBondContact O-N 3.13Å; N180-F183 PolarHBondContact O-N 2.93Å
181	E	81.7	Confident	82.2	Confident	13 Å²	13	46.1 Å²	46.1	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-71	-34.4	175.8	-61	-162.9	119.6	0	0	112.3	R174 I176 K177 S178 V179 F183 R184	R174-E181 IonicContact CZ-OE1 3.17Å; R174-E181 VanDerWaalsContact CZ-OE1 3.28Å; R174-E181 IonicContact NE-OE1 3.48Å; R174-E181 PolarHBondContact NE-OE1 3.32Å; R174-E181 VanDerWaalsContact NE-OE1 3.07Å; R174-E181 IonicContact NH2-OE1 3.32Å; R174-E181 PolarHBondContact NH2-OE1 2.99Å; I176-E181 HydrophobicContact CD1-CB 4.38Å; I176-E181 HydrophobicContact CG2-CB 4.05Å; K177-E181 PolarHBondContact N-OE2 3.23Å; S178-E181 PolarHBondContact O-N 3.16Å; S178-E181 VanDerWaalsContact O-N 3.16Å; V179-E181 PolarHBondContact O-N 2.94Å; E181-F183 PolarHBondContact O-N 3.38Å; E181-R184 PolarHBondContact O-N 3.26Å; E181-R184 IonicContact OE1-CZ 3.3Å; E181-R184 IonicContact OE1-NH1 3.99Å; E181-R184 PolarHBondContact OE1-NH1 2.98Å; E181-R184 IonicContact OE1-NH2 2.94Å
182	L	81.5	Confident	82.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-20.1	172.5	-62.1	171.2	0	0	0	113	R116 M137 L145 V148 L168 I176 V179 F189	R116-L182 VanDerWaalsContact CD-O 3.32Å; R116-L182 WeakPolarHBondContact CD-O 3.49Å; R116-L182 PolarHBondContact NE-O 3.32Å; M137-L182 HydrophobicContact CE-CB 3.89Å; M137-L182 HydrophobicContact CE-CD1 4.16Å; M137-L182 HydrophobicContact SD-CD1 4.38Å; L145-L182 HydrophobicContact CD1-CD1 3.94Å; V148-L182 HydrophobicContact CG1-CD1 4.08Å; V148-L182 HydrophobicContact CG2-CD1 4.33Å; L168-L182 HydrophobicContact CD1-CD2 4.22Å; I176-L182 HydrophobicContact CG1-CD2 4.38Å; I176-L182 HydrophobicContact CG2-CD2 3.71Å; I176-L182 HydrophobicContact CG2-CG 3.8Å; V179-L182 WeakPolarHBondContact O-CB 3.47Å; V179-L182 PolarHBondContact O-N 3.47Å; V179-L182 VanDerWaalsContact O-N 3.09Å; L182-F189 HydrophobicContact CD2-CD1 4.16Å; L182-F189 HydrophobicContact CD2-CD2 4.11Å; L182-F189 HydrophobicContact CD2-CE1 3.97Å; L182-F189 HydrophobicContact CD2-CE2 3.93Å; L182-F189 HydrophobicContact CD2-CG 4.23Å; L182-F189 HydrophobicContact CD2-CZ 3.85Å
183	F	77.5	Confident	82.1	Confident	42 Å²	42	43.1 Å²	43.1	18%	0.184	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	9.7	179.3	-72.6	-81.3	0	0	0	114.2	R116 M137 R139 V179 N180 E181	R116-F183 HydrophobicContact CB-CD1 3.95Å; R116-F183 HydrophobicContact CB-CE1 3.77Å; R116-F183 HydrophobicContact CG-CD1 4.44Å; R116-F183 VanDerWaalsContact NH1-C 3.3Å; R116-F183 PolarHBondContact NH1-O 2.88Å; M137-F183 HydrophobicContact CB-CE1 4.33Å; M137-F183 HydrophobicContact CB-CZ 3.83Å; M137-F183 HydrophobicContact CE-CE2 4.35Å; M137-F183 HydrophobicContact CE-CZ 4.2Å; R139-F183 HydrophobicContact CB-CE1 4.16Å; R139-F183 HydrophobicContact CB-CE2 4.39Å; R139-F183 HydrophobicContact CB-CZ 4.06Å; V179-F183 HydrophobicContact CG1-CD2 4.06Å; V179-F183 HydrophobicContact CG1-CE2 3.75Å; V179-F183 WeakPolarHBondContact O-CD2 3.32Å; N180-F183 PolarHBondContact O-N 2.93Å; E181-F183 PolarHBondContact O-N 3.38Å
184	R	78.3	Confident	81.4	Confident	134 Å²	134	47.6 Å²	47.6	51%	0.506	22%	0.217	S	C	.	.	S	Bend	trans	-80.8	-130.5	178.2	-68.6	-177.5	176.3	156.7	1.5	113.6	R116 E181	R116-R184 PolarHBondContact NH1-O 3.48Å; R116-R184 PolarHBondContact NH2-O 3.06Å; E181-R184 PolarHBondContact O-N 3.26Å; E181-R184 IonicContact OE1-CZ 3.3Å; E181-R184 IonicContact OE1-NH1 3.99Å; E181-R184 PolarHBondContact OE1-NH1 2.98Å; E181-R184 IonicContact OE1-NH2 2.94Å
185	K	74.5	Confident	80.1	Confident	142 Å²	142	47.3 Å²	47.3	62%	0.617	22%	0.219	S	C	*	.	S	Bend	trans	-83.9	-41.1	178.5	-71	-178.6	176	178.2	0	112.4	R116 K187 E344	R116-K185 PolarHBondContact NH2-O 2.99Å; K185-K187 PolarHBondContact O-N 2.99Å; K185-E344 IonicContact NZ-OE1 2.79Å; K185-E344 PolarHBondContact NZ-OE1 3.4Å; K185-E344 IonicContact NZ-OE2 2.63Å; K185-E344 PolarHBondContact NZ-OE2 3.46Å
186	D	80.7	Confident	78.4	Confident	54 Å²	54	53 Å²	53	29%	0.289	24%	0.244	S	C	.	.			trans	-58.9	130	-172.4	-60.4	-30.9	0	0	0	114.3	R116 S170 F189	R116-D186 PolarHBondContact NH2-O 3.45Å; S170-D186 VanDerWaalsContact CB-OD2 3.22Å; S170-D186 WeakPolarHBondContact CB-OD2 3.5Å; D186-F189 HydrophobicContact CB-CE1 3.64Å; D186-F189 HydrophobicContact CB-CZ 3.7Å; D186-F189 WeakPolarHBondContact O-CZ 3.38Å
187	K	83.6	Confident	76.6	Confident	157 Å²	157	52.7 Å²	52.7	68%	0.683	24%	0.242	S	C	*	.			trans	-103.3	-15.9	177	-65.6	172.7	-175.1	167	0	113.3	I118 T119 K185	I118-K187 CarbonylContact C-O 3.54Å; I118-K187 WeakPolarHBondContact CA-O 3.41Å; T119-K187 PolarHBondContact N-O 2.89Å; K185-K187 PolarHBondContact O-N 2.99Å
188	V	87.3	Confident	74.8	Confident	20 Å²	20	47.1 Å²	47.1	12%	0.121	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.2	-174.9	-172	0	0	0	0	109.9	T119 V121 L171 F273	T119-V188 CarbonylContact O-C 3.6Å; T119-V188 VanDerWaalsContact O-CA 3.28Å; T119-V188 WeakPolarHBondContact O-CA 3.33Å; V121-V188 HydrophobicContact CG2-CG1 3.95Å; L171-V188 HydrophobicContact CD1-CB 4.03Å; L171-V188 HydrophobicContact CD1-CG1 4.5Å; L171-V188 HydrophobicContact CD2-CB 4.28Å; L171-V188 HydrophobicContact CD2-CG1 3.99Å; L171-V188 HydrophobicContact CG-CB 4.15Å; L171-V188 HydrophobicContact CG-CG1 4.41Å; V188-F273 HydrophobicContact CG1-CB 4.08Å; V188-F273 HydrophobicContact CG1-CD1 3.86Å; V188-F273 HydrophobicContact CG1-CD2 4.37Å; V188-F273 HydrophobicContact CG1-CE1 4.4Å; V188-F273 HydrophobicContact CG1-CG 3.84Å; V188-F273 HydrophobicContact CG2-CB 4.41Å; V188-F273 HydrophobicContact CG2-CD1 3.95Å; V188-F273 HydrophobicContact CG2-CG 4.46Å
189	F	90.8	Very high	72.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.8	-178.9	-54	-83.2	0	0	0	111.1	I118 T119 V120 V121 L168 Y169 I176 L182 D186	I118-F189 HydrophobicContact CB-CD2 4.3Å; I118-F189 HydrophobicContact CB-CE2 3.97Å; I118-F189 HydrophobicContact CD1-CD2 3.99Å; I118-F189 HydrophobicContact CD1-CE2 4.02Å; I118-F189 HydrophobicContact CG2-CE2 3.91Å; T119-F189 PolarHBondContact O-N 2.98Å; V120-F189 CarbonylContact C-O 3.18Å; V120-F189 VanDerWaalsContact CA-O 3.31Å; V120-F189 WeakPolarHBondContact CA-O 3.31Å; V121-F189 PolarHBondContact N-O 3.26Å; L168-F189 HydrophobicContact CD2-CB 4.07Å; Y169-F189 CarbonylContact O-C 3.55Å; Y169-F189 WeakPolarHBondContact O-CA 3.44Å; Y169-F189 WeakPolarHBondContact O-CB 3.43Å; I176-F189 HydrophobicContact CD1-CD1 3.85Å; I176-F189 HydrophobicContact CD1-CE1 3.67Å; I176-F189 HydrophobicContact CG1-CD1 3.75Å; I176-F189 HydrophobicContact CG1-CE1 3.99Å; L182-F189 HydrophobicContact CD2-CD1 4.16Å; L182-F189 HydrophobicContact CD2-CD2 4.11Å; L182-F189 HydrophobicContact CD2-CE1 3.97Å; L182-F189 HydrophobicContact CD2-CE2 3.93Å; L182-F189 HydrophobicContact CD2-CG 4.23Å; L182-F189 HydrophobicContact CD2-CZ 3.85Å; D186-F189 HydrophobicContact CB-CE1 3.64Å; D186-F189 HydrophobicContact CB-CZ 3.7Å; D186-F189 WeakPolarHBondContact O-CZ 3.38Å
190	I	89.4	Confident	70.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.4	176.4	-51.3	-177.9	0	0	0	108.9	V121 L168 Y169 L171 M197 I269 W287	V121-I190 WeakPolarHBondContact O-CA 3.32Å; L168-I190 CarbonylContact C-O 3.5Å; L168-I190 WeakPolarHBondContact CA-O 3.46Å; Y169-I190 PolarHBondContact N-O 3.3Å; Y169-I190 PolarHBondContact O-N 3.19Å; L171-I190 HydrophobicContact CD2-CD1 4.31Å; L171-I190 HydrophobicContact CD2-CG1 4.28Å; I190-M197 HydrophobicContact CG2-CE 3.63Å; I190-M197 HydrophobicContact CG2-SD 4.1Å; I190-I269 HydrophobicContact CD1-CB 4.29Å; I190-I269 HydrophobicContact CD1-CD1 4.19Å; I190-I269 HydrophobicContact CD1-CG2 3.67Å; I190-I269 HydrophobicContact CG1-CG2 4.03Å; I190-I269 HydrophobicContact CG2-CD1 4.16Å; I190-W287 HydrophobicContact CB-CH2 4.3Å; I190-W287 HydrophobicContact CD1-CH2 4.02Å; I190-W287 HydrophobicContact CD1-CZ2 3.74Å
191	A	87.8	Confident	68.4	Low	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.5	-179	0	0	0	0	0	112.3	V120 V121 R122 I165 L168	V120-A191 HydrophobicContact CG1-CB 3.76Å; V121-A191 PolarHBondContact O-N 2.98Å; R122-A191 HydrophobicContact CB-CB 4.29Å; R122-A191 HydrophobicContact CG-CB 4.15Å; I165-A191 HydrophobicContact CD1-CB 3.95Å; I165-A191 HydrophobicContact CG1-CB 4.16Å; I165-A191 HydrophobicContact CG2-CB 3.9Å; L168-A191 HydrophobicContact CD2-CB 3.91Å
192	S	82.7	Confident	66	Low	2 Å²	2	61.6 Å²	61.6	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	173.8	143.6	0	0	0	0	110	R166 N167 H195	R166-S192 PolarHBondContact N-O 2.89Å; N167-S192 PolarHBondContact N-O 3.17Å; N167-S192 VanDerWaalsContact N-O 3.07Å; N167-S192 PolarHBondContact O-N 3.19Å; S192-H195 PolarHBondContact OG-O 3.1Å
193	G	79.5	Confident	63.8	Low	4 Å²	4	66.7 Å²	66.7	4%	0.041	32%	0.32	C	S	.	.			trans	-114	-127.8	-172.3	0	0	0	0	0	113.5	D163 P164 R166 H195	D163-G193 WeakPolarHBondContact OD1-CA 3.49Å; P164-G193 WeakPolarHBondContact O-CA 3.46Å; R166-G193 WeakPolarHBondContact CB-O 3.47Å; R166-G193 WeakPolarHBondContact CD-O 3.27Å; G193-H195 VanDerWaalsContact C-N 3.28Å; G193-H195 PolarHBondContact O-N 3.42Å
194	L	63	Low	61.5	Low	101 Å²	101	71.6 Å²	71.6	53%	0.529	34%	0.344	S	S	.	.	S	Bend	trans	-58.7	-41.3	178.3	-157.2	86.2	0	0	0	111.7	D163	D163-L194 PolarHBondContact OD1-N 3.48Å
195	H	53.4	Low	59.3	Low	87 Å²	87	70.9 Å²	70.9	40%	0.403	35%	0.35	S	S	.	.	S	Bend	trans	-83.2	123.1	172.5	-77.4	-105.4	0	0	0	110.7	S192 G193	S192-H195 PolarHBondContact OG-O 3.1Å; G193-H195 VanDerWaalsContact C-N 3.28Å; G193-H195 PolarHBondContact O-N 3.42Å
196	K	49.2	Very low	57.2	Low	147 Å²	147	69.9 Å²	69.9	64%	0.639	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-59.1	152.3	164.4	-68.2	-179.7	179.9	176.5	0	109.6	F198	K196-F198 PolarHBondContact O-N 3.48Å
197	M	50	Low	54.9	Low	1 Å²	1	73.9 Å²	73.9	1%	0.005	37%	0.366	C	S	.	.	S	Bend	trans	-72.4	119.8	167.5	-57.5	-177.8	70.8	0	0	106.8	Y169 I190 L261 I266 W287 L291	Y169-M197 HydrophobicContact CD2-SD 3.61Å; Y169-M197 HydrophobicContact CE2-CG 4.25Å; Y169-M197 HydrophobicContact CE2-SD 3.64Å; I190-M197 HydrophobicContact CG2-CE 3.63Å; I190-M197 HydrophobicContact CG2-SD 4.1Å; M197-L261 HydrophobicContact CB-CB 4.36Å; M197-L261 HydrophobicContact CE-CB 4.25Å; M197-L261 HydrophobicContact CE-CD1 3.87Å; M197-L261 HydrophobicContact CE-CD2 3.87Å; M197-L261 HydrophobicContact CE-CG 4.2Å; M197-L261 HydrophobicContact CG-CB 4.09Å; M197-L261 HydrophobicContact CG-CD1 3.87Å; M197-L261 HydrophobicContact SD-CD1 4.18Å; M197-I266 HydrophobicContact CE-CD1 3.93Å; M197-I266 HydrophobicContact CE-CG1 3.79Å; M197-W287 HydrophobicContact CB-CZ3 4.24Å; M197-W287 HydrophobicContact CE-CE3 4.42Å; M197-W287 HydrophobicContact CE-CH2 3.56Å; M197-W287 HydrophobicContact CE-CZ3 3.37Å; M197-W287 HydrophobicContact CG-CZ3 4.46Å; M197-W287 HydrophobicContact SD-CH2 3.71Å; M197-W287 HydrophobicContact SD-CZ3 3.48Å; M197-W287 WeakPolarHBondContact SD-CZ3 3.23Å; M197-L291 HydrophobicContact CB-CD1 4.31Å
198	F	44.1	Very low	52.4	Low	19 Å²	19	70.7 Å²	70.7	8%	0.083	36%	0.363	C	S	.	.	S	Bend	trans	61.3	124.1	-156.4	-39.2	-54.7	0	0	0	114.4	K196 I201 E260 P263 I266 E288 L291	K196-F198 PolarHBondContact O-N 3.48Å; F198-I201 HydrophobicContact CB-CD1 4.07Å; F198-I201 HydrophobicContact CB-CG1 4.35Å; F198-E260 WeakPolarHBondContact CA-OE1 3.47Å; F198-P263 HydrophobicContact CE1-CB 4.44Å; F198-P263 HydrophobicContact CE1-CG 3.75Å; F198-P263 HydrophobicContact CZ-CG 4.41Å; F198-I266 HydrophobicContact CE1-CD1 4.02Å; F198-I266 HydrophobicContact CE2-CD1 4.18Å; F198-I266 HydrophobicContact CZ-CD1 3.48Å; F198-I266 VanDerWaalsContact CZ-CD1 3.48Å; F198-E288 HydrophobicContact CD2-CG 4.17Å; F198-E288 HydrophobicContact CE1-CG 4.44Å; F198-E288 HydrophobicContact CE2-CB 4.1Å; F198-E288 HydrophobicContact CE2-CG 3.51Å; F198-E288 HydrophobicContact CZ-CG 3.66Å; F198-L291 HydrophobicContact CD2-CB 4.32Å; F198-L291 HydrophobicContact CD2-CD1 3.56Å; F198-L291 HydrophobicContact CE2-CD1 3.71Å
199	G	35.2	Very low	49.6	Very low	27 Å²	27	76 Å²	76	28%	0.278	39%	0.391	S	S	.	.			trans	-85.1	-155.8	170.4	0	0	0	0	0	110.9	I201 E260	G199-I201 WeakPolarHBondContact O-CG1 3.17Å; G199-I201 PolarHBondContact O-N 2.84Å; G199-E260 WeakPolarHBondContact CA-OE2 3.3Å; G199-E260 PolarHBondContact N-OE1 3.15Å; G199-E260 PolarHBondContact N-OE2 2.92Å
200	N	33.1	Very low	46.6	Very low	139 Å²	139	83.5 Å²	83.5	74%	0.743	43%	0.431	S	S	*	.			trans	-69.4	96.6	-174.3	-68.5	-11.3	0	0	0	111.4	H202	N200-H202 PolarHBondContact O-N 3.23Å
201	I	33.9	Very low	43.8	Very low	72 Å²	72	89.3 Å²	89.3	37%	0.369	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	55.6	173.4	-41.5	-179.4	0	0	0	110.8	F198 G199 L205 R292	F198-I201 HydrophobicContact CB-CD1 4.07Å; F198-I201 HydrophobicContact CB-CG1 4.35Å; G199-I201 WeakPolarHBondContact O-CG1 3.17Å; G199-I201 PolarHBondContact O-N 2.84Å; I201-L205 HydrophobicContact CG2-CD1 4.11Å; I201-R292 HydrophobicContact CD1-CG 4.13Å
202	H	30.5	Very low	41.1	Very low	146 Å²	146	97 Å²	97	68%	0.676	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.4	-0.6	178.9	-115.9	-66.6	0	0	0	112.7	N200	N200-H202 PolarHBondContact O-N 3.23Å
203	I	35.4	Very low	38.5	Very low	107 Å²	107	101.8 Å²	101.8	55%	0.549	54%	0.541	S	S	.	.	S	Bend	trans	-113.2	-20	-175.6	-62.7	177.8	0	0	0	112.4	K207	I203-K207 VanDerWaalsContact O-CE 3.3Å; I203-K207 WeakPolarHBondContact O-CE 3.42Å; I203-K207 WeakPolarHBondContact O-CG 3.45Å
204	E	30	Very low	36.1	Very low	144 Å²	144	109.1 Å²	109.1	67%	0.673	58%	0.579	S	S	*	*	S	Bend	trans	-103.9	-23.2	-179.1	-53.8	-134.9	112.5	0	0	113.9	N206 K207	E204-N206 PolarHBondContact O-N 3.39Å; E204-K207 PolarHBondContact O-N 3.24Å; E204-K207 IonicContact OE1-NZ 2.75Å; E204-K207 PolarHBondContact OE1-NZ 2.87Å
205	L	31	Very low	34.6	Very low	120 Å²	120	109.3 Å²	109.3	63%	0.628	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-11.6	171.2	-71	170.2	0	0	0	113.5	I201 S208	I201-L205 HydrophobicContact CG2-CD1 4.11Å; L205-S208 PolarHBondContact O-OG 3.48Å
206	N	30.7	Very low	33.7	Very low	120 Å²	120	111.2 Å²	111.2	64%	0.642	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	9	172.9	-72.9	19	0	0	0	112.7	E204	E204-N206 PolarHBondContact O-N 3.39Å
207	K	32.4	Very low	32.9	Very low	138 Å²	138	115 Å²	115	60%	0.6	61%	0.613	S	S	*	*	S	Bend	trans	-98.4	-4	176	-68.4	177	-172.6	172.3	0	113.7	I203 E204	I203-K207 VanDerWaalsContact O-CE 3.3Å; I203-K207 WeakPolarHBondContact O-CE 3.42Å; I203-K207 WeakPolarHBondContact O-CG 3.45Å; E204-K207 PolarHBondContact O-N 3.24Å; E204-K207 IonicContact OE1-NZ 2.75Å; E204-K207 PolarHBondContact OE1-NZ 2.87Å
208	S	30.2	Very low	32.1	Very low	90 Å²	90	117.3 Å²	117.3	63%	0.629	63%	0.632	S	S	*	*	S	Bend	trans	-99.1	-9.9	179.5	53.9	0	0	0	0	114	L205	L205-S208 PolarHBondContact O-OG 3.48Å
209	N	29.6	Very low	31.5	Very low	131 Å²	131	121.5 Å²	121.5	70%	0.701	66%	0.656	S	S	*	*			trans	-110	114	178.6	-66.7	6.4	0	0	0	109
210	N	27.1	Very low	31.5	Very low	159 Å²	159	125.2 Å²	125.2	85%	0.85	67%	0.669	S	S	*	*			trans	-68	176.7	167.1	-85.6	-29.3	0	0	0	111.2
211	V	30.7	Very low	31.4	Very low	122 Å²	122	127.1 Å²	127.1	74%	0.739	67%	0.667	S	S	*	*			trans	90	104.4	165.7	-168.3	0	0	0	0	115.4
212	D	31.9	Very low	31.5	Very low	160 Å²	160	129 Å²	129	86%	0.856	68%	0.676	S	S	*	*			trans	78.3	137.6	146	-58.8	-5.6	0	0	0	123.4
213	S	26.8	Very low	31.6	Very low	103 Å²	103	126.4 Å²	126.4	72%	0.72	67%	0.668	S	S	*	*			trans	-94.9	128.9	-173.1	53	0	0	0	0	112.3
214	N	30	Very low	31.5	Very low	158 Å²	158	125.5 Å²	125.5	85%	0.845	66%	0.664	S	S	*	*			trans	-173.7	69.9	149.4	-100.1	-38.2	0	0	0	113.3
215	T	30.6	Very low	31.7	Very low	106 Å²	106	122.8 Å²	122.8	65%	0.65	66%	0.66	S	S	*	*			trans	-151.7	35.7	173.9	-25.9	0	0	0	0	116.3	R217 A218	T215-R217 PolarHBondContact O-N 3.46Å; T215-A218 HydrophobicContact CG2-CB 4.1Å; T215-A218 PolarHBondContact O-N 2.86Å
216	T	35.2	Very low	31.8	Very low	127 Å²	127	122 Å²	122	78%	0.779	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-14.6	-179.8	-36.8	0	0	0	0	114.5
217	R	32.6	Very low	31.9	Very low	226 Å²	226	122.6 Å²	122.6	85%	0.853	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-18.2	-176	-155.4	168.2	-174	160.8	0.9	114.9	T215	T215-R217 PolarHBondContact O-N 3.46Å
218	A	33	Very low	32	Very low	50 Å²	50	122.4 Å²	122.4	41%	0.413	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-40.3	-176.4	0	0	0	0	0	113.6	T215 N220 Y221	T215-A218 HydrophobicContact CG2-CB 4.1Å; T215-A218 PolarHBondContact O-N 2.86Å; A218-N220 VanDerWaalsContact C-N 3.26Å; A218-N220 PolarHBondContact O-N 3.19Å; A218-Y221 PolarHBondContact O-N 2.65Å
219	N	32.3	Very low	32.2	Very low	107 Å²	107	122.8 Å²	122.8	57%	0.572	66%	0.658	S	S	*	*	H	α-helix	trans	-64.3	-27.3	-173	-72.1	-29.2	0	0	0	113.9	Y221 I222 N223	N219-Y221 VanDerWaalsContact C-N 3.35Å; N219-Y221 PolarHBondContact O-N 2.9Å; N219-I222 PolarHBondContact O-N 3.39Å; N219-N223 PolarHBondContact O-N 3.14Å; N219-N223 PolarHBondContact O-ND2 3.15Å
220	N	34.2	Very low	32.3	Very low	105 Å²	105	123 Å²	123	56%	0.561	66%	0.656	S	S	*	*	H	α-helix	trans	-72.4	-25.5	179.1	-70.2	-6.3	0	0	0	113.2	A218 N224	A218-N220 VanDerWaalsContact C-N 3.26Å; A218-N220 PolarHBondContact O-N 3.19Å; N220-N224 PolarHBondContact O-N 2.96Å
221	Y	32.4	Very low	32.4	Very low	179 Å²	179	120 Å²	120	70%	0.702	65%	0.648	S	S	*	*	H	α-helix	trans	-71.7	-38.6	175.3	-100.6	-87.8	0	0	0	112.3	A218 N219 N223 N224 C225	A218-Y221 PolarHBondContact O-N 2.65Å; N219-Y221 VanDerWaalsContact C-N 3.35Å; N219-Y221 PolarHBondContact O-N 2.9Å; Y221-N223 PolarHBondContact O-N 3.27Å; Y221-N224 PolarHBondContact O-N 2.95Å; Y221-C225 PolarHBondContact O-N 2.99Å; Y221-C225 VanDerWaalsContact O-N 3.17Å; Y221-C225 PolarHBondContact O-SG 3.37Å
222	I	36	Very low	32.4	Very low	110 Å²	110	118.4 Å²	118.4	56%	0.564	64%	0.641	S	S	*	*	H	α-helix	trans	-66.4	-39.9	180	-61.2	176.5	0	0	0	110.8	N219 C225	N219-I222 PolarHBondContact O-N 3.39Å; I222-C225 PolarHBondContact O-N 2.99Å
223	N	32.7	Very low	32.4	Very low	93 Å²	93	117.7 Å²	117.7	50%	0.497	64%	0.637	S	S	.	*	H	α-helix	trans	-66.5	-37.3	175.6	-70.5	-29.1	0	0	0	112.7	N219 Y221 I226 H227	N219-N223 PolarHBondContact O-N 3.14Å; N219-N223 PolarHBondContact O-ND2 3.15Å; Y221-N223 PolarHBondContact O-N 3.27Å; N223-I226 PolarHBondContact O-N 3.45Å; N223-H227 PolarHBondContact O-N 3.16Å; N223-H227 VanDerWaalsContact O-N 3.16Å
224	N	33	Very low	32.8	Very low	88 Å²	88	120.3 Å²	120.3	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-65.9	-37.8	176.7	-82.3	-13.9	0	0	0	113	N220 Y221 I226 H227 Q228	N220-N224 PolarHBondContact O-N 2.96Å; Y221-N224 PolarHBondContact O-N 2.95Å; N224-I226 PolarHBondContact O-N 3.38Å; N224-H227 PolarHBondContact O-N 3.04Å; N224-Q228 WeakPolarHBondContact O-CG 3.32Å; N224-Q228 PolarHBondContact O-N 2.92Å
225	C	33.2	Very low	33	Very low	86 Å²	86	117.9 Å²	117.9	58%	0.581	64%	0.637	S	S	*	*	H	α-helix	trans	-62.4	-28.1	175.5	-69	0	0	0	0	113.1	Y221 I222	Y221-C225 PolarHBondContact O-N 2.99Å; Y221-C225 VanDerWaalsContact O-N 3.17Å; Y221-C225 PolarHBondContact O-SG 3.37Å; I222-C225 PolarHBondContact O-N 2.99Å
226	I	33.9	Very low	33	Very low	104 Å²	104	120.4 Å²	120.4	53%	0.533	64%	0.641	S	S	.	*	H	α-helix	trans	-76.2	-44	174.2	-64.2	172.5	0	0	0	110.1	N223 N224 S229	N223-I226 PolarHBondContact O-N 3.45Å; N224-I226 PolarHBondContact O-N 3.38Å; I226-S229 PolarHBondContact O-OG 2.83Å
227	H	32.6	Very low	32.7	Very low	132 Å²	132	124 Å²	124	61%	0.611	65%	0.646	S	S	*	*	H	α-helix	trans	-67.9	-39.3	179.4	-102	-90.1	0	0	0	114.6	N223 N224 S229 M230	N223-H227 PolarHBondContact O-N 3.16Å; N223-H227 VanDerWaalsContact O-N 3.16Å; N224-H227 PolarHBondContact O-N 3.04Å; H227-S229 PolarHBondContact O-N 2.98Å; H227-M230 PolarHBondContact O-N 3.49Å
228	Q	33.6	Very low	32.6	Very low	135 Å²	135	117.9 Å²	117.9	63%	0.631	64%	0.638	S	S	*	*	H	α-helix	trans	-65.2	-24.7	-178.2	-74.2	179.3	-13.9	0	0	113	N224 M230 S231	N224-Q228 WeakPolarHBondContact O-CG 3.32Å; N224-Q228 PolarHBondContact O-N 2.92Å; Q228-M230 PolarHBondContact O-N 2.83Å; Q228-M230 VanDerWaalsContact O-N 3.14Å; Q228-S231 PolarHBondContact O-N 2.93Å; Q228-S231 PolarHBondContact O-OG 2.73Å
229	S	34.5	Very low	32.5	Very low	97 Å²	97	125 Å²	125	68%	0.678	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-9.1	177	74.9	0	0	0	0	115.2	I226 H227	I226-S229 PolarHBondContact O-OG 2.83Å; H227-S229 PolarHBondContact O-N 2.98Å
230	M	31.5	Very low	32.2	Very low	137 Å²	137	128 Å²	128	68%	0.675	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	16.2	-178.8	-63	-167.6	-71.2	0	0	114.3	H227 Q228	H227-M230 PolarHBondContact O-N 3.49Å; Q228-M230 PolarHBondContact O-N 2.83Å; Q228-M230 VanDerWaalsContact O-N 3.14Å
231	S	29.2	Very low	31.9	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	69%	0.688	S	S	*	*			trans	-105.5	58.7	-172.7	60.4	0	0	0	0	114.8	Q228	Q228-S231 PolarHBondContact O-N 2.93Å; Q228-S231 PolarHBondContact O-OG 2.73Å
232	C	31.5	Very low	31.7	Very low	88 Å²	88	127.5 Å²	127.5	60%	0.595	69%	0.69	S	S	*	*			trans	-139.9	101.4	172.4	-173.2	0	0	0	0	112.7	N234	C232-N234 PolarHBondContact O-N 2.96Å
233	N	31.1	Very low	31.3	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	9.7	-166.3	-69.7	-7.7	0	0	0	116.3
234	N	35	Very low	31	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-4.9	-177.5	-83.2	-22.2	0	0	0	115.4	C232	C232-N234 PolarHBondContact O-N 2.96Å
235	C	34.4	Very low	30.8	Very low	108 Å²	108	135.8 Å²	135.8	73%	0.73	73%	0.731	S	S	*	*			trans	-96.5	8.5	-174.7	-65.2	0	0	0	0	115	K237	C235-K237 PolarHBondContact O-N 3.47Å
236	Q	30.3	Very low	30.8	Very low	158 Å²	158	137.9 Å²	137.9	74%	0.738	74%	0.737	S	S	*	*			trans	-86.7	17.9	-157.8	-134.1	175.3	15.8	0	0	116.5
237	K	29.6	Very low	30.7	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	74%	0.739	S	S	*	*	S	Bend	trans	-134	36.1	-169.5	-70.7	-171.2	179.1	176	0	117.2	C235	C235-K237 PolarHBondContact O-N 3.47Å
238	S	31.4	Very low	31.3	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	73%	0.726	S	S	*	*	S	Bend	trans	-153.2	11.1	166.2	63	0	0	0	0	117.5
239	F	30.1	Very low	31.7	Very low	199 Å²	199	139.3 Å²	139.3	87%	0.873	74%	0.74	S	S	*	*			trans	-137.4	48.6	-176.7	-91.4	-79	0	0	0	114.3
240	H	26.7	Very low	32.1	Very low	170 Å²	170	141 Å²	141	79%	0.787	74%	0.742	S	S	*	*			trans	-111.2	73	177.1	-108.7	-85.1	0	0	0	113.3
241	H	28	Very low	32.3	Very low	203 Å²	203	136.4 Å²	136.4	94%	0.94	73%	0.729	S	S	*	*	S	Bend	trans	-165.1	103.9	154.6	-107.5	-73.5	0	0	0	108.9
242	G	27.7	Very low	32.6	Very low	71 Å²	71	136.2 Å²	136.2	73%	0.732	72%	0.721	S	S	*	*	S	Bend	trans	158.5	-44.9	175.1	0	0	0	0	0	115	L244	G242-L244 PolarHBondContact O-N 2.83Å; G242-L244 VanDerWaalsContact O-N 3.15Å
243	F	26.7	Very low	32.6	Very low	219 Å²	219	138.3 Å²	138.3	96%	0.961	73%	0.725	S	S	*	*			trans	-85.6	83.4	176.5	-82.6	-88.7	0	0	0	111.4
244	L	27.6	Very low	32.6	Very low	157 Å²	157	135.4 Å²	135.4	82%	0.822	71%	0.712	S	S	*	*			trans	-109.9	126.1	154.7	-78.6	170.6	0	0	0	107.9	G242 N246	G242-L244 PolarHBondContact O-N 2.83Å; G242-L244 VanDerWaalsContact O-N 3.15Å; L244-N246 PolarHBondContact O-N 3.11Å
245	S	28.8	Very low	32.3	Very low	89 Å²	89	138 Å²	138	62%	0.622	71%	0.71	S	S	*	*			trans	-70.6	112.9	172.7	49.7	0	0	0	0	109.4	Q247	S245-Q247 VanDerWaalsContact C-N 3.35Å; S245-Q247 PolarHBondContact O-N 3.32Å
246	N	32.2	Very low	32	Very low	131 Å²	131	137.9 Å²	137.9	70%	0.701	71%	0.711	S	S	*	*			trans	-66.6	96.8	168.3	-74.8	-17.4	0	0	0	108.9	L244 V254	L244-N246 PolarHBondContact O-N 3.11Å; N246-V254 WeakPolarHBondContact O-CB 3.49Å; N246-V254 WeakPolarHBondContact O-CG2 3.47Å; N246-V254 PolarHBondContact O-N 2.87Å
247	Q	32.8	Very low	31.9	Very low	123 Å²	123	136.9 Å²	136.9	58%	0.575	71%	0.71	S	S	*	*	B	Isolated β-bridge	trans	-72.8	146.6	157.4	-71.3	173.4	-16.9	0	0	108.7	S245 N252	S245-Q247 VanDerWaalsContact C-N 3.35Å; S245-Q247 PolarHBondContact O-N 3.32Å; Q247-N252 VanDerWaalsContact CA-O 3.3Å; Q247-N252 WeakPolarHBondContact CA-O 3.2Å
248	D	44.2	Very low	32.3	Very low	65 Å²	65	129.6 Å²	129.6	35%	0.348	69%	0.688	S	S	.	*			trans	-75.6	179.2	164.4	68.8	12.3	0	0	0	110.9	N250 G251 N252 V254	D248-N250 PolarHBondContact O-N 2.9Å; D248-N250 VanDerWaalsContact OD1-C 3.26Å; D248-N250 VanDerWaalsContact OD1-CA 3.3Å; D248-N250 WeakPolarHBondContact OD1-CA 3.3Å; D248-N250 WeakPolarHBondContact OD1-CB 3.43Å; D248-N250 PolarHBondContact OD1-N 3.34Å; D248-G251 PolarHBondContact O-N 3.05Å; D248-G251 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact OD1-N 3.4Å; D248-G251 VanDerWaalsContact OD1-N 3.07Å; D248-N252 PolarHBondContact N-O 3.23Å; D248-N252 VanDerWaalsContact N-O 3.14Å; D248-N252 PolarHBondContact OD1-N 3.43Å; D248-N252 PolarHBondContact OD1-ND2 3.05Å; D248-N252 PolarHBondContact OD2-ND2 2.87Å; D248-V254 HydrophobicContact CB-CG2 4.02Å
249	K	43.2	Very low	33	Very low	212 Å²	212	128.3 Å²	128.3	92%	0.922	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-8	177.4	-68.9	-172.1	175.9	-173.9	0	114
250	N	42.7	Very low	34.2	Very low	133 Å²	133	122.7 Å²	122.7	71%	0.711	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	9.4	-178	-57.3	5.5	0	0	0	111.2	D248 N252	D248-N250 PolarHBondContact O-N 2.9Å; D248-N250 VanDerWaalsContact OD1-C 3.26Å; D248-N250 VanDerWaalsContact OD1-CA 3.3Å; D248-N250 WeakPolarHBondContact OD1-CA 3.3Å; D248-N250 WeakPolarHBondContact OD1-CB 3.43Å; D248-N250 PolarHBondContact OD1-N 3.34Å; N250-N252 VanDerWaalsContact C-N 3.31Å; N250-N252 PolarHBondContact O-N 3.4Å
251	G	35	Very low	35.8	Very low	40 Å²	40	115.5 Å²	115.5	41%	0.412	62%	0.62	S	S	.	*			trans	80.3	0.7	178.2	0	0	0	0	0	115.3	D248	D248-G251 PolarHBondContact O-N 3.05Å; D248-G251 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact OD1-N 3.4Å; D248-G251 VanDerWaalsContact OD1-N 3.07Å
252	N	35.3	Very low	37.6	Very low	93 Å²	93	111.9 Å²	111.9	50%	0.497	60%	0.601	S	S	.	*			trans	-73.2	136.6	-177.4	-61.5	-66.4	0	0	0	111.3	Q247 D248 N250 V254	Q247-N252 VanDerWaalsContact CA-O 3.3Å; Q247-N252 WeakPolarHBondContact CA-O 3.2Å; D248-N252 PolarHBondContact N-O 3.23Å; D248-N252 VanDerWaalsContact N-O 3.14Å; D248-N252 PolarHBondContact OD1-N 3.43Å; D248-N252 PolarHBondContact OD1-ND2 3.05Å; D248-N252 PolarHBondContact OD2-ND2 2.87Å; N250-N252 VanDerWaalsContact C-N 3.31Å; N250-N252 PolarHBondContact O-N 3.4Å; N252-V254 PolarHBondContact O-N 2.87Å
253	I	31.3	Very low	39.6	Very low	131 Å²	131	110 Å²	110	67%	0.672	58%	0.576	S	S	*	*	B	Isolated β-bridge	trans	-70.1	102.5	174.5	-58.3	174.6	0	0	0	108.8	R255	I253-R255 PolarHBondContact O-N 3.32Å
254	V	31.7	Very low	41.5	Very low	83 Å²	83	104.2 Å²	104.2	50%	0.503	55%	0.552	S	S	.	*			trans	-71.1	95.4	177	-175.4	0	0	0	0	109	N246 D248 N252 S256	N246-V254 WeakPolarHBondContact O-CB 3.49Å; N246-V254 WeakPolarHBondContact O-CG2 3.47Å; N246-V254 PolarHBondContact O-N 2.87Å; D248-V254 HydrophobicContact CB-CG2 4.02Å; N252-V254 PolarHBondContact O-N 2.87Å; V254-S256 PolarHBondContact O-N 3.1Å
255	R	28.4	Very low	43.7	Very low	212 Å²	212	98.9 Å²	98.9	80%	0.8	52%	0.524	S	S	*	.			trans	-57.6	110	168.2	-74.5	-175.9	175.6	176.9	-0.3	108.7	I253 N257	I253-R255 PolarHBondContact O-N 3.32Å; R255-N257 PolarHBondContact O-N 3.28Å
256	S	28.3	Very low	45.9	Very low	107 Å²	107	94.6 Å²	94.6	75%	0.748	50%	0.495	S	S	*	.			trans	-68.7	97.8	174.8	56.7	0	0	0	0	109.4	V254 A258	V254-S256 PolarHBondContact O-N 3.1Å; S256-A258 PolarHBondContact O-N 2.86Å
257	N	29	Very low	48	Very low	137 Å²	137	92.9 Å²	92.9	73%	0.733	48%	0.479	S	S	*	.			trans	-68.3	75.8	177.7	-72.6	-19.6	0	0	0	111	R255 T259	R255-N257 PolarHBondContact O-N 3.28Å; N257-T259 PolarHBondContact O-N 3.19Å
258	A	36.3	Very low	50.1	Low	50 Å²	50	88.8 Å²	88.8	41%	0.413	47%	0.466	S	S	.	.			trans	-66.1	102.5	168.5	0	0	0	0	0	108.3	S256 E260	S256-A258 PolarHBondContact O-N 2.86Å; A258-E260 PolarHBondContact O-N 2.73Å
259	T	48.1	Very low	51.9	Low	70 Å²	70	85.8 Å²	85.8	43%	0.429	45%	0.449	S	S	.	.			trans	-64.2	117.3	-171.9	44.8	0	0	0	0	111.8	G126 G127 N257	G126-T259 PolarHBondContact N-OG1 2.83Å; G127-T259 PolarHBondContact N-OG1 3.39Å; N257-T259 PolarHBondContact O-N 3.19Å
260	E	53.5	Low	53.7	Low	80 Å²	80	75.8 Å²	75.8	37%	0.374	41%	0.406	S	S	.	.			trans	-54	140.4	164.9	-176	175	140.3	0	0	111.4	F198 G199 A258 K262	F198-E260 WeakPolarHBondContact CA-OE1 3.47Å; G199-E260 WeakPolarHBondContact CA-OE2 3.3Å; G199-E260 PolarHBondContact N-OE1 3.15Å; G199-E260 PolarHBondContact N-OE2 2.92Å; A258-E260 PolarHBondContact O-N 2.73Å; E260-K262 PolarHBondContact O-N 3.2Å
261	L	61.4	Low	55.3	Low	20 Å²	20	73.1 Å²	73.1	11%	0.105	40%	0.398	C	S	.	.			trans	-74.3	112	178.6	-107.6	149.6	0	0	0	109.9	C123 M197 D265	C123-L261 HydrophobicContact CB-CD2 3.86Å; C123-L261 HydrophobicContact CB-CG 4.22Å; C123-L261 VanDerWaalsContact SG-CD2 3.59Å; M197-L261 HydrophobicContact CB-CB 4.36Å; M197-L261 HydrophobicContact CE-CB 4.25Å; M197-L261 HydrophobicContact CE-CD1 3.87Å; M197-L261 HydrophobicContact CE-CD2 3.87Å; M197-L261 HydrophobicContact CE-CG 4.2Å; M197-L261 HydrophobicContact CG-CB 4.09Å; M197-L261 HydrophobicContact CG-CD1 3.87Å; M197-L261 HydrophobicContact SD-CD1 4.18Å; L261-D265 HydrophobicContact CD2-CB 3.71Å
262	K	66.2	Low	57.4	Low	126 Å²	126	75.1 Å²	75.1	55%	0.548	40%	0.396	S	S	.	.			trans	-84	161.3	-172.7	-65.6	-164.6	173.5	-161.7	0	112.8	E260 E264 D265 I266	E260-K262 PolarHBondContact O-N 3.2Å; K262-E264 PolarHBondContact O-N 2.85Å; K262-D265 PolarHBondContact N-OD2 2.98Å; K262-D265 WeakPolarHBondContact O-CB 3.46Å; K262-D265 PolarHBondContact O-N 3.31Å; K262-D265 VanDerWaalsContact O-N 3.1Å; K262-I266 PolarHBondContact O-N 2.69Å
263	P	68.2	Low	59.7	Low	32 Å²	32	73.4 Å²	73.4	21%	0.208	39%	0.385	C	S	.	.	H	α-helix	trans	-54.5	-35.5	170.9	-23.8	33.7	0	0	0	111.9	F198 I266 R267 V284	F198-P263 HydrophobicContact CE1-CB 4.44Å; F198-P263 HydrophobicContact CE1-CG 3.75Å; F198-P263 HydrophobicContact CZ-CG 4.41Å; P263-I266 PolarHBondContact O-N 2.96Å; P263-R267 WeakPolarHBondContact O-CB 3.33Å; P263-R267 PolarHBondContact O-N 2.89Å; P263-V284 HydrophobicContact CB-CG1 3.89Å
264	E	68.2	Low	61.8	Low	98 Å²	98	71 Å²	71	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-39.3	178.3	-70.8	54.6	-113.7	0	0	112.3	K262 R267 A268	K262-E264 PolarHBondContact O-N 2.85Å; E264-R267 PolarHBondContact O-N 3.07Å; E264-R267 IonicContact OE1-CZ 2.73Å; E264-R267 IonicContact OE1-NH1 2.78Å; E264-R267 PolarHBondContact OE1-NH1 2.91Å; E264-R267 IonicContact OE1-NH2 3.21Å; E264-R267 PolarHBondContact OE1-NH2 2.87Å; E264-A268 VanDerWaalsContact O-CB 3.28Å; E264-A268 WeakPolarHBondContact O-CB 3.3Å; E264-A268 PolarHBondContact O-N 3.18Å
265	D	72.9	Confident	63.8	Low	44 Å²	44	71.2 Å²	71.2	24%	0.235	37%	0.37	C	S	.	.	H	α-helix	trans	-65.5	-42.9	176.8	-66.6	-53.3	0	0	0	110.9	L261 K262 A268 I269	L261-D265 HydrophobicContact CD2-CB 3.71Å; K262-D265 PolarHBondContact N-OD2 2.98Å; K262-D265 WeakPolarHBondContact O-CB 3.46Å; K262-D265 PolarHBondContact O-N 3.31Å; K262-D265 VanDerWaalsContact O-N 3.1Å; D265-A268 PolarHBondContact O-N 2.85Å; D265-I269 VanDerWaalsContact O-CG1 3.3Å; D265-I269 WeakPolarHBondContact O-CG1 3.31Å; D265-I269 PolarHBondContact O-N 3Å
266	I	74.9	Confident	66	Low	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-67.7	-44.2	178.2	-60.5	162.9	0	0	0	109.7	M197 F198 K262 P263 A268 I269 L270 V284 W287	M197-I266 HydrophobicContact CE-CD1 3.93Å; M197-I266 HydrophobicContact CE-CG1 3.79Å; F198-I266 HydrophobicContact CE1-CD1 4.02Å; F198-I266 HydrophobicContact CE2-CD1 4.18Å; F198-I266 HydrophobicContact CZ-CD1 3.48Å; F198-I266 VanDerWaalsContact CZ-CD1 3.48Å; K262-I266 PolarHBondContact O-N 2.69Å; P263-I266 PolarHBondContact O-N 2.96Å; I266-A268 VanDerWaalsContact C-N 3.27Å; I266-A268 PolarHBondContact O-N 2.89Å; I266-I269 PolarHBondContact O-N 2.92Å; I266-I269 VanDerWaalsContact O-N 3.12Å; I266-L270 HydrophobicContact CG2-CD1 4.03Å; I266-L270 HydrophobicContact CG2-CG 4.4Å; I266-L270 WeakPolarHBondContact O-CG 3.48Å; I266-L270 PolarHBondContact O-N 2.59Å; I266-V284 HydrophobicContact CB-CG2 4.43Å; I266-V284 HydrophobicContact CG2-CG2 4.05Å; I266-W287 HydrophobicContact CD1-CD2 4.43Å; I266-W287 HydrophobicContact CD1-CE3 3.85Å; I266-W287 HydrophobicContact CD1-CZ3 4.11Å; I266-W287 HydrophobicContact CG2-CD2 4.26Å
267	R	76.3	Confident	68.1	Low	95 Å²	95	65 Å²	65	36%	0.358	34%	0.343	S	S	.	.	H	α-helix	trans	-57.5	-40.1	173.9	-163.5	-177.2	-62.6	110.7	2.7	111.4	P263 E264 S271 V284	P263-R267 WeakPolarHBondContact O-CB 3.33Å; P263-R267 PolarHBondContact O-N 2.89Å; E264-R267 PolarHBondContact O-N 3.07Å; E264-R267 IonicContact OE1-CZ 2.73Å; E264-R267 IonicContact OE1-NH1 2.78Å; E264-R267 PolarHBondContact OE1-NH1 2.91Å; E264-R267 IonicContact OE1-NH2 3.21Å; E264-R267 PolarHBondContact OE1-NH2 2.87Å; R267-S271 PolarHBondContact O-N 3.05Å; R267-S271 VanDerWaalsContact O-N 3.09Å; R267-S271 PolarHBondContact O-OG 2.99Å; R267-V284 HydrophobicContact CB-CG2 4.27Å
268	A	78	Confident	69.9	Low	37 Å²	37	64.6 Å²	64.6	31%	0.306	35%	0.348	S	S	.	.	H	α-helix	trans	-71.4	-31.9	176	0	0	0	0	0	113.7	R130 E264 D265 I266 S271 E272	R130-A268 PolarHBondContact NH1-O 3.16Å; E264-A268 VanDerWaalsContact O-CB 3.28Å; E264-A268 WeakPolarHBondContact O-CB 3.3Å; E264-A268 PolarHBondContact O-N 3.18Å; D265-A268 PolarHBondContact O-N 2.85Å; I266-A268 VanDerWaalsContact C-N 3.27Å; I266-A268 PolarHBondContact O-N 2.89Å; A268-S271 PolarHBondContact O-OG 3.38Å; A268-E272 PolarHBondContact O-N 2.78Å
269	I	80.7	Confident	71.6	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-72.3	-42.2	173.7	-69	166.4	0	0	0	110.2	V121 L171 I190 D265 I266 S271 E272 F273	V121-I269 HydrophobicContact CG1-CD1 4.05Å; V121-I269 HydrophobicContact CG1-CG1 4.09Å; V121-I269 HydrophobicContact CG1-CG2 4.33Å; L171-I269 HydrophobicContact CD2-CG2 4.3Å; I190-I269 HydrophobicContact CD1-CB 4.29Å; I190-I269 HydrophobicContact CD1-CD1 4.19Å; I190-I269 HydrophobicContact CD1-CG2 3.67Å; I190-I269 HydrophobicContact CG1-CG2 4.03Å; I190-I269 HydrophobicContact CG2-CD1 4.16Å; D265-I269 VanDerWaalsContact O-CG1 3.3Å; D265-I269 WeakPolarHBondContact O-CG1 3.31Å; D265-I269 PolarHBondContact O-N 3Å; I266-I269 PolarHBondContact O-N 2.92Å; I266-I269 VanDerWaalsContact O-N 3.12Å; I269-S271 PolarHBondContact O-N 3.37Å; I269-E272 PolarHBondContact O-N 3.4Å; I269-F273 HydrophobicContact CG2-CD2 3.95Å; I269-F273 PolarHBondContact O-N 3.25Å
270	L	80.9	Confident	72.7	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-43.7	177	-71.2	168.8	0	0	0	111.5	L171 I266 E272 F273 W274 P280 V283 V284	L171-L270 HydrophobicContact CB-CD2 4.16Å; I266-L270 HydrophobicContact CG2-CD1 4.03Å; I266-L270 HydrophobicContact CG2-CG 4.4Å; I266-L270 WeakPolarHBondContact O-CG 3.48Å; I266-L270 PolarHBondContact O-N 2.59Å; L270-E272 VanDerWaalsContact C-N 3.27Å; L270-E272 PolarHBondContact O-N 2.81Å; L270-F273 PolarHBondContact O-N 3.37Å; L270-W274 HydrophobicContact CD2-CE3 4.29Å; L270-W274 CarbonylContact O-C 3.37Å; L270-W274 VanDerWaalsContact O-CA 3.27Å; L270-W274 WeakPolarHBondContact O-CA 3.47Å; L270-W274 PolarHBondContact O-N 3.24Å; L270-P280 HydrophobicContact CB-CB 4.42Å; L270-V283 HydrophobicContact CD1-CB 3.96Å; L270-V283 HydrophobicContact CD1-CG1 3.74Å; L270-V283 HydrophobicContact CD2-CG1 4.01Å; L270-V284 HydrophobicContact CD1-CG2 3.84Å
271	S	77.3	Confident	73.5	Confident	76 Å²	76	63.6 Å²	63.6	53%	0.531	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-16.5	176.9	56.8	0	0	0	0	115.1	R267 A268 I269	R267-S271 PolarHBondContact O-N 3.05Å; R267-S271 VanDerWaalsContact O-N 3.09Å; R267-S271 PolarHBondContact O-OG 2.99Å; A268-S271 PolarHBondContact O-OG 3.38Å; I269-S271 PolarHBondContact O-N 3.37Å
272	E	79.3	Confident	74.1	Confident	82 Å²	82	64.4 Å²	64.4	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-90	-37.9	173.2	-179.3	172.5	-96.2	0	0	113.1	R130 A268 I269 L270	R130-E272 WeakPolarHBondContact CD-OE2 3.37Å; R130-E272 IonicContact CZ-OE1 2.74Å; R130-E272 VanDerWaalsContact CZ-OE1 3.29Å; R130-E272 IonicContact CZ-OE2 3.1Å; R130-E272 VanDerWaalsContact CZ-OE2 3.24Å; R130-E272 IonicContact NE-OE1 2.7Å; R130-E272 PolarHBondContact NE-OE1 2.83Å; R130-E272 IonicContact NE-OE2 3.86Å; R130-E272 PolarHBondContact NE-OE2 3.43Å; R130-E272 IonicContact NH2-OE1 2.7Å; R130-E272 PolarHBondContact NH2-OE1 3.2Å; R130-E272 IonicContact NH2-OE2 2.81Å; R130-E272 PolarHBondContact NH2-OE2 2.82Å; A268-E272 PolarHBondContact O-N 2.78Å; I269-E272 PolarHBondContact O-N 3.4Å; L270-E272 VanDerWaalsContact C-N 3.27Å; L270-E272 PolarHBondContact O-N 2.81Å
273	F	82	Confident	74.5	Confident	57 Å²	57	58.7 Å²	58.7	25%	0.25	33%	0.326	C	S	.	.	H	α-helix	trans	-109.3	-6.3	-172.6	-68.7	-77.8	0	0	0	114.9	T119 V121 L171 V188 I269 L270	T119-F273 HydrophobicContact CG2-CE1 4.08Å; T119-F273 HydrophobicContact CG2-CZ 4.34Å; V121-F273 HydrophobicContact CB-CE2 4.43Å; V121-F273 HydrophobicContact CG1-CE2 4.11Å; V121-F273 HydrophobicContact CG2-CD2 4Å; V121-F273 HydrophobicContact CG2-CE1 4.43Å; V121-F273 HydrophobicContact CG2-CE2 3.43Å; V121-F273 VanDerWaalsContact CG2-CE2 3.43Å; V121-F273 HydrophobicContact CG2-CZ 3.69Å; L171-F273 HydrophobicContact CD1-CB 4.11Å; L171-F273 HydrophobicContact CD2-CB 4.32Å; V188-F273 HydrophobicContact CG1-CB 4.08Å; V188-F273 HydrophobicContact CG1-CD1 3.86Å; V188-F273 HydrophobicContact CG1-CD2 4.37Å; V188-F273 HydrophobicContact CG1-CE1 4.4Å; V188-F273 HydrophobicContact CG1-CG 3.84Å; V188-F273 HydrophobicContact CG2-CB 4.41Å; V188-F273 HydrophobicContact CG2-CD1 3.95Å; V188-F273 HydrophobicContact CG2-CG 4.46Å; I269-F273 HydrophobicContact CG2-CD2 3.95Å; I269-F273 PolarHBondContact O-N 3.25Å; L270-F273 PolarHBondContact O-N 3.37Å
274	W	77	Confident	74.9	Confident	81 Å²	81	57.3 Å²	57.3	31%	0.307	32%	0.317	S	S	.	.			trans	-147.9	57.3	175.8	-155	-12.3	0	0	0	111.6	L171 T172 L270 D276 H277	L171-W274 HydrophobicContact CB-CE3 3.64Å; L171-W274 HydrophobicContact CB-CZ3 3.87Å; L171-W274 HydrophobicContact CD1-CB 4.16Å; L171-W274 HydrophobicContact CD1-CE3 4.07Å; T172-W274 HydrophobicContact CG2-CH2 3.56Å; T172-W274 HydrophobicContact CG2-CZ3 3.57Å; L270-W274 HydrophobicContact CD2-CE3 4.29Å; L270-W274 CarbonylContact O-C 3.37Å; L270-W274 VanDerWaalsContact O-CA 3.27Å; L270-W274 WeakPolarHBondContact O-CA 3.47Å; L270-W274 PolarHBondContact O-N 3.24Å; W274-D276 PolarHBondContact O-N 3.22Å; W274-H277 HydrophobicContact CD2-CB 4.04Å; W274-H277 AromaticContact CE2-CD2 3.62Å; W274-H277 HydrophobicContact CG-CB 3.84Å; W274-H277 AromaticContact CH2-CD2 3.99Å; W274-H277 AromaticContact CZ2-CD2 3.63Å; W274-H277 PolarHBondContact O-N 3.47Å
275	P	73.9	Confident	75.2	Confident	87 Å²	87	58.5 Å²	58.5	57%	0.565	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-29.4	-178.5	27.1	-35.4	0	0	0	112.7	H277	P275-H277 VanDerWaalsContact C-N 3.27Å; P275-H277 PolarHBondContact O-N 3.11Å
276	D	74.4	Confident	75	Confident	143 Å²	143	59.7 Å²	59.7	77%	0.765	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	8.4	-176.5	-36.6	-70.3	0	0	0	114	W274	W274-D276 PolarHBondContact O-N 3.22Å
277	H	71.7	Confident	75	Confident	46 Å²	46	59.8 Å²	59.8	21%	0.213	32%	0.322	C	S	.	.			trans	-79.4	125.1	177.9	-168.6	-84	0	0	0	111	W274 P275 D279 P280 V283	W274-H277 HydrophobicContact CD2-CB 4.04Å; W274-H277 AromaticContact CE2-CD2 3.62Å; W274-H277 HydrophobicContact CG-CB 3.84Å; W274-H277 AromaticContact CH2-CD2 3.99Å; W274-H277 AromaticContact CZ2-CD2 3.63Å; W274-H277 PolarHBondContact O-N 3.47Å; P275-H277 VanDerWaalsContact C-N 3.27Å; P275-H277 PolarHBondContact O-N 3.11Å; H277-D279 VanDerWaalsContact C-N 3.32Å; H277-D279 PolarHBondContact CE1-O 3.5Å; H277-D279 PolarHBondContact ND1-N 3.08Å; H277-D279 PolarHBondContact ND1-O 3.4Å; H277-D279 PolarHBondContact O-N 3.32Å; H277-P280 WeakPolarHBondContact O-CD 3.32Å; H277-V283 WeakPolarHBondContact CE1-CG2 3.21Å
278	P	66.8	Low	74.7	Confident	128 Å²	128	57.2 Å²	57.2	83%	0.831	31%	0.314	S	S	*	.	S	Bend	trans	-66.1	-29.1	-170.9	24.7	-34.7	0	0	0	114.3
279	D	71.2	Confident	74.3	Confident	74 Å²	74	62.1 Å²	62.1	40%	0.396	33%	0.325	S	S	.	.			trans	-140.6	90.1	172.9	-179.2	2.1	0	0	0	112.3	H277 S281 S282 V283	H277-D279 VanDerWaalsContact C-N 3.32Å; H277-D279 PolarHBondContact CE1-O 3.5Å; H277-D279 PolarHBondContact ND1-N 3.08Å; H277-D279 PolarHBondContact ND1-O 3.4Å; H277-D279 PolarHBondContact O-N 3.32Å; D279-S281 PolarHBondContact O-N 2.99Å; D279-S281 WeakPolarHBondContact OD1-CA 3.4Å; D279-S281 VanDerWaalsContact OD1-CB 3.29Å; D279-S281 WeakPolarHBondContact OD1-CB 3.45Å; D279-S281 PolarHBondContact OD1-N 3.1Å; D279-S282 VanDerWaalsContact CG-CB 3.46Å; D279-S282 VanDerWaalsContact CG-N 3.3Å; D279-S282 PolarHBondContact OD1-N 3.44Å; D279-S282 WeakPolarHBondContact OD2-CB 3.39Å; D279-S282 PolarHBondContact OD2-N 2.78Å; D279-V283 PolarHBondContact O-N 2.92Å
280	P	70.9	Confident	73.6	Confident	39 Å²	39	66.7 Å²	66.7	25%	0.253	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-22.7	174.5	-21.3	34.4	0	0	0	113.4	L270 H277 V283 V284	L270-P280 HydrophobicContact CB-CB 4.42Å; H277-P280 WeakPolarHBondContact O-CD 3.32Å; P280-V283 WeakPolarHBondContact O-CB 3.4Å; P280-V283 PolarHBondContact O-N 2.73Å; P280-V284 WeakPolarHBondContact O-CG2 3.38Å; P280-V284 PolarHBondContact O-N 3.35Å
281	S	71.7	Confident	72.7	Confident	66 Å²	66	68 Å²	68	46%	0.462	35%	0.349	S	S	.	.	H	α-helix	trans	-75.5	-38.8	179.9	-65.7	0	0	0	0	111.7	D279 V283 V284 Y285	D279-S281 PolarHBondContact O-N 2.99Å; D279-S281 WeakPolarHBondContact OD1-CA 3.4Å; D279-S281 VanDerWaalsContact OD1-CB 3.29Å; D279-S281 WeakPolarHBondContact OD1-CB 3.45Å; D279-S281 PolarHBondContact OD1-N 3.1Å; S281-V283 VanDerWaalsContact C-N 3.28Å; S281-V283 PolarHBondContact O-N 2.86Å; S281-V284 PolarHBondContact O-N 2.91Å; S281-Y285 WeakPolarHBondContact O-CB 3.38Å; S281-Y285 PolarHBondContact O-N 3.34Å
282	S	74.2	Confident	71.8	Confident	38 Å²	38	68.9 Å²	68.9	27%	0.266	34%	0.341	S	S	.	.	H	α-helix	trans	-60	-37.4	167.2	171.3	0	0	0	0	111.6	D279 Y285 Q286	D279-S282 VanDerWaalsContact CG-CB 3.46Å; D279-S282 VanDerWaalsContact CG-N 3.3Å; D279-S282 PolarHBondContact OD1-N 3.44Å; D279-S282 WeakPolarHBondContact OD2-CB 3.39Å; D279-S282 PolarHBondContact OD2-N 2.78Å; S282-Y285 PolarHBondContact O-N 3.41Å; S282-Q286 WeakPolarHBondContact O-CB 3.19Å; S282-Q286 WeakPolarHBondContact O-CG 3.44Å; S282-Q286 PolarHBondContact O-N 2.76Å; S282-Q286 PolarHBondContact OG-NE2 3.16Å
283	V	74.2	Confident	70.7	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.03	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-46.5	173.9	-179.4	0	0	0	0	110.9	L270 H277 D279 P280 S281 Q286 W287	L270-V283 HydrophobicContact CD1-CB 3.96Å; L270-V283 HydrophobicContact CD1-CG1 3.74Å; L270-V283 HydrophobicContact CD2-CG1 4.01Å; H277-V283 WeakPolarHBondContact CE1-CG2 3.21Å; D279-V283 PolarHBondContact O-N 2.92Å; P280-V283 WeakPolarHBondContact O-CB 3.4Å; P280-V283 PolarHBondContact O-N 2.73Å; S281-V283 VanDerWaalsContact C-N 3.28Å; S281-V283 PolarHBondContact O-N 2.86Å; V283-Q286 PolarHBondContact O-N 3Å; V283-W287 WeakPolarHBondContact O-CB 3.34Å; V283-W287 VanDerWaalsContact O-CD1 3.26Å; V283-W287 PolarHBondContact O-N 3.05Å
284	V	76.8	Confident	69.4	Low	4 Å²	4	73.2 Å²	73.2	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-44.1	175.3	175.3	0	0	0	0	111.9	P263 I266 R267 L270 P280 S281 Q286 W287 E288	P263-V284 HydrophobicContact CB-CG1 3.89Å; I266-V284 HydrophobicContact CB-CG2 4.43Å; I266-V284 HydrophobicContact CG2-CG2 4.05Å; R267-V284 HydrophobicContact CB-CG2 4.27Å; L270-V284 HydrophobicContact CD1-CG2 3.84Å; P280-V284 WeakPolarHBondContact O-CG2 3.38Å; P280-V284 PolarHBondContact O-N 3.35Å; S281-V284 PolarHBondContact O-N 2.91Å; V284-Q286 PolarHBondContact O-N 3.3Å; V284-W287 WeakPolarHBondContact O-CB 3.46Å; V284-W287 PolarHBondContact O-N 3.4Å; V284-E288 WeakPolarHBondContact O-CG 3.26Å; V284-E288 PolarHBondContact O-N 3.24Å
285	Y	73	Confident	67.7	Low	122 Å²	122	72.2 Å²	72.2	48%	0.478	38%	0.376	S	S	.	.	H	α-helix	trans	-64.2	-40.2	177.2	173.2	-102.9	0	0	0	112.7	S281 S282 R289	S281-Y285 WeakPolarHBondContact O-CB 3.38Å; S281-Y285 PolarHBondContact O-N 3.34Å; S282-Y285 PolarHBondContact O-N 3.41Å; Y285-R289 WeakPolarHBondContact O-CB 3.43Å; Y285-R289 PolarHBondContact O-N 3.14Å
286	Q	70.6	Confident	65.6	Low	70 Å²	70	77.5 Å²	77.5	33%	0.327	39%	0.39	S	S	.	.	H	α-helix	trans	-67.9	-37.2	173.5	-70.4	175.5	46.6	0	0	112	S282 V283 V284 R289 R290	S282-Q286 WeakPolarHBondContact O-CB 3.19Å; S282-Q286 WeakPolarHBondContact O-CG 3.44Å; S282-Q286 PolarHBondContact O-N 2.76Å; S282-Q286 PolarHBondContact OG-NE2 3.16Å; V283-Q286 PolarHBondContact O-N 3Å; V284-Q286 PolarHBondContact O-N 3.3Å; Q286-R289 PolarHBondContact O-N 3.49Å; Q286-R290 WeakPolarHBondContact O-CB 3.41Å; Q286-R290 WeakPolarHBondContact O-CG 3.32Å; Q286-R290 PolarHBondContact O-N 3.27Å; Q286-R290 VanDerWaalsContact OE1-NH1 3.11Å
287	W	74.4	Confident	63.4	Low	1 Å²	1	74 Å²	74	0%	0.004	39%	0.389	C	S	.	.	H	α-helix	trans	-55.3	-56.1	171.2	-104	79.5	0	0	0	110.7	Y169 S170 L171 G173 I190 M197 I266 V283 V284 R289 R290 L291	Y169-W287 VanDerWaalsContact CB-CH2 3.5Å; Y169-W287 HydrophobicContact CD1-CH2 4.32Å; Y169-W287 HydrophobicContact CD1-CZ3 4.43Å; Y169-W287 HydrophobicContact CD2-CH2 4.03Å; Y169-W287 HydrophobicContact CD2-CZ3 4.36Å; Y169-W287 AromaticContact CG-CH2 3.7Å; Y169-W287 HydrophobicContact CG-CH2 3.7Å; Y169-W287 HydrophobicContact CG-CZ2 4.42Å; Y169-W287 HydrophobicContact CG-CZ3 4.15Å; S170-W287 WeakPolarHBondContact O-CZ2 3.24Å; L171-W287 PolarHBondContact O-NE1 3.13Å; G173-W287 VanDerWaalsContact CA-NE1 3.27Å; G173-W287 VanDerWaalsContact N-NE1 3.11Å; I190-W287 HydrophobicContact CB-CH2 4.3Å; I190-W287 HydrophobicContact CD1-CH2 4.02Å; I190-W287 HydrophobicContact CD1-CZ2 3.74Å; M197-W287 HydrophobicContact CB-CZ3 4.24Å; M197-W287 HydrophobicContact CE-CE3 4.42Å; M197-W287 HydrophobicContact CE-CH2 3.56Å; M197-W287 HydrophobicContact CE-CZ3 3.37Å; M197-W287 HydrophobicContact CG-CZ3 4.46Å; M197-W287 HydrophobicContact SD-CH2 3.71Å; M197-W287 HydrophobicContact SD-CZ3 3.48Å; M197-W287 WeakPolarHBondContact SD-CZ3 3.23Å; I266-W287 HydrophobicContact CD1-CD2 4.43Å; I266-W287 HydrophobicContact CD1-CE3 3.85Å; I266-W287 HydrophobicContact CD1-CZ3 4.11Å; I266-W287 HydrophobicContact CG2-CD2 4.26Å; V283-W287 WeakPolarHBondContact O-CB 3.34Å; V283-W287 VanDerWaalsContact O-CD1 3.26Å; V283-W287 PolarHBondContact O-N 3.05Å; V284-W287 WeakPolarHBondContact O-CB 3.46Å; V284-W287 PolarHBondContact O-N 3.4Å; W287-R289 VanDerWaalsContact C-N 3.32Å; W287-R289 PolarHBondContact O-N 3.26Å; W287-R290 PolarHBondContact O-N 2.92Å; W287-L291 HydrophobicContact CE3-CD1 3.88Å; W287-L291 HydrophobicContact CZ3-CD1 4.39Å; W287-L291 WeakPolarHBondContact O-CD1 3.2Å; W287-L291 WeakPolarHBondContact O-CG 3.14Å; W287-L291 PolarHBondContact O-N 2.95Å
288	E	69.9	Low	61.4	Low	41 Å²	41	79.9 Å²	79.9	19%	0.192	42%	0.418	C	S	.	.	H	α-helix	trans	-56.4	-45.5	175.7	-69.1	175	-165.8	0	0	111.6	F198 V284 R290 L291 R292	F198-E288 HydrophobicContact CD2-CG 4.17Å; F198-E288 HydrophobicContact CE1-CG 4.44Å; F198-E288 HydrophobicContact CE2-CB 4.1Å; F198-E288 HydrophobicContact CE2-CG 3.51Å; F198-E288 HydrophobicContact CZ-CG 3.66Å; V284-E288 WeakPolarHBondContact O-CG 3.26Å; V284-E288 PolarHBondContact O-N 3.24Å; E288-R290 PolarHBondContact O-N 3.22Å; E288-L291 CarbonylContact O-C 3.59Å; E288-L291 PolarHBondContact O-N 3.3Å; E288-L291 VanDerWaalsContact O-N 3.11Å; E288-R292 WeakPolarHBondContact O-CB 3.32Å; E288-R292 WeakPolarHBondContact O-CG 3.4Å; E288-R292 PolarHBondContact O-N 2.52Å; E288-R292 IonicContact OE2-CZ 3.88Å; E288-R292 IonicContact OE2-NH1 3.33Å; E288-R292 PolarHBondContact OE2-NH1 3.06Å; E288-R292 IonicContact OE2-NH2 2.59Å; E288-R292 PolarHBondContact OE2-NH2 2.65Å
289	R	69.3	Low	59.4	Low	140 Å²	140	83.5 Å²	83.5	53%	0.528	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-39.2	179.3	-170.4	170.9	-179.3	153.1	-2.5	112.1	Y285 Q286 W287 L291 N293	Y285-R289 WeakPolarHBondContact O-CB 3.43Å; Y285-R289 PolarHBondContact O-N 3.14Å; Q286-R289 PolarHBondContact O-N 3.49Å; W287-R289 VanDerWaalsContact C-N 3.32Å; W287-R289 PolarHBondContact O-N 3.26Å; R289-L291 PolarHBondContact O-N 3.26Å; R289-N293 WeakPolarHBondContact O-CB 3.44Å; R289-N293 VanDerWaalsContact O-CG 3.29Å; R289-N293 PolarHBondContact O-N 3.32Å; R289-N293 VanDerWaalsContact O-N 3.1Å; R289-N293 PolarHBondContact O-OD1 2.66Å; R289-N293 VanDerWaalsContact O-OD1 3.12Å
290	R	66.6	Low	57.4	Low	98 Å²	98	86 Å²	86	37%	0.37	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-27.9	173.4	-75.9	169.9	-177.9	117.2	21.8	112.5	T172 Q286 W287 E288 R294	T172-R290 PolarHBondContact O-NH1 3.14Å; Q286-R290 WeakPolarHBondContact O-CB 3.41Å; Q286-R290 WeakPolarHBondContact O-CG 3.32Å; Q286-R290 PolarHBondContact O-N 3.27Å; Q286-R290 VanDerWaalsContact OE1-NH1 3.11Å; W287-R290 PolarHBondContact O-N 2.92Å; E288-R290 PolarHBondContact O-N 3.22Å; R290-R294 WeakPolarHBondContact O-CD 3.3Å; R290-R294 VanDerWaalsContact O-CG 3.28Å; R290-R294 WeakPolarHBondContact O-CG 3.21Å; R290-R294 PolarHBondContact O-NE 3.13Å
291	L	62.1	Low	55.3	Low	31 Å²	31	89.9 Å²	89.9	16%	0.162	47%	0.467	C	S	.	.	H	α-helix	trans	-88.1	-42.5	178.9	-70.6	160.5	0	0	0	112.1	Y169 M197 F198 W287 E288 R289 N293 R294	Y169-L291 HydrophobicContact CE1-CD2 4.29Å; M197-L291 HydrophobicContact CB-CD1 4.31Å; F198-L291 HydrophobicContact CD2-CB 4.32Å; F198-L291 HydrophobicContact CD2-CD1 3.56Å; F198-L291 HydrophobicContact CE2-CD1 3.71Å; W287-L291 HydrophobicContact CE3-CD1 3.88Å; W287-L291 HydrophobicContact CZ3-CD1 4.39Å; W287-L291 WeakPolarHBondContact O-CD1 3.2Å; W287-L291 WeakPolarHBondContact O-CG 3.14Å; W287-L291 PolarHBondContact O-N 2.95Å; E288-L291 CarbonylContact O-C 3.59Å; E288-L291 PolarHBondContact O-N 3.3Å; E288-L291 VanDerWaalsContact O-N 3.11Å; R289-L291 PolarHBondContact O-N 3.26Å; L291-N293 VanDerWaalsContact C-N 3.33Å; L291-N293 PolarHBondContact O-N 2.99Å; L291-R294 WeakPolarHBondContact O-CB 3.25Å; L291-R294 PolarHBondContact O-N 3.11Å
292	R	58	Low	53.4	Low	94 Å²	94	95.4 Å²	95.4	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-52.8	-48.6	170.3	-77.4	-173.1	-81.4	-101.3	0.2	111.5	I201 E288 R294 G295	I201-R292 HydrophobicContact CD1-CG 4.13Å; E288-R292 WeakPolarHBondContact O-CB 3.32Å; E288-R292 WeakPolarHBondContact O-CG 3.4Å; E288-R292 PolarHBondContact O-N 2.52Å; E288-R292 IonicContact OE2-CZ 3.88Å; E288-R292 IonicContact OE2-NH1 3.33Å; E288-R292 PolarHBondContact OE2-NH1 3.06Å; E288-R292 IonicContact OE2-NH2 2.59Å; E288-R292 PolarHBondContact OE2-NH2 2.65Å; R292-R294 PolarHBondContact O-N 3.37Å; R292-G295 PolarHBondContact O-N 2.89Å
293	N	56.5	Low	51.1	Low	120 Å²	120	102 Å²	102	64%	0.642	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-4.7	178.6	-74.4	30.4	0	0	0	114.7	R289 L291	R289-N293 WeakPolarHBondContact O-CB 3.44Å; R289-N293 VanDerWaalsContact O-CG 3.29Å; R289-N293 PolarHBondContact O-N 3.32Å; R289-N293 VanDerWaalsContact O-N 3.1Å; R289-N293 PolarHBondContact O-OD1 2.66Å; R289-N293 VanDerWaalsContact O-OD1 3.12Å; L291-N293 VanDerWaalsContact C-N 3.33Å; L291-N293 PolarHBondContact O-N 2.99Å
294	R	54	Low	49	Very low	110 Å²	110	111.2 Å²	111.2	42%	0.415	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.9	0.4	175.7	-63.2	162.9	171.6	-128	-4.7	113.3	E175 R290 L291 R292	E175-R294 IonicContact OE1-NH1 3.56Å; E175-R294 PolarHBondContact OE1-NH1 2.88Å; E175-R294 IonicContact OE2-CZ 2.8Å; E175-R294 IonicContact OE2-NH1 3.16Å; E175-R294 PolarHBondContact OE2-NH1 2.74Å; E175-R294 IonicContact OE2-NH2 3.37Å; E175-R294 PolarHBondContact OE2-NH2 2.8Å; E175-R294 VanDerWaalsContact OE2-NH2 3.17Å; R290-R294 WeakPolarHBondContact O-CD 3.3Å; R290-R294 VanDerWaalsContact O-CG 3.28Å; R290-R294 WeakPolarHBondContact O-CG 3.21Å; R290-R294 PolarHBondContact O-NE 3.13Å; L291-R294 WeakPolarHBondContact O-CB 3.25Å; L291-R294 PolarHBondContact O-N 3.11Å; R292-R294 PolarHBondContact O-N 3.37Å
295	G	40.8	Very low	46.6	Very low	60 Å²	60	118.5 Å²	118.5	62%	0.619	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-31.9	175.8	0	0	0	0	0	113.4	R292 G297	R292-G295 PolarHBondContact O-N 2.89Å; G295-G297 PolarHBondContact O-N 3.18Å
296	F	29.7	Very low	44.5	Very low	197 Å²	197	118.1 Å²	118.1	86%	0.864	60%	0.601	S	S	*	*			trans	-82.4	106.8	177.6	-78.2	-96.6	0	0	0	110.2
297	G	28.3	Very low	42.7	Very low	71 Å²	71	121.9 Å²	121.9	73%	0.732	62%	0.623	S	S	*	*			trans	-176.7	-8.4	-179.5	0	0	0	0	0	116.4	G295	G295-G297 PolarHBondContact O-N 3.18Å
298	M	29.4	Very low	40.5	Very low	168 Å²	168	130 Å²	130	83%	0.828	66%	0.659	S	S	*	*			trans	-87.7	119	172.1	-68.2	-101.3	65.1	0	0	109.9	T300	M298-T300 PolarHBondContact O-N 3.45Å
299	K	26.1	Very low	38.5	Very low	205 Å²	205	135.3 Å²	135.3	89%	0.891	68%	0.683	S	S	*	*			trans	-78.5	79.5	177.7	-70.2	-175.9	176.7	-179.3	0	111.7
300	T	29.3	Very low	36.5	Very low	127 Å²	127	136 Å²	136	78%	0.779	70%	0.696	S	S	*	*			trans	-90.2	96	165.9	48.7	0	0	0	0	110	M298 Q302	M298-T300 PolarHBondContact O-N 3.45Å; T300-Q302 VanDerWaalsContact C-N 3.34Å; T300-Q302 PolarHBondContact O-N 3.03Å
301	S	25.4	Very low	34.6	Very low	119 Å²	119	137.7 Å²	137.7	83%	0.832	71%	0.712	S	S	*	*			trans	-76.3	76.8	-179.2	-63.4	0	0	0	0	112.7
302	Q	32.3	Very low	33	Very low	183 Å²	183	145.2 Å²	145.2	86%	0.855	74%	0.744	S	S	*	*			trans	-148.1	88.4	166.8	-111.7	163.7	19.1	0	0	112.6	T300	T300-Q302 VanDerWaalsContact C-N 3.34Å; T300-Q302 PolarHBondContact O-N 3.03Å
303	Q	25.7	Very low	31.4	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	77%	0.767	S	S	*	*			trans	-5.4	118.3	148.1	-179.6	178.5	3.5	0	0	117.6
304	F	30.3	Very low	30	Very low	197 Å²	197	151.6 Å²	151.6	86%	0.864	78%	0.777	S	S	*	*			trans	-153.2	105.3	150.2	-101.4	-72.7	0	0	0	110.3
305	D	26.1	Very low	28.8	Very low	157 Å²	157	151.6 Å²	151.6	84%	0.84	79%	0.792	S	S	*	*			trans	-97	112.2	169.8	-86	-62.9	0	0	0	109.8
306	V	30	Very low	28	Very low	115 Å²	115	160 Å²	160	70%	0.697	81%	0.805	S	S	*	*			trans	-153.2	151.7	159.2	-131.2	0	0	0	0	111.8
307	N	32.2	Very low	28.1	Very low	148 Å²	148	156.7 Å²	156.7	79%	0.791	80%	0.803	S	S	*	*			trans	65.9	55.7	159.9	-59.4	-14.1	0	0	0	119.2
308	K	28.1	Very low	28	Very low	173 Å²	173	163 Å²	163	75%	0.752	81%	0.81	S	S	*	*				18.8	138.2	105.4	-130.6	-175.2	175.5	-152.1	0	118.9
309	H	27.3	Very low	28.1	Very low	151 Å²	151	164.3 Å²	164.3	70%	0.699	82%	0.815	S	S	*	*			trans	68.8	116.2	163	-60.2	-71.8	0	0	0	119.7
310	L	28.8	Very low	28.1	Very low	155 Å²	155	164.1 Å²	164.1	81%	0.812	81%	0.814	S	S	*	*				-172.1	113	110.5	-98.7	164.6	0	0	0	111.2
311	L	25.9	Very low	28	Very low	134 Å²	134	166.4 Å²	166.4	70%	0.702	82%	0.82	S	S	*	*	S	Bend	trans	54.6	138	153.9	-59.9	169	0	0	0	119.9
312	F	28.8	Very low	27.9	Very low	188 Å²	188	165.6 Å²	165.6	83%	0.825	81%	0.814	S	S	*	*			cis	-125.1	148.7	3.3	-91.9	-91.9	0	0	0	111.3
313	E	24	Very low	27.8	Very low	178 Å²	178	165.2 Å²	165.2	83%	0.832	82%	0.817	S	S	*	*			trans	-107.6	151.4	168.8	-64.7	-174.1	124	0	0	111.2
314	I	28.3	Very low	27.8	Very low	170 Å²	170	165.2 Å²	165.2	87%	0.872	82%	0.815	S	S	*	*			trans	-132.6	129.3	148.3	-60.2	-177.3	0	0	0	107.1
315	P	28.3	Very low	27.6	Very low	110 Å²	110	161.1 Å²	161.1	71%	0.714	81%	0.806	S	S	*	*			trans	-94.5	159.2	-158	-4.7	26.1	0	0	0	114.3
316	R	24.1	Very low	27.6	Very low	237 Å²	237	159.9 Å²	159.9	89%	0.894	80%	0.8	S	S	*	*			trans	-110.5	123.9	160.7	-66.8	-171.8	-174.7	-165.2	1.9	110.2
317	P	32.5	Very low	27.4	Very low	128 Å²	128	161 Å²	161	83%	0.831	80%	0.801	S	S	*	*			trans	-71.3	145.7	167.1	30.4	-32.9	0	0	0	110.6
318	K	25.4	Very low	27.2	Very low	202 Å²	202	161.1 Å²	161.1	88%	0.878	80%	0.8	S	S	*	*			trans	-114.3	136.2	164.6	-68.4	176.1	-179.3	171.6	0	108.1
319	Q	31.9	Very low	27.1	Very low	197 Å²	197	160.3 Å²	160.3	92%	0.921	80%	0.803	S	S	*	*			trans	-128.1	142.9	150.8	-75.5	-169.2	-12.5	0	0	109.4
320	K	24.7	Very low	27.1	Very low	201 Å²	201	158.3 Å²	158.3	87%	0.874	81%	0.806	S	S	*	*			trans	-86.9	141.9	167.3	-68.3	175.2	175.8	177.4	0	107.7
321	L	27.8	Very low	26.9	Very low	174 Å²	174	158 Å²	158	91%	0.911	81%	0.805	S	S	*	*			trans	-154.9	140.1	138.1	-108.8	156.7	0	0	0	108.2
322	S	24.2	Very low	27.1	Very low	102 Å²	102	159.2 Å²	159.2	71%	0.713	81%	0.81	S	S	*	*			trans	-102.8	142.7	177.3	55.3	0	0	0	0	109.6
323	L	30.1	Very low	26.9	Very low	175 Å²	175	159.4 Å²	159.4	92%	0.916	81%	0.811	S	S	*	*			trans	-157.4	174.3	141.2	-109.3	163.8	0	0	0	110.2
324	K	24.5	Very low	27.2	Very low	177 Å²	177	162.2 Å²	162.2	77%	0.77	82%	0.816	S	S	*	*			trans	-100.9	157.6	-159.2	-65.9	179	176.4	176.4	0	113.8
325	T	25.8	Very low	27.1	Very low	112 Å²	112	158.4 Å²	158.4	69%	0.687	80%	0.804	S	S	*	*			trans	64.9	123.7	141.8	43.4	0	0	0	0	121.1
326	N	26.1	Very low	27.2	Very low	131 Å²	131	159 Å²	159	70%	0.701	81%	0.811	S	S	*	*			trans	91.3	120.4	132.4	-64.5	5.4	0	0	0	121.1
327	N	26.5	Very low	27.3	Very low	137 Å²	137	154.6 Å²	154.6	73%	0.733	81%	0.805	S	S	*	*			trans	87.6	151.8	135.3	-64.7	-2.4	0	0	0	121.3
328	I	28.4	Very low	27.2	Very low	151 Å²	151	157 Å²	157	77%	0.774	81%	0.805	S	S	*	*			trans	72.6	82.2	163.9	-58.1	139	0	0	0	116.4
329	I	26.1	Very low	27.3	Very low	157 Å²	157	152 Å²	152	81%	0.805	80%	0.796	S	S	*	*				17.6	113.5	116.8	-53	168.3	0	0	0	115.7
330	S	26.6	Very low	27	Very low	109 Å²	109	151.1 Å²	151.1	76%	0.762	79%	0.789	S	S	*	*				-177.5	162	115.3	40.2	0	0	0	0	112.9
331	N	25.4	Very low	27	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	78%	0.783	S	S	*	*			trans	-63.9	157.3	177.5	-54.9	-65.8	0	0	0	110.9
332	I	28.9	Very low	27.1	Very low	159 Å²	159	148.5 Å²	148.5	82%	0.815	78%	0.779	S	S	*	*				-154.6	149.5	78.2	-88.2	158.2	0	0	0	111.7
333	K	25.5	Very low	27.2	Very low	193 Å²	193	149.9 Å²	149.9	84%	0.839	78%	0.778	S	S	*	*			trans	-71.2	148.2	175.2	-61.2	173.4	180	174.4	0	111.6
334	Y	29.5	Very low	27.1	Very low	236 Å²	236	149.3 Å²	149.3	93%	0.925	77%	0.771	S	S	*	*			trans	-126.7	149.5	136.7	-104.6	-86.4	0	0	0	109.8
335	S	26.3	Very low	27.2	Very low	91 Å²	91	146.3 Å²	146.3	64%	0.636	76%	0.758	S	S	*	*			trans	-114.6	143.8	-172.3	-164.8	0	0	0	0	111.2
336	S	30.4	Very low	27.4	Very low	123 Å²	123	149.9 Å²	149.9	86%	0.86	76%	0.764	S	S	*	*			trans	-145.8	135.2	163.1	-66.9	0	0	0	0	107.5
337	N	26.1	Very low	27.6	Very low	143 Å²	143	151.8 Å²	151.8	77%	0.765	77%	0.774	S	S	*	*			trans	-95.7	-170.3	-164.4	-71.8	-28	0	0	0	112.9
338	E	30.8	Very low	27.7	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	77%	0.774	S	S	*	*			trans	89.8	96.3	175	-56.2	178.5	-173.8	0	0	113
339	S	26.8	Very low	27.6	Very low	97 Å²	97	146.5 Å²	146.5	68%	0.678	77%	0.772	S	S	*	*				68.2	136.4	53.6	93.3	0	0	0	0	112.8
340	F	26.6	Very low	27.6	Very low	178 Å²	178	148.5 Å²	148.5	78%	0.781	78%	0.775	S	S	*	*			cis	-114.2	130.7	3.5	-98.5	-108.8	0	0	0	112.7
341	I	25.5	Very low	27.7	Very low	146 Å²	146	149.7 Å²	149.7	75%	0.749	77%	0.774	S	S	*	*			trans	-139.6	111.2	156.8	-59.8	178.6	0	0	0	107.1	N343	I341-N343 PolarHBondContact O-ND2 3.3Å
342	E	28.8	Very low	28	Very low	175 Å²	175	152.2 Å²	152.2	82%	0.818	78%	0.78	S	S	*	*			trans	-92.7	144.5	169.5	-71	-162.8	141.1	0	0	111.5
343	N	26.6	Very low	27.8	Very low	130 Å²	130	151.6 Å²	151.6	70%	0.695	78%	0.778	S	S	*	*			trans	-116.7	125.4	-166.9	-66.1	-88.8	0	0	0	110.7	I341	I341-N343 PolarHBondContact O-ND2 3.3Å
344	E	27.7	Very low	27.9	Very low	163 Å²	163	147.3 Å²	147.3	76%	0.762	77%	0.768	S	S	*	*			trans	-98.5	87.2	155.8	-68.6	-152	133.8	0	0	109.4	K185	K185-E344 IonicContact NZ-OE1 2.79Å; K185-E344 PolarHBondContact NZ-OE1 3.4Å; K185-E344 IonicContact NZ-OE2 2.63Å; K185-E344 PolarHBondContact NZ-OE2 3.46Å
345	K	27.8	Very low	28.2	Very low	114 Å²	114	144.2 Å²	144.2	50%	0.496	77%	0.766	S	S	.	*			trans	-143.5	144.6	170.4	-98.7	-166.8	177.3	-174.9	0	110.1
346	K	28.7	Very low	28.3	Very low	187 Å²	187	145.6 Å²	145.6	81%	0.813	77%	0.766	S	S	*	*			trans	70.9	124.8	-174.7	-57.8	-173.3	175.9	-172.5	0	114.4
347	D	31.2	Very low	28.3	Very low	172 Å²	172	146.5 Å²	146.5	92%	0.92	76%	0.761	S	S	*	*				-156.7	78.6	129.3	-108.1	-11.4	0	0	0	108.1
348	S	28.4	Very low	28.6	Very low	106 Å²	106	146.2 Å²	146.2	74%	0.741	76%	0.76	S	S	*	*			trans	-89.7	111.7	159.1	50.1	0	0	0	0	106.4
349	G	24.9	Very low	28.5	Very low	71 Å²	71	144.7 Å²	144.7	73%	0.732	76%	0.756	S	S	*	*			trans	-69.2	157.5	-171.5	0	0	0	0	0	114.3
350	F	27.8	Very low	28.5	Very low	198 Å²	198	147.3 Å²	147.3	87%	0.868	76%	0.762	S	S	*	*			trans	-147.2	166.6	155.7	-132.7	-88.4	0	0	0	109.3
351	D	29	Very low	28.7	Very low	135 Å²	135	144 Å²	144	72%	0.722	76%	0.757	S	S	*	*			trans	-71.1	162.5	176.8	-46.3	-87.8	0	0	0	112.3
352	E	29.9	Very low	28.8	Very low	200 Å²	200	145.9 Å²	145.9	94%	0.935	76%	0.76	S	S	*	*			trans	-133.3	139.2	160	-165.5	164.5	-123.8	0	0	109.9
353	L	25.4	Very low	28.8	Very low	147 Å²	147	143.3 Å²	143.3	77%	0.77	75%	0.751	S	S	*	*			trans	-142.5	120.9	-163.8	-125.1	175.9	0	0	0	110.7
354	T	28.5	Very low	28.7	Very low	103 Å²	103	143.5 Å²	143.5	63%	0.632	75%	0.752	S	S	*	*			trans	70.5	135.8	164.7	-10.7	0	0	0	0	118.3
355	I	34.6	Very low	28.7	Very low	171 Å²	171	144.2 Å²	144.2	88%	0.877	76%	0.755	S	S	*	*				-157.3	141.4	122.9	-99.4	153.5	0	0	0	107.3
356	N	29	Very low	28.7	Very low	120 Å²	120	145.9 Å²	145.9	64%	0.642	77%	0.765	S	S	*	*			trans	-90.3	153.1	-175.2	-60.8	-26.5	0	0	0	112
357	N	29.6	Very low	28.6	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	76%	0.755	S	S	*	*				176.1	169	104.9	-90.2	-27.9	0	0	0	113.7
358	N	32.9	Very low	28.3	Very low	137 Å²	137	141 Å²	141	73%	0.733	74%	0.742	S	S	*	*			trans	77.7	98.9	176.9	-53.2	-17.1	0	0	0	114.3
359	I	28.4	Very low	28.2	Very low	147 Å²	147	144.9 Å²	144.9	75%	0.754	75%	0.748	S	S	*	*				73.3	125.5	66.5	-62.1	163.4	0	0	0	110
360	L	26.4	Very low	28.4	Very low	152 Å²	152	145.2 Å²	145.2	80%	0.796	75%	0.751	S	S	*	*			cis	-144.9	150.1	18.8	-142.2	145.6	0	0	0	110.4
361	P	32.4	Very low	28.3	Very low	107 Å²	107	143.8 Å²	143.8	70%	0.695	75%	0.747	S	S	*	*			trans	-98.1	163.9	179.2	37.3	-37.3	0	0	0	114.7
362	K	27	Very low	28.1	Very low	186 Å²	186	144.7 Å²	144.7	81%	0.809	75%	0.747	S	S	*	*			trans	173.5	151.2	131.8	-101.8	176.4	170.4	-168.2	0	117.1
363	I	28.4	Very low	27.8	Very low	122 Å²	122	139.8 Å²	139.8	63%	0.626	74%	0.735	S	S	*	*			trans	67.9	98.5	143.6	-64.4	166.3	0	0	0	119.4
364	D	25.5	Very low	27.9	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	73%	0.734	S	S	*	*				45	156	105.5	-43.3	-48.3	0	0	0	123
365	E	27.7	Very low	27.6	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	74%	0.737	S	S	*	*			trans	67.2	148.6	161.1	-74.1	169.3	-153	0	0	119.1
366	E	26	Very low	27.2	Very low	149 Å²	149	141.1 Å²	141.1	70%	0.696	73%	0.731	S	S	*	*			cis	-157.7	173.9	-33.5	-133	-157.1	142.2	0	0	110.4
367	Q	26.7	Very low	27.1	Very low	131 Å²	131	140 Å²	140	61%	0.612	73%	0.729	S	S	*	*			trans	53.7	122	148	-73.8	-178	37	0	0	124.1
368	I	26.3	Very low	27	Very low	124 Å²	124	139.5 Å²	139.5	64%	0.636	73%	0.726	S	S	*	*				83.6	126.7	121.4	-67.5	176.5	0	0	0	121.7
369	H	26.7	Very low	26.8	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.875	72%	0.723	S	S	*	*			trans	48.1	148.5	155.3	-64.8	-36.1	0	0	0	122.4
370	G	29.2	Very low	27.2	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	72%	0.72	S	S	*	*			trans	151.1	96.7	171.9	0	0	0	0	0	111.7
371	E	24	Very low	27.4	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	72%	0.715	S	S	*	*			trans	-86.4	177.9	168.4	-58.6	-165.7	143.8	0	0	111.9
372	Q	26.3	Very low	27.4	Very low	154 Å²	154	136.3 Å²	136.3	72%	0.72	71%	0.712	S	S	*	*			trans	73	86.9	151.2	-69.4	169.3	53.8	0	0	119.4
373	S	23.8	Very low	27.5	Very low	97 Å²	97	135 Å²	135	68%	0.678	71%	0.707	S	S	*	*				81	164.3	113.9	79.2	0	0	0	0	121.2
374	I	25.9	Very low	27.6	Very low	144 Å²	144	135.9 Å²	135.9	74%	0.738	71%	0.71	S	S	*	*			trans	69.9	103.1	168.7	-54.9	164.7	0	0	0	113.6
375	L	23.7	Very low	27.7	Very low	136 Å²	136	137.1 Å²	137.1	71%	0.712	71%	0.709	S	S	*	*				75.1	145.8	70.8	-136.9	148.7	0	0	0	113.3
376	F	25.2	Very low	27.8	Very low	169 Å²	169	134.2 Å²	134.2	74%	0.741	70%	0.699	S	S	*	*			trans	73.5	144.8	179.5	-62.9	-69.9	0	0	0	116.7
377	T	26.6	Very low	28.1	Very low	97 Å²	97	134.5 Å²	134.5	60%	0.595	70%	0.7	S	S	*	*			cis	-170.2	163.6	-34.5	11.7	0	0	0	0	109.6
378	N	27.4	Very low	28.5	Very low	131 Å²	131	133.6 Å²	133.6	70%	0.701	71%	0.706	S	S	*	*			trans	66.5	162.2	147	-68.4	-4.4	0	0	0	117.1
379	N	29.5	Very low	28.6	Very low	125 Å²	125	133.8 Å²	133.8	67%	0.668	71%	0.708	S	S	*	*			cis	-155.8	169.2	-15.7	-115.8	-18.1	0	0	0	109.5
380	S	36.4	Very low	28.6	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	70%	0.703	S	S	*	*			trans	136.8	114.5	140.4	-65.2	0	0	0	0	112.9
381	I	30.1	Very low	28.4	Very low	133 Å²	133	136.3 Å²	136.3	68%	0.682	70%	0.701	S	S	*	*				83.6	123.3	66.2	-74.4	165.1	0	0	0	109.5
382	N	33.9	Very low	28.4	Very low	119 Å²	119	132.6 Å²	132.6	64%	0.636	69%	0.693	S	S	*	*			cis	-156.3	159.9	16.6	-119.4	-2.5	0	0	0	114.9
383	F	28.1	Very low	28.3	Very low	159 Å²	159	129.8 Å²	129.8	70%	0.697	69%	0.691	S	S	*	*			trans	28.4	158.2	139.1	-75.6	-55.8	0	0	0	123.3
384	M	31.1	Very low	28.4	Very low	140 Å²	140	131 Å²	131	69%	0.69	69%	0.694	S	S	*	*			cis	-157.5	154.3	19.9	-134.1	172.4	-156.8	0	0	113.7
385	K	27.9	Very low	28.3	Very low	159 Å²	159	132.1 Å²	132.1	69%	0.691	70%	0.696	S	S	*	*			trans	26	150.3	133.1	-69.3	-178.4	172	-167.8	0	121.5
386	D	29.9	Very low	28.4	Very low	118 Å²	118	129.1 Å²	129.1	63%	0.631	69%	0.687	S	S	*	*			cis	-164.3	176.1	6	-128.5	-44.8	0	0	0	113.3
387	Q	30.6	Very low	28.6	Very low	154 Å²	154	129.5 Å²	129.5	72%	0.72	69%	0.69	S	S	*	*			trans	57.7	119.8	154.3	-67.9	-70.6	-26	0	0	122.2
388	P	36.1	Very low	28.7	Very low	113 Å²	113	128.6 Å²	128.6	73%	0.734	69%	0.688	S	S	*	*			trans	-114.3	140.3	164.5	36.6	-27.1	0	0	0	114.3
389	N	28.2	Very low	28.8	Very low	128 Å²	128	130.6 Å²	130.6	68%	0.684	69%	0.69	S	S	*	*			trans	-165.2	128.5	166.3	-111.1	-66.4	0	0	0	116.3
390	K	26.7	Very low	28.7	Very low	174 Å²	174	131.5 Å²	131.5	76%	0.757	69%	0.694	S	S	*	*			trans	69.9	155.7	137	-85.7	173.8	-171.8	175.5	0	124.4
391	L	25.8	Very low	28.2	Very low	145 Å²	145	132.7 Å²	132.7	76%	0.759	69%	0.692	S	S	*	*			trans	65.7	113.1	160.1	-91	72.7	0	0	0	115.6
392	S	23.6	Very low	28.1	Very low	89 Å²	89	133.8 Å²	133.8	62%	0.622	69%	0.692	S	S	*	*				64.8	115.7	82.5	82	0	0	0	0	111.1
393	S	23.8	Very low	27.8	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	70%	0.698	S	S	*	*				128.3	161.6	55	49.6	0	0	0	0	105.7
394	V	26	Very low	27.7	Very low	122 Å²	122	133.8 Å²	133.8	74%	0.739	70%	0.698	S	S	*	*			trans	70.3	100.9	179.1	-171.4	0	0	0	0	110.9
395	E	24.1	Very low	27.7	Very low	167 Å²	167	134.3 Å²	134.3	78%	0.78	70%	0.704	S	S	*	*				81.7	158.2	68.5	-162.1	-161.2	-106.8	0	0	112.7
396	S	26.6	Very low	27.6	Very low	74 Å²	74	131.8 Å²	131.8	52%	0.517	71%	0.706	S	S	.	*			trans	74.6	113.7	155.7	-72.1	0	0	0	0	120.7
397	H	28.2	Very low	27.9	Very low	177 Å²	177	131 Å²	131	82%	0.819	71%	0.707	S	S	*	*				57.8	129.6	130	-68.9	-74.9	0	0	0	119.7
398	S	28.6	Very low	27.7	Very low	78 Å²	78	132 Å²	132	55%	0.545	71%	0.712	S	S	.	*			cis	172.8	-173.8	24.6	47.7	0	0	0	0	111.5
399	K	30.5	Very low	27.3	Very low	172 Å²	172	134.2 Å²	134.2	75%	0.748	71%	0.712	S	S	*	*			trans	82	124	158.3	-69.8	150.3	-171.7	172.4	0	115.3
400	L	26	Very low	27.1	Very low	144 Å²	144	133.9 Å²	133.9	75%	0.754	71%	0.71	S	S	*	*				71.1	132.6	56.8	-63.4	166.7	0	0	0	110.1
401	L	25.7	Very low	27	Very low	125 Å²	125	132.2 Å²	132.2	65%	0.654	70%	0.704	S	S	*	*			cis	-165.5	166.8	17.3	-116.5	158.7	0	0	0	111.2
402	K	28	Very low	26.9	Very low	157 Å²	157	134.2 Å²	134.2	68%	0.683	70%	0.703	S	S	*	*			trans	66.8	163.8	155.8	-69.4	158.5	-174.7	177.6	0	116.1
403	Q	28.8	Very low	27	Very low	162 Å²	162	135.2 Å²	135.2	76%	0.757	71%	0.705	S	S	*	*			cis	-140.9	133.9	-1.7	-121.2	136.4	-32.7	0	0	106.2
404	V	25.9	Very low	27.4	Very low	116 Å²	116	139.9 Å²	139.9	70%	0.703	71%	0.714	S	S	*	*				86	137.5	68.4	166	0	0	0	0	114.4
405	N	30.5	Very low	28	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	71%	0.708	S	S	*	*			trans	83.2	101.5	167.2	-68.9	-6.2	0	0	0	122.2
406	S	26.4	Very low	28.2	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	70%	0.702	S	S	*	*			trans	-65.3	-170.2	143.3	56.6	0	0	0	0	114.1
407	P	36.5	Very low	28.7	Very low	100 Å²	100	140.3 Å²	140.3	65%	0.649	71%	0.711	S	S	*	*			cis	-131.5	-159	-27.7	29.1	-5.6	0	0	0	112.2
408	Q	25.7	Very low	28.8	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	70%	0.698	S	S	*	*			trans	72	150.6	157.9	-73.7	179.1	1.8	0	0	116.5
409	H	26.8	Very low	28.9	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.736	71%	0.708	S	S	*	*			cis	-157.9	175.8	-17	-155.7	-103.4	0	0	0	109
410	L	24.6	Very low	28.8	Very low	120 Å²	120	137.9 Å²	137.9	63%	0.628	70%	0.7	S	S	*	*			trans	72.9	129.1	151.2	-133.1	74.5	0	0	0	121.5
411	E	23.7	Very low	28.9	Very low	139 Å²	139	136.9 Å²	136.9	65%	0.65	70%	0.695	S	S	*	*				90.5	154.2	128.1	-107	168	-155.3	0	0	126.7
412	Y	25.4	Very low	29.1	Very low	188 Å²	188	139.4 Å²	139.4	74%	0.737	70%	0.701	S	S	*	*			trans	43.6	149.4	170.8	-69.7	-87.7	0	0	0	121.8
413	V	25.6	Very low	29.1	Very low	110 Å²	110	140.4 Å²	140.4	67%	0.667	71%	0.705	S	S	*	*			cis	178.5	123.9	-44.8	132.7	0	0	0	0	109.7
414	K	32.6	Very low	29	Very low	194 Å²	194	139.9 Å²	139.9	84%	0.843	71%	0.707	S	S	*	*			trans	59.9	-175.2	151.2	-97	177.1	179.3	177.3	0	118.3
415	P	36.6	Very low	29.2	Very low	94 Å²	94	141 Å²	141	61%	0.61	71%	0.709	S	S	*	*			cis	-131.9	-177.8	-12.1	26.2	-3.4	0	0	0	116.1
416	N	30.3	Very low	29	Very low	123 Å²	123	138.3 Å²	138.3	66%	0.658	70%	0.702	S	S	*	*			trans	74.4	147.9	146.8	-70.1	-12.9	0	0	0	119.1
417	H	36.6	Very low	29.2	Very low	154 Å²	154	138.3 Å²	138.3	71%	0.713	70%	0.702	S	S	*	*			cis	-153.6	171.2	-2.5	-96.5	-34.9	0	0	0	108.6
418	N	30	Very low	28.9	Very low	101 Å²	101	139.2 Å²	139.2	54%	0.54	71%	0.711	S	S	.	*			cis	-172.4	153.9	-40.7	-155.1	0.8	0	0	0	109.2
419	Y	29.7	Very low	29	Very low	195 Å²	195	137 Å²	137	77%	0.765	71%	0.711	S	S	*	*			trans	60.4	154.6	168.8	-57.7	-61.6	0	0	0	119.5
420	S	28.7	Very low	29.1	Very low	81 Å²	81	134.8 Å²	134.8	57%	0.566	71%	0.714	S	S	*	*			cis	-169	169.9	-30.4	59.4	0	0	0	0	113.3
421	N	29.5	Very low	29.3	Very low	122 Å²	122	134.8 Å²	134.8	65%	0.652	72%	0.719	S	S	*	*			trans	87.9	123.6	139.9	-76.5	-6.9	0	0	0	123.6
422	F	29.8	Very low	29.4	Very low	178 Å²	178	135.8 Å²	135.8	78%	0.781	73%	0.727	S	S	*	*			trans	70.1	135	147.3	-63.8	-48.9	0	0	0	120.2
423	K	28.4	Very low	29.5	Very low	178 Å²	178	134.9 Å²	134.9	77%	0.774	73%	0.73	S	S	*	*			cis	-153.3	153.8	-7.4	-162.4	175.1	175.4	-172.7	0	110.7
424	L	25.8	Very low	29.5	Very low	151 Å²	151	137.5 Å²	137.5	79%	0.791	74%	0.735	S	S	*	*			trans	-83.9	148.4	170.1	-76.6	75.2	0	0	0	111.3
425	D	30.3	Very low	29.1	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	73%	0.727	S	S	*	*				-160.8	120.8	118.5	-95.6	-48.2	0	0	0	107
426	S	26.3	Very low	28.6	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	73%	0.728	S	S	*	*				71.9	131.1	70	91.6	0	0	0	0	112.5
427	S	29.3	Very low	28.5	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	74%	0.742	S	S	*	*			cis	-159	150.9	-7.9	56.4	0	0	0	0	111.4
428	S	30.9	Very low	28	Very low	120 Å²	120	139.9 Å²	139.9	84%	0.839	74%	0.74	S	S	*	*			trans	163.8	93.1	152.5	-80.6	0	0	0	0	111.9
429	P	27.2	Very low	27.8	Very low	129 Å²	129	141 Å²	141	84%	0.838	74%	0.742	S	S	*	*			trans	-93.8	146.5	177.8	35.3	-31.9	0	0	0	112.7
430	S	30.1	Very low	27.7	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	75%	0.747	S	S	*	*			trans	-145.2	115.5	155.2	48.4	0	0	0	0	112.6
431	T	28.9	Very low	27.5	Very low	121 Å²	121	139.2 Å²	139.2	74%	0.742	75%	0.745	S	S	*	*			trans	53.5	77.4	151	-36.3	0	0	0	0	117.9	E433	T431-E433 HydrophobicContact CG2-CB 4.24Å; T431-E433 PolarHBondContact O-N 3.42Å
432	I	25.3	Very low	27.4	Very low	159 Å²	159	143 Å²	143	82%	0.815	76%	0.756	S	S	*	*			trans	-52.9	127	130.7	-64.2	162.7	0	0	0	107.2
433	E	27.2	Very low	27.1	Very low	169 Å²	169	144.3 Å²	144.3	79%	0.79	76%	0.762	S	S	*	*			trans	-150.4	107.1	144.9	-129.7	171.9	-137	0	0	110	T431	T431-E433 HydrophobicContact CG2-CB 4.24Å; T431-E433 PolarHBondContact O-N 3.42Å
434	E	25.6	Very low	27	Very low	165 Å²	165	146 Å²	146	77%	0.771	77%	0.77	S	S	*	*			trans	-58.7	143.6	154.4	-51.6	175.7	105.6	0	0	107.9
435	N	25.5	Very low	27	Very low	129 Å²	129	147.7 Å²	147.7	69%	0.69	77%	0.773	S	S	*	*			trans	-178.8	132.1	132.8	-101.4	-64.5	0	0	0	113.3
436	N	25.9	Very low	26.7	Very low	118 Å²	118	149.9 Å²	149.9	63%	0.631	78%	0.779	S	S	*	*			trans	31.7	96.6	139.8	-66.4	-49.9	0	0	0	119.2
437	F	26.7	Very low	26.7	Very low	215 Å²	215	153.5 Å²	153.5	94%	0.943	79%	0.79	S	S	*	*			trans	-113.5	129.6	145.7	-102.1	-89.5	0	0	0	111.9
438	F	26.8	Very low	26.5	Very low	153 Å²	153	153.2 Å²	153.2	67%	0.671	79%	0.788	S	S	*	*			trans	-82.5	163.9	-166.5	-99.2	-123.8	0	0	0	113.9	S440	F438-S440 PolarHBondContact O-N 3.19Å
439	H	25.2	Very low	26.4	Very low	125 Å²	125	155.4 Å²	155.4	58%	0.579	79%	0.789	S	S	*	*			trans	-50.5	133.7	164.8	-82.2	-125	0	0	0	111.9	E441	H439-E441 PolarHBondContact O-N 3.08Å
440	S	27.7	Very low	26.3	Very low	125 Å²	125	155 Å²	155	87%	0.874	79%	0.785	S	S	*	*			trans	-85.3	48	168.6	49.9	0	0	0	0	113.2	F438	F438-S440 PolarHBondContact O-N 3.19Å
441	E	25.3	Very low	26.1	Very low	113 Å²	113	157.3 Å²	157.3	53%	0.528	79%	0.788	S	S	.	*	S	Bend	trans	-102.3	122.3	155.3	-75.2	-161.9	150.9	0	0	108.1	R174 H439	R174-E441 IonicContact CZ-OE1 2.71Å; R174-E441 VanDerWaalsContact CZ-OE1 3.3Å; R174-E441 IonicContact NH1-OE1 2.75Å; R174-E441 PolarHBondContact NH1-OE1 3.32Å; R174-E441 IonicContact NH1-OE2 3.51Å; R174-E441 PolarHBondContact NH1-OE2 2.69Å; R174-E441 IonicContact NH2-OE1 2.91Å; R174-E441 PolarHBondContact NH2-OE1 2.88Å; H439-E441 PolarHBondContact O-N 3.08Å
442	K	26.8	Very low	26	Very low	201 Å²	201	160.4 Å²	160.4	87%	0.874	79%	0.791	S	S	*	*			trans	81	98.2	-164	-55.7	178.4	177.6	-177.4	0	115.4
443	F	25	Very low	26.2	Very low	206 Å²	206	157.4 Å²	157.4	90%	0.904	78%	0.784	S	S	*	*			trans	-160.9	76.4	150.5	-120.4	-72.4	0	0	0	110.2
444	F	26.4	Very low	26.1	Very low	215 Å²	215	155.4 Å²	155.4	94%	0.943	79%	0.789	S	S	*	*	S	Bend	trans	-162.2	45.1	167	-125.7	-68.3	0	0	0	113.4
445	E	25.5	Very low	26.1	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.864	79%	0.788	S	S	*	*	S	Bend	trans	-151.3	134.4	168.3	-121.6	155.6	-155.9	0	0	110.7
446	E	24.2	Very low	26.1	Very low	186 Å²	186	157.7 Å²	157.7	87%	0.869	80%	0.796	S	S	*	*			trans	39.9	88.1	165.8	-54.9	-161	133.8	0	0	120.4
447	L	24.9	Very low	26.1	Very low	172 Å²	172	159.8 Å²	159.8	90%	0.901	81%	0.806	S	S	*	*			trans	-168.3	132.6	135.1	-98.1	164.2	0	0	0	106.2
448	S	26.6	Very low	26.1	Very low	98 Å²	98	157.2 Å²	157.2	69%	0.685	80%	0.796	S	S	*	*	S	Bend	cis	-143.8	139.4	15.1	45.8	0	0	0	0	113.9
449	L	27.6	Very low	26	Very low	166 Å²	166	156.7 Å²	156.7	87%	0.869	80%	0.796	S	S	*	*			trans	43.1	84.4	145.7	-63.5	166.2	0	0	0	118.6	N451	L449-N451 PolarHBondContact O-N 3.47Å
450	T	24.8	Very low	26.1	Very low	121 Å²	121	157.3 Å²	157.3	74%	0.742	80%	0.804	S	S	*	*			trans	-61.4	116	150.4	52.7	0	0	0	0	109.7	K452	T450-K452 PolarHBondContact O-N 3.47Å
451	N	26.5	Very low	26	Very low	162 Å²	162	156 Å²	156	87%	0.866	79%	0.791	S	S	*	*			trans	-71.7	103	172.4	-131.2	0.9	0	0	0	108.9	L449 S453	L449-N451 PolarHBondContact O-N 3.47Å; N451-S453 PolarHBondContact O-N 3.16Å
452	K	26.6	Very low	26.2	Very low	186 Å²	186	159.8 Å²	159.8	81%	0.809	81%	0.806	S	S	*	*			trans	-80.4	103.7	-179.7	-75.4	-178.8	177.5	176.4	0	110.4	T450	T450-K452 PolarHBondContact O-N 3.47Å
453	S	30.3	Very low	26.2	Very low	96 Å²	96	156.1 Å²	156.1	67%	0.671	80%	0.796	S	S	*	*			trans	-129.7	74.1	162.1	45.4	0	0	0	0	110.4	N451 I455	N451-S453 PolarHBondContact O-N 3.16Å; S453-I455 VanDerWaalsContact C-N 3.27Å; S453-I455 PolarHBondContact O-N 2.91Å
454	S	23.6	Very low	26.5	Very low	126 Å²	126	153.4 Å²	153.4	88%	0.881	80%	0.796	S	S	*	*			trans	-72.4	79.2	173.1	-56.3	0	0	0	0	110.8
455	I	27.2	Very low	26.6	Very low	147 Å²	147	151.6 Å²	151.6	75%	0.754	79%	0.788	S	S	*	*			trans	-114.8	126.9	173.9	-62.2	-177.6	0	0	0	109	S453	S453-I455 VanDerWaalsContact C-N 3.27Å; S453-I455 PolarHBondContact O-N 2.91Å
456	K	24.4	Very low	26.7	Very low	196 Å²	196	154.7 Å²	154.7	85%	0.852	79%	0.792	S	S	*	*			trans	-75.7	136.9	176.4	-53.6	165.6	-177.1	172.1	0	109.5
457	L	26.6	Very low	26.8	Very low	161 Å²	161	152.3 Å²	152.3	84%	0.843	78%	0.784	S	S	*	*			trans	-178.9	97.7	157.2	-97.3	154.4	0	0	0	104.4
458	H	26.7	Very low	27.1	Very low	161 Å²	161	152.5 Å²	152.5	75%	0.745	79%	0.785	S	S	*	*				61.7	134.3	74	-138.6	-57.8	0	0	0	113.9
459	E	24.7	Very low	27	Very low	142 Å²	142	156.5 Å²	156.5	66%	0.664	79%	0.79	S	S	*	*			trans	-66.7	140.5	-171	-46.9	125.6	134.1	0	0	112.8
460	N	27.3	Very low	27	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	79%	0.786	S	S	*	*				175.2	148.4	100.2	-94	-65.7	0	0	0	114.5
461	T	26.1	Very low	27.2	Very low	97 Å²	97	157.6 Å²	157.6	60%	0.595	79%	0.793	S	S	*	*			trans	32.4	119.2	138.4	-47.2	0	0	0	0	120.2
462	F	29.7	Very low	27.1	Very low	192 Å²	192	156.2 Å²	156.2	84%	0.842	79%	0.79	S	S	*	*				-165.6	154.8	106.2	-114.3	-79.3	0	0	0	114.1
463	N	26.2	Very low	27.3	Very low	124 Å²	124	155.6 Å²	155.6	66%	0.663	80%	0.795	S	S	*	*			trans	-85.8	155	177	-79.7	-81.9	0	0	0	112.4
464	T	30.9	Very low	27.2	Very low	150 Å²	150	160.3 Å²	160.3	92%	0.92	80%	0.803	S	S	*	*				-166.6	162.3	119.6	14.6	0	0	0	0	112.8
465	K	27.6	Very low	27.6	Very low	177 Å²	177	159.4 Å²	159.4	77%	0.77	79%	0.794	S	S	*	*			trans	-117.8	139.9	-171.8	-60.8	172.1	-179.7	173.7	0	112.3
466	R	29.1	Very low	27.8	Very low	250 Å²	250	159.5 Å²	159.5	94%	0.943	80%	0.796	S	S	*	*			trans	-175.8	109.8	150.2	-102.3	165	-176.9	-173.1	0.2	106.2
467	L	25.9	Very low	28	Very low	136 Å²	136	156.3 Å²	156.3	71%	0.712	79%	0.789	S	S	*	*			cis	74.3	88.5	23.8	-136.2	-175	0	0	0	113.8
468	L	30	Very low	28.2	Very low	176 Å²	176	155 Å²	155	92%	0.921	78%	0.781	S	S	*	*			trans	-138.2	155.4	154.1	-100.9	167.1	0	0	0	108
469	K	25.3	Very low	28.3	Very low	181 Å²	181	153.7 Å²	153.7	79%	0.787	78%	0.78	S	S	*	*			trans	-111.4	157.9	-167.6	-88.4	-174.6	173.9	-177	0	112.6
470	P	26.7	Very low	28.6	Very low	121 Å²	121	153.1 Å²	153.1	79%	0.786	78%	0.781	S	S	*	*			trans	-76.1	159.7	177.6	33.3	-36.9	0	0	0	112.7
471	Q	29.4	Very low	28.8	Very low	190 Å²	190	152.1 Å²	152.1	89%	0.888	78%	0.776	S	S	*	*			trans	-131.1	157.7	162.4	-78.7	-168.4	-16.2	0	0	110.6
472	V	25.9	Very low	28.9	Very low	133 Å²	133	154.3 Å²	154.3	81%	0.806	78%	0.781	S	S	*	*			trans	-114.7	129.9	-178.6	174.2	0	0	0	0	108.6
473	L	29.6	Very low	28.8	Very low	172 Å²	172	151 Å²	151	90%	0.901	77%	0.772	S	S	*	*			trans	-128.3	158	162.3	-83.2	170.5	0	0	0	109.8
474	K	27.8	Very low	28.9	Very low	195 Å²	195	152 Å²	152	85%	0.848	78%	0.778	S	S	*	*			trans	-96.4	161.9	-168.4	-92.6	-175.6	175.8	-176.7	0	112.4
475	P	33.1	Very low	28.7	Very low	108 Å²	108	150.4 Å²	150.4	70%	0.701	77%	0.768	S	S	*	*			trans	-85.7	163.9	-167.3	36	-37.5	0	0	0	113
476	D	30.8	Very low	28.8	Very low	148 Å²	148	149.7 Å²	149.7	79%	0.791	77%	0.772	S	S	*	*			trans	-158.8	150.4	136.5	-102.1	-31.2	0	0	0	112.4
477	N	29.7	Very low	28.6	Very low	129 Å²	129	144.7 Å²	144.7	69%	0.69	76%	0.763	S	S	*	*			trans	63	115.4	153.4	-70.6	-34.3	0	0	0	124.7
478	I	29.4	Very low	28.6	Very low	135 Å²	135	146.6 Å²	146.6	69%	0.692	77%	0.767	S	S	*	*				90.1	104.3	122.5	-65.4	170.9	0	0	0	120.3
479	N	29.4	Very low	28.4	Very low	132 Å²	132	141.7 Å²	141.7	71%	0.706	75%	0.753	S	S	*	*			trans	62.3	125.7	135.5	-60.3	4.8	0	0	0	123.8
480	N	30.3	Very low	28.5	Very low	130 Å²	130	140.4 Å²	140.4	70%	0.695	75%	0.754	S	S	*	*			trans	68.4	144.6	133.7	-65.6	39.2	0	0	0	119.6
481	D	32	Very low	28.4	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	75%	0.752	S	S	*	*			cis	-151.7	161.8	5.4	-125.9	-39.9	0	0	0	114.4
482	M	28.9	Very low	28.3	Very low	142 Å²	142	137 Å²	137	70%	0.7	75%	0.748	S	S	*	*			trans	46.6	123.5	156.1	-66.6	-63.8	-175.2	0	0	124.1
483	N	27	Very low	28.4	Very low	123 Å²	123	137.4 Å²	137.4	66%	0.658	75%	0.752	S	S	*	*			trans	54.1	111.3	134.5	-54	-26	0	0	0	119.8
484	N	28.5	Very low	28.3	Very low	146 Å²	146	133.4 Å²	133.4	78%	0.781	74%	0.738	S	S	*	*				-178.3	155.6	70.4	-97	-50.9	0	0	0	113.5
485	T	26.9	Very low	28.4	Very low	116 Å²	116	133.9 Å²	133.9	71%	0.712	74%	0.74	S	S	*	*			trans	37.8	104.8	149.6	-39.8	0	0	0	0	120.2
486	L	28.2	Very low	28.1	Very low	162 Å²	162	133.7 Å²	133.7	85%	0.848	74%	0.741	S	S	*	*				-165.5	166.3	121.5	-128.7	81.4	0	0	0	114.9
487	L	25.1	Very low	28.1	Very low	145 Å²	145	131.3 Å²	131.3	76%	0.759	73%	0.734	S	S	*	*			trans	-65.2	170.2	-174.8	-70.8	147.6	0	0	0	117.9
488	H	27	Very low	27.9	Very low	175 Å²	175	134 Å²	134	81%	0.81	74%	0.74	S	S	*	*			trans	93.4	101.1	146	-101.9	-93	0	0	0	121.9
489	A	25.5	Very low	27.8	Very low	74 Å²	74	138.6 Å²	138.6	61%	0.612	75%	0.75	S	S	*	*				74.5	132	125.9	0	0	0	0	0	124.3
490	N	26.7	Very low	27.6	Very low	153 Å²	153	143 Å²	143	82%	0.818	76%	0.759	S	S	*	*			trans	100.6	142.2	143.1	-66.8	-16.9	0	0	0	123.2
491	S	26.4	Very low	27.4	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	76%	0.761	S	S	*	*			trans	65.1	96.1	154	43.9	0	0	0	0	122.2
492	V	26.9	Very low	27.1	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	77%	0.769	S	S	*	*				35	113.5	121	-173.2	0	0	0	0	119
493	T	28	Very low	26.9	Very low	143 Å²	143	146.4 Å²	146.4	88%	0.877	78%	0.777	S	S	*	*				-164.5	166.5	119.9	10.9	0	0	0	0	112.7
494	S	27.5	Very low	26.8	Very low	87 Å²	87	149.8 Å²	149.8	61%	0.608	79%	0.789	S	S	*	*			trans	-73.1	149	-174.1	51	0	0	0	0	115.5
495	F	29	Very low	26.7	Very low	206 Å²	206	151.4 Å²	151.4	90%	0.904	79%	0.792	S	S	*	*				-169.6	-173.3	107.7	-103.7	-70.2	0	0	0	111.6
496	S	27.3	Very low	26.7	Very low	103 Å²	103	151.8 Å²	151.8	72%	0.72	79%	0.79	S	S	*	*			trans	-133.8	175.3	-163.6	-155.3	0	0	0	0	110.6
497	P	31.6	Very low	26.7	Very low	98 Å²	98	150.9 Å²	150.9	64%	0.636	79%	0.785	S	S	*	*				-120.4	-164.2	-52.9	28.5	-8.6	0	0	0	111.7
498	F	25.5	Very low	26.8	Very low	187 Å²	187	148.9 Å²	148.9	82%	0.82	78%	0.783	S	S	*	*			trans	76.5	131.5	174.2	-69.4	-90.9	0	0	0	118.5
499	Y	26.7	Very low	26.8	Very low	230 Å²	230	149.7 Å²	149.7	90%	0.902	78%	0.784	S	S	*	*			trans	-150.8	100.7	146.5	-129	-88.3	0	0	0	108.9
500	Y	25.4	Very low	26.9	Very low	226 Å²	226	153.4 Å²	153.4	89%	0.886	79%	0.794	S	S	*	*			trans	-161.7	65.6	174.2	-143.9	-70	0	0	0	111.9
501	S	26.6	Very low	27.1	Very low	106 Å²	106	154.8 Å²	154.8	74%	0.741	80%	0.795	S	S	*	*			trans	-161.5	105.5	173.9	56.1	0	0	0	0	113.6
502	V	25.2	Very low	27	Very low	134 Å²	134	158.5 Å²	158.5	81%	0.812	80%	0.801	S	S	*	*			trans	-138.2	147	146.5	-174.2	0	0	0	0	106.1
503	Y	24.3	Very low	27.1	Very low	221 Å²	221	161.7 Å²	161.7	87%	0.867	80%	0.804	S	S	*	*			trans	76.3	69.6	-173.6	-74.2	-79.1	0	0	0	118.4
504	Q	24.1	Very low	27	Very low	195 Å²	195	158.4 Å²	158.4	91%	0.911	79%	0.787	S	S	*	*				-150	115.9	127	-84.7	-156	-7.2	0	0	110.7
505	Q	26.3	Very low	27	Very low	179 Å²	179	163.9 Å²	163.9	84%	0.836	80%	0.796	S	S	*	*			trans	-149.8	113	152.9	-77.9	-164.5	-12.3	0	0	109.1
506	N	28.6	Very low	27	Very low	125 Å²	125	162.1 Å²	162.1	67%	0.668	79%	0.79	S	S	*	*				178.4	133.9	118.6	-90	-16.3	0	0	0	112
507	L	27.7	Very low	26.9	Very low	142 Å²	142	164 Å²	164	74%	0.743	79%	0.791	S	S	*	*			trans	30.1	150.5	149.5	-66.7	89.7	0	0	0	122.2
508	S	27.8	Very low	26.7	Very low	104 Å²	104	165.2 Å²	165.2	73%	0.727	80%	0.799	S	S	*	*			cis	-163.1	175.3	-27.6	75.8	0	0	0	0	109.9
509	K	25.4	Very low	26.6	Very low	192 Å²	192	161.7 Å²	161.7	84%	0.835	79%	0.792	S	S	*	*			trans	-42.9	136.3	179.3	-54.1	160.4	-178.3	172.6	0	114.2
510	N	28	Very low	26.7	Very low	151 Å²	151	161.6 Å²	161.6	81%	0.807	79%	0.792	S	S	*	*				-166.2	157.6	119.5	-112.4	-29.4	0	0	0	116.6
511	Q	30.9	Very low	26.9	Very low	182 Å²	182	155 Å²	155	85%	0.85	78%	0.777	S	S	*	*			trans	63.9	115.6	161	-66.6	176.7	8.7	0	0	120.6
512	Q	25.1	Very low	26.8	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.864	78%	0.779	S	S	*	*			trans	-95.9	156.6	160.2	-50.7	152.2	-53.4	0	0	109
513	K	28.2	Very low	27	Very low	199 Å²	199	160.9 Å²	160.9	87%	0.865	78%	0.781	S	S	*	*				-176.1	153.4	122.9	-103.5	168.7	-177.7	-178	0	113.7
514	S	26.1	Very low	27	Very low	74 Å²	74	155 Å²	155	52%	0.517	77%	0.772	S	S	.	*			trans	-5.3	149.2	158.3	53.8	0	0	0	0	119.3
515	Y	27.8	Very low	27.5	Very low	203 Å²	203	151 Å²	151	80%	0.796	76%	0.763	S	S	*	*			cis	-157.2	168.7	45.5	-77.3	-84.5	0	0	0	109.9
516	Q	27.6	Very low	27.5	Very low	168 Å²	168	151.7 Å²	151.7	79%	0.785	76%	0.764	S	S	*	*			cis	-177.7	168.6	-17.2	-171.2	173.2	21.6	0	0	105
517	I	25.1	Very low	27.6	Very low	142 Å²	142	153 Å²	153	73%	0.728	77%	0.77	S	S	*	*			trans	-135.9	141.6	-176	-55	167.6	0	0	0	110.2	V519	I517-V519 HydrophobicContact CG2-CG2 3.95Å
518	P	29	Very low	27.5	Very low	125 Å²	125	153.4 Å²	153.4	81%	0.812	77%	0.772	S	S	*	*			trans	-97.4	134.8	157.1	-2.3	22.9	0	0	0	112
519	V	23	Very low	27.7	Very low	112 Å²	112	153 Å²	153	68%	0.679	77%	0.769	S	S	*	*			trans	-128.4	135.4	175.2	174.5	0	0	0	0	108.3	I517	I517-V519 HydrophobicContact CG2-CG2 3.95Å
520	Y	27.7	Very low	28	Very low	228 Å²	228	150.4 Å²	150.4	89%	0.894	77%	0.77	S	S	*	*			trans	-139.1	152	160	-89.1	-83.7	0	0	0	112.2
521	P	29.9	Very low	28.5	Very low	89 Å²	89	146.6 Å²	146.6	58%	0.578	75%	0.754	S	S	*	*			trans	-138.9	-173.3	-146.8	44.6	-27.1	0	0	0	117
522	F	25.3	Very low	28.7	Very low	179 Å²	179	143 Å²	143	79%	0.785	74%	0.74	S	S	*	*			trans	54.3	119.5	155.8	-75	-70.7	0	0	0	120.4
523	H	29.4	Very low	29.1	Very low	183 Å²	183	141.1 Å²	141.1	85%	0.847	73%	0.73	S	S	*	*				-178.5	159.5	98.6	-107	-80.2	0	0	0	115
524	S	23.2	Very low	29.5	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	72%	0.722	S	S	*	*			trans	-140.6	-178	166	69.1	0	0	0	0	106.9
525	P	35.5	Very low	30.2	Very low	110 Å²	110	141 Å²	141	71%	0.714	72%	0.724	S	S	*	*			cis	-142.1	-168.7	13.5	38.9	-15.1	0	0	0	117.1
526	F	26.5	Very low	30.6	Very low	194 Å²	194	136.6 Å²	136.6	85%	0.851	71%	0.711	S	S	*	*			trans	-4.8	141.9	159.1	-74.9	-102.4	0	0	0	121.1
527	L	29.9	Very low	31.3	Very low	152 Å²	152	133.4 Å²	133.4	80%	0.796	70%	0.696	S	S	*	*				-173.2	153.7	107.1	-97	173.6	0	0	0	114.7
528	L	26.8	Very low	31.8	Very low	152 Å²	152	134.2 Å²	134.2	80%	0.796	69%	0.69	S	S	*	*			trans	33.4	115.2	155	-72.2	158.6	0	0	0	122.4
529	S	32.1	Very low	32.4	Very low	94 Å²	94	132.4 Å²	132.4	66%	0.657	67%	0.673	S	S	*	*				-177.2	163.6	102.1	55.3	0	0	0	0	112.2	S531	S529-S531 VanDerWaalsContact C-N 3.3Å; S529-S531 PolarHBondContact O-N 3.49Å
530	T	32	Very low	33.1	Very low	139 Å²	139	132 Å²	132	85%	0.853	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	3	-166.3	30.1	0	0	0	0	116.6
531	S	36.8	Very low	33.6	Very low	70 Å²	70	126.7 Å²	126.7	49%	0.49	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-39.3	-175.8	56.4	0	0	0	0	114.3	S529 F533 Q534	S529-S531 VanDerWaalsContact C-N 3.3Å; S529-S531 PolarHBondContact O-N 3.49Å; S531-F533 VanDerWaalsContact C-N 3.32Å; S531-F533 PolarHBondContact O-N 3.15Å; S531-Q534 PolarHBondContact O-N 2.75Å
532	L	35.9	Very low	34.1	Very low	106 Å²	106	127.6 Å²	127.6	56%	0.555	65%	0.647	S	S	*	*	H	α-helix	trans	-67.1	-27.7	-170.2	-111.9	80.3	0	0	0	114.3	Q534 Q535 Q536	L532-Q534 PolarHBondContact O-N 2.93Å; L532-Q535 PolarHBondContact O-N 3.23Å; L532-Q536 PolarHBondContact O-N 3.4Å
533	F	32.5	Very low	34.8	Very low	147 Å²	147	126.7 Å²	126.7	65%	0.645	64%	0.642	S	S	*	*	H	α-helix	trans	-66.8	-39.9	-176.2	-164.4	-102	0	0	0	112	S531 Q535 H537	S531-F533 VanDerWaalsContact C-N 3.32Å; S531-F533 PolarHBondContact O-N 3.15Å; F533-Q535 VanDerWaalsContact C-N 3.35Å; F533-H537 PolarHBondContact O-N 3.27Å
534	Q	37.1	Very low	35.4	Very low	151 Å²	151	124 Å²	124	71%	0.706	63%	0.628	S	S	*	*	H	α-helix	trans	-68.3	-34	173.7	-71	-172.8	-11.3	0	0	112.2	S531 L532 H537 R538	S531-Q534 PolarHBondContact O-N 2.75Å; L532-Q534 PolarHBondContact O-N 2.93Å; Q534-H537 PolarHBondContact O-N 3.16Å; Q534-R538 PolarHBondContact O-N 3.31Å
535	Q	40.3	Very low	36.5	Very low	118 Å²	118	122.4 Å²	122.4	55%	0.551	62%	0.617	S	S	*	*	H	α-helix	trans	-72.7	-37.2	178	-156.2	172.6	16.9	0	0	112	L532 F533 R538 N539	L532-Q535 PolarHBondContact O-N 3.23Å; F533-Q535 VanDerWaalsContact C-N 3.35Å; Q535-R538 PolarHBondContact O-N 2.9Å; Q535-N539 WeakPolarHBondContact O-CB 3.27Å; Q535-N539 PolarHBondContact O-N 3.09Å; Q535-N539 PolarHBondContact O-ND2 2.98Å
536	Q	38.1	Very low	37.3	Very low	112 Å²	112	121.1 Å²	121.1	52%	0.523	60%	0.604	S	S	.	*	H	α-helix	trans	-63.6	-39.7	167.9	-75.8	-165.5	-6.6	0	0	111.9	L532 N539 Q540	L532-Q536 PolarHBondContact O-N 3.4Å; Q536-N539 PolarHBondContact O-N 3.4Å; Q536-Q540 WeakPolarHBondContact O-CG 3.33Å; Q536-Q540 PolarHBondContact O-N 3.42Å
537	H	41.9	Very low	38.7	Very low	101 Å²	101	115 Å²	115	47%	0.468	59%	0.586	S	S	.	*	H	α-helix	trans	-63.2	-43.6	175.1	-120	-88.3	0	0	0	112.4	F533 Q534 Q540 Q541	F533-H537 PolarHBondContact O-N 3.27Å; Q534-H537 PolarHBondContact O-N 3.16Å; H537-Q540 PolarHBondContact O-N 3.34Å; H537-Q541 WeakPolarHBondContact O-CG 3.3Å; H537-Q541 PolarHBondContact O-N 2.78Å
538	R	35.8	Very low	39.8	Very low	158 Å²	158	112.4 Å²	112.4	60%	0.596	57%	0.572	S	S	*	*	H	α-helix	trans	-59.8	-43.6	171.6	-93.7	179	160	151.6	-9.6	112	Q534 Q535 Q540 Q541 L542 N622	Q534-R538 PolarHBondContact O-N 3.31Å; Q535-R538 PolarHBondContact O-N 2.9Å; R538-Q540 VanDerWaalsContact C-N 3.33Å; R538-Q540 PolarHBondContact O-N 2.73Å; R538-Q541 WeakPolarHBondContact O-CB 3.34Å; R538-Q541 PolarHBondContact O-N 2.96Å; R538-Q541 VanDerWaalsContact O-N 3.17Å; R538-L542 PolarHBondContact O-N 3.43Å; R538-N622 PolarHBondContact NH2-OD1 2.97Å
539	N	40.3	Very low	41.3	Very low	87 Å²	87	108.2 Å²	108.2	47%	0.465	56%	0.556	S	S	.	*	H	α-helix	trans	-68.7	-27.8	177.3	-75.1	-21.1	0	0	0	113.5	Q535 Q536 K543	Q535-N539 WeakPolarHBondContact O-CB 3.27Å; Q535-N539 PolarHBondContact O-N 3.09Å; Q535-N539 PolarHBondContact O-ND2 2.98Å; Q536-N539 PolarHBondContact O-N 3.4Å; N539-K543 WeakPolarHBondContact O-CB 3.41Å; N539-K543 WeakPolarHBondContact O-CG 3.16Å; N539-K543 PolarHBondContact O-N 3.32Å
540	Q	38.9	Very low	42.7	Very low	104 Å²	104	109.2 Å²	109.2	49%	0.486	55%	0.548	S	S	.	.	H	α-helix	trans	-73.5	-35	169.2	-73.2	-171.2	22.4	0	0	112.4	Q536 H537 R538 K543 K544	Q536-Q540 WeakPolarHBondContact O-CG 3.33Å; Q536-Q540 PolarHBondContact O-N 3.42Å; H537-Q540 PolarHBondContact O-N 3.34Å; R538-Q540 VanDerWaalsContact C-N 3.33Å; R538-Q540 PolarHBondContact O-N 2.73Å; Q540-K543 PolarHBondContact O-N 3.16Å; Q540-K544 WeakPolarHBondContact O-CB 3.26Å; Q540-K544 WeakPolarHBondContact O-CG 3.35Å; Q540-K544 PolarHBondContact O-N 3.44Å
541	Q	38.4	Very low	43.9	Very low	116 Å²	116	107.9 Å²	107.9	54%	0.542	54%	0.535	S	S	.	.	H	α-helix	trans	-64.4	-44	171.8	-65.8	-74.9	43.6	0	0	111.2	H537 R538 K544 S545	H537-Q541 WeakPolarHBondContact O-CG 3.3Å; H537-Q541 PolarHBondContact O-N 2.78Å; R538-Q541 WeakPolarHBondContact O-CB 3.34Å; R538-Q541 PolarHBondContact O-N 2.96Å; R538-Q541 VanDerWaalsContact O-N 3.17Å; Q541-K544 CarbonylContact O-C 3.45Å; Q541-K544 WeakPolarHBondContact O-CA 3.32Å; Q541-K544 WeakPolarHBondContact O-CB 3.28Å; Q541-K544 PolarHBondContact O-N 3.41Å; Q541-S545 PolarHBondContact O-N 3.3Å
542	L	39.4	Very low	45	Very low	109 Å²	109	109.6 Å²	109.6	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-39.1	175.2	-82.7	155.8	0	0	0	112.9	R538 K544 S545 D546	R538-L542 PolarHBondContact O-N 3.43Å; L542-K544 VanDerWaalsContact C-N 3.27Å; L542-K544 PolarHBondContact O-N 2.78Å; L542-S545 PolarHBondContact O-N 2.76Å; L542-S545 PolarHBondContact O-OG 2.82Å; L542-D546 WeakPolarHBondContact O-CB 3.41Å; L542-D546 PolarHBondContact O-N 2.87Å; L542-D546 VanDerWaalsContact O-N 3.08Å
543	K	40.9	Very low	46.3	Very low	159 Å²	159	107.6 Å²	107.6	69%	0.691	53%	0.533	S	S	*	.	H	α-helix	trans	-67.8	-25.2	171.4	-75.1	-179.1	177.8	-177.5	0	112.9	N539 Q540 S547	N539-K543 WeakPolarHBondContact O-CB 3.41Å; N539-K543 WeakPolarHBondContact O-CG 3.16Å; N539-K543 PolarHBondContact O-N 3.32Å; Q540-K543 PolarHBondContact O-N 3.16Å; K543-S547 WeakPolarHBondContact O-CB 3.47Å; K543-S547 PolarHBondContact O-N 3.2Å; K543-S547 PolarHBondContact O-OG 2.91Å
544	K	42.1	Very low	47.6	Very low	126 Å²	126	107.7 Å²	107.7	55%	0.548	53%	0.529	S	S	.	.	H	α-helix	trans	-75.2	-42	172.1	-78.3	173.5	179.1	177.9	0	112.6	Q540 Q541 L542 S547 L548	Q540-K544 WeakPolarHBondContact O-CB 3.26Å; Q540-K544 WeakPolarHBondContact O-CG 3.35Å; Q540-K544 PolarHBondContact O-N 3.44Å; Q541-K544 CarbonylContact O-C 3.45Å; Q541-K544 WeakPolarHBondContact O-CA 3.32Å; Q541-K544 WeakPolarHBondContact O-CB 3.28Å; Q541-K544 PolarHBondContact O-N 3.41Å; L542-K544 VanDerWaalsContact C-N 3.27Å; L542-K544 PolarHBondContact O-N 2.78Å; K544-S547 WeakPolarHBondContact CA-OG 3.5Å; K544-S547 PolarHBondContact O-N 3.35Å; K544-S547 PolarHBondContact O-OG 2.96Å; K544-L548 VanDerWaalsContact O-CB 3.27Å; K544-L548 WeakPolarHBondContact O-CB 3.48Å; K544-L548 PolarHBondContact O-N 2.84Å
545	S	44.7	Very low	48.7	Very low	66 Å²	66	107.7 Å²	107.7	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-41.9	175.7	60.7	0	0	0	0	111.8	Q541 L542 S547 L548 S549	Q541-S545 PolarHBondContact O-N 3.3Å; L542-S545 PolarHBondContact O-N 2.76Å; L542-S545 PolarHBondContact O-OG 2.82Å; S545-S547 PolarHBondContact O-N 3.41Å; S545-L548 PolarHBondContact O-N 3.12Å; S545-S549 WeakPolarHBondContact O-CB 3.26Å; S545-S549 PolarHBondContact O-N 2.79Å
546	D	54.1	Low	50.1	Low	82 Å²	82	106.3 Å²	106.3	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-34.3	179.6	-174.1	53.4	0	0	0	112.7	L542 K550	L542-D546 WeakPolarHBondContact O-CB 3.41Å; L542-D546 PolarHBondContact O-N 2.87Å; L542-D546 VanDerWaalsContact O-N 3.08Å; D546-K550 WeakPolarHBondContact O-CD 3.36Å; D546-K550 WeakPolarHBondContact O-CG 3.32Å; D546-K550 PolarHBondContact O-N 2.78Å; D546-K550 IonicContact OD1-NZ 3.53Å; D546-K550 PolarHBondContact OD1-NZ 2.92Å; D546-K550 VanDerWaalsContact OD1-NZ 3.1Å; D546-K550 IonicContact OD2-NZ 2.75Å; D546-K550 PolarHBondContact OD2-NZ 2.91Å
547	S	54.5	Low	51.5	Low	66 Å²	66	105.3 Å²	105.3	46%	0.462	52%	0.516	S	S	.	.	H	α-helix	trans	-77.1	-32.5	171.9	51.6	0	0	0	0	113.5	K543 K544 S545 K550 L551	K543-S547 WeakPolarHBondContact O-CB 3.47Å; K543-S547 PolarHBondContact O-N 3.2Å; K543-S547 PolarHBondContact O-OG 2.91Å; K544-S547 WeakPolarHBondContact CA-OG 3.5Å; K544-S547 PolarHBondContact O-N 3.35Å; K544-S547 PolarHBondContact O-OG 2.96Å; S545-S547 PolarHBondContact O-N 3.41Å; S547-K550 PolarHBondContact O-N 3.09Å; S547-L551 WeakPolarHBondContact O-CB 3.41Å; S547-L551 PolarHBondContact O-N 3.19Å
548	L	54.1	Low	52.3	Low	98 Å²	98	104.6 Å²	104.6	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-43.7	171	-173	70.6	0	0	0	111.3	K544 S545 K550 L551 L552	K544-L548 VanDerWaalsContact O-CB 3.27Å; K544-L548 WeakPolarHBondContact O-CB 3.48Å; K544-L548 PolarHBondContact O-N 2.84Å; S545-L548 PolarHBondContact O-N 3.12Å; L548-K550 PolarHBondContact O-N 3.46Å; L548-L551 WeakPolarHBondContact O-CB 3.34Å; L548-L551 PolarHBondContact O-N 2.69Å; L548-L551 VanDerWaalsContact O-N 3.13Å; L548-L552 HydrophobicContact CG-CD1 4.13Å; L548-L552 WeakPolarHBondContact O-CG 3.12Å; L548-L552 PolarHBondContact O-N 2.64Å
549	S	56.8	Low	53.6	Low	64 Å²	64	101.2 Å²	101.2	45%	0.448	51%	0.514	S	S	.	.	H	α-helix	trans	-56.4	-49.7	173.9	178.6	0	0	0	0	111.1	S545 L551 L552 S553	S545-S549 WeakPolarHBondContact O-CB 3.26Å; S545-S549 PolarHBondContact O-N 2.79Å; S549-L551 VanDerWaalsContact C-N 3.28Å; S549-L551 PolarHBondContact O-N 3.19Å; S549-L552 PolarHBondContact O-N 2.92Å; S549-S553 PolarHBondContact O-N 2.93Å; S549-S553 PolarHBondContact O-OG 3.15Å; S549-S553 VanDerWaalsContact O-OG 3.08Å
550	K	61.7	Low	54.7	Low	115 Å²	115	99.9 Å²	99.9	50%	0.5	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-31.5	176	-72.9	161.2	-173.3	159.5	0	113.3	D546 S547 L548 R554	D546-K550 WeakPolarHBondContact O-CD 3.36Å; D546-K550 WeakPolarHBondContact O-CG 3.32Å; D546-K550 PolarHBondContact O-N 2.78Å; D546-K550 IonicContact OD1-NZ 3.53Å; D546-K550 PolarHBondContact OD1-NZ 2.92Å; D546-K550 VanDerWaalsContact OD1-NZ 3.1Å; D546-K550 IonicContact OD2-NZ 2.75Å; D546-K550 PolarHBondContact OD2-NZ 2.91Å; S547-K550 PolarHBondContact O-N 3.09Å; L548-K550 PolarHBondContact O-N 3.46Å; K550-R554 WeakPolarHBondContact O-CB 3.24Å; K550-R554 WeakPolarHBondContact O-CG 3.49Å; K550-R554 PolarHBondContact O-N 3.43Å; K550-R554 VanDerWaalsContact O-N 3.13Å
551	L	58.5	Low	56.1	Low	111 Å²	111	99.9 Å²	99.9	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-71.5	-44.4	173.8	-173.2	65.2	0	0	0	111.8	S547 L548 S549 R554 Y555	S547-L551 WeakPolarHBondContact O-CB 3.41Å; S547-L551 PolarHBondContact O-N 3.19Å; L548-L551 WeakPolarHBondContact O-CB 3.34Å; L548-L551 PolarHBondContact O-N 2.69Å; L548-L551 VanDerWaalsContact O-N 3.13Å; S549-L551 VanDerWaalsContact C-N 3.28Å; S549-L551 PolarHBondContact O-N 3.19Å; L551-R554 WeakPolarHBondContact O-CB 3.43Å; L551-R554 PolarHBondContact O-N 3.23Å; L551-Y555 PolarHBondContact O-N 2.95Å
552	L	58.5	Low	57.3	Low	105 Å²	105	96 Å²	96	55%	0.55	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176	-70.5	169.1	0	0	0	111.5	L548 S549 R554 Y555 H556	L548-L552 HydrophobicContact CG-CD1 4.13Å; L548-L552 WeakPolarHBondContact O-CG 3.12Å; L548-L552 PolarHBondContact O-N 2.64Å; S549-L552 PolarHBondContact O-N 2.92Å; L552-R554 VanDerWaalsContact C-N 3.31Å; L552-R554 PolarHBondContact O-N 2.79Å; L552-Y555 PolarHBondContact O-N 3.18Å; L552-H556 WeakPolarHBondContact O-CB 3.5Å; L552-H556 PolarHBondContact O-N 3.45Å
553	S	63.9	Low	58.5	Low	64 Å²	64	95.5 Å²	95.5	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-36.8	173.2	-56.7	0	0	0	0	112.4	S549 N557	S549-S553 PolarHBondContact O-N 2.93Å; S549-S553 PolarHBondContact O-OG 3.15Å; S549-S553 VanDerWaalsContact O-OG 3.08Å; S553-N557 WeakPolarHBondContact O-CB 3.48Å; S553-N557 PolarHBondContact O-N 3.12Å; S553-N557 VanDerWaalsContact O-N 3.12Å; S553-N557 PolarHBondContact O-ND2 3.12Å
554	R	60.1	Low	60.1	Low	150 Å²	150	95.1 Å²	95.1	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-66.2	-44.3	172.2	-79.1	176.2	173.6	-163.6	-3.6	111.4	K550 L551 L552 N557 C558	K550-R554 WeakPolarHBondContact O-CB 3.24Å; K550-R554 WeakPolarHBondContact O-CG 3.49Å; K550-R554 PolarHBondContact O-N 3.43Å; K550-R554 VanDerWaalsContact O-N 3.13Å; L551-R554 WeakPolarHBondContact O-CB 3.43Å; L551-R554 PolarHBondContact O-N 3.23Å; L552-R554 VanDerWaalsContact C-N 3.31Å; L552-R554 PolarHBondContact O-N 2.79Å; R554-N557 PolarHBondContact O-N 2.87Å; R554-C558 PolarHBondContact O-N 3Å; R554-C558 PolarHBondContact O-SG 2.9Å; R554-C558 VanDerWaalsContact O-SG 3.38Å
555	Y	59	Low	61.4	Low	150 Å²	150	93 Å²	93	59%	0.588	49%	0.486	S	S	*	.	H	α-helix	trans	-62.7	-45	179	-166	-104.5	0	0	0	112.2	L551 L552 N557 C558 L559	L551-Y555 PolarHBondContact O-N 2.95Å; L552-Y555 PolarHBondContact O-N 3.18Å; Y555-N557 PolarHBondContact O-N 3.25Å; Y555-C558 WeakPolarHBondContact O-CB 3.14Å; Y555-C558 PolarHBondContact O-N 3.2Å; Y555-C558 VanDerWaalsContact O-N 3.16Å; Y555-L559 HydrophobicContact CD1-CD1 3.91Å; Y555-L559 HydrophobicContact CD1-CG 4.43Å; Y555-L559 HydrophobicContact CE1-CD1 3.79Å; Y555-L559 HydrophobicContact CE1-CG 4.28Å; Y555-L559 PolarHBondContact O-N 3.04Å
556	H	69.8	Low	62.5	Low	89 Å²	89	95.1 Å²	95.1	41%	0.412	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-39.2	175.5	-174.8	85.1	0	0	0	112.5	L552 L559 Q560	L552-H556 WeakPolarHBondContact O-CB 3.5Å; L552-H556 PolarHBondContact O-N 3.45Å; H556-L559 PolarHBondContact O-N 3.46Å; H556-Q560 PolarHBondContact CD2-NE2 3.47Å; H556-Q560 PolarHBondContact NE2-NE2 3.08Å; H556-Q560 PolarHBondContact O-N 2.92Å
557	N	67.3	Low	63.3	Low	92 Å²	92	96.6 Å²	96.6	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-40	171.8	-85.2	-73.9	0	0	0	112.3	S553 R554 Y555 Q560 I561	S553-N557 WeakPolarHBondContact O-CB 3.48Å; S553-N557 PolarHBondContact O-N 3.12Å; S553-N557 VanDerWaalsContact O-N 3.12Å; S553-N557 PolarHBondContact O-ND2 3.12Å; R554-N557 PolarHBondContact O-N 2.87Å; Y555-N557 PolarHBondContact O-N 3.25Å; N557-Q560 PolarHBondContact O-N 3.2Å; N557-I561 WeakPolarHBondContact O-CB 3.38Å; N557-I561 WeakPolarHBondContact O-CD1 3.46Å; N557-I561 VanDerWaalsContact O-CG1 3.23Å; N557-I561 WeakPolarHBondContact O-CG1 3.36Å; N557-I561 PolarHBondContact O-N 2.81Å
558	C	59.1	Low	64.1	Low	85 Å²	85	102.7 Å²	102.7	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-40.4	174.2	-72	0	0	0	0	112.3	R554 Y555 I561 G562	R554-C558 PolarHBondContact O-N 3Å; R554-C558 PolarHBondContact O-SG 2.9Å; R554-C558 VanDerWaalsContact O-SG 3.38Å; Y555-C558 WeakPolarHBondContact O-CB 3.14Å; Y555-C558 PolarHBondContact O-N 3.2Å; Y555-C558 VanDerWaalsContact O-N 3.16Å; C558-I561 PolarHBondContact O-N 3.35Å; C558-G562 PolarHBondContact O-N 3.27Å
559	L	64.5	Low	64.5	Low	87 Å²	87	101.4 Å²	101.4	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-51.9	174.1	-71.7	170.8	0	0	0	111.6	Y555 H556 I561 G562 E563	Y555-L559 HydrophobicContact CD1-CD1 3.91Å; Y555-L559 HydrophobicContact CD1-CG 4.43Å; Y555-L559 HydrophobicContact CE1-CD1 3.79Å; Y555-L559 HydrophobicContact CE1-CG 4.28Å; Y555-L559 PolarHBondContact O-N 3.04Å; H556-L559 PolarHBondContact O-N 3.46Å; L559-I561 VanDerWaalsContact C-N 3.26Å; L559-I561 PolarHBondContact O-N 2.7Å; L559-G562 CarbonylContact O-C 3.6Å; L559-G562 WeakPolarHBondContact O-CA 3.38Å; L559-G562 PolarHBondContact O-N 3.43Å; L559-E563 PolarHBondContact O-N 3.08Å
560	Q	63.4	Low	65.3	Low	60 Å²	60	103.7 Å²	103.7	28%	0.28	51%	0.508	S	S	.	.	H	α-helix	trans	-59.7	-34.8	177.2	-72.2	-163	23.3	0	0	113.1	H556 N557 R564	H556-Q560 PolarHBondContact CD2-NE2 3.47Å; H556-Q560 PolarHBondContact NE2-NE2 3.08Å; H556-Q560 PolarHBondContact O-N 2.92Å; N557-Q560 PolarHBondContact O-N 3.2Å; Q560-R564 WeakPolarHBondContact O-CB 3.42Å; Q560-R564 WeakPolarHBondContact O-CD 3.47Å; Q560-R564 WeakPolarHBondContact O-CG 3.49Å; Q560-R564 PolarHBondContact O-N 3.06Å; Q560-R564 VanDerWaalsContact O-N 3.1Å
561	I	68.1	Low	65.9	Low	103 Å²	103	103 Å²	103	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-67.9	-42.2	173.9	-70.3	165.3	0	0	0	110.3	N557 C558 L559 R564 V565	N557-I561 WeakPolarHBondContact O-CB 3.38Å; N557-I561 WeakPolarHBondContact O-CD1 3.46Å; N557-I561 VanDerWaalsContact O-CG1 3.23Å; N557-I561 WeakPolarHBondContact O-CG1 3.36Å; N557-I561 PolarHBondContact O-N 2.81Å; C558-I561 PolarHBondContact O-N 3.35Å; L559-I561 VanDerWaalsContact C-N 3.26Å; L559-I561 PolarHBondContact O-N 2.7Å; I561-R564 PolarHBondContact O-N 3.35Å; I561-V565 WeakPolarHBondContact O-CB 3.38Å; I561-V565 VanDerWaalsContact O-CG2 3.32Å; I561-V565 WeakPolarHBondContact O-CG2 3.36Å; I561-V565 PolarHBondContact O-N 2.85Å
562	G	62.9	Low	66.4	Low	36 Å²	36	105.8 Å²	105.8	37%	0.371	51%	0.512	S	S	.	.	H	α-helix	trans	-56.8	-51.1	174.2	0	0	0	0	0	112.4	C558 L559 R564 V565 L566	C558-G562 PolarHBondContact O-N 3.27Å; L559-G562 CarbonylContact O-C 3.6Å; L559-G562 WeakPolarHBondContact O-CA 3.38Å; L559-G562 PolarHBondContact O-N 3.43Å; G562-R564 PolarHBondContact O-N 2.91Å; G562-V565 PolarHBondContact O-N 2.91Å; G562-L566 WeakPolarHBondContact O-CB 3.06Å; G562-L566 PolarHBondContact O-N 2.92Å
563	E	65.5	Low	66.8	Low	98 Å²	98	109.4 Å²	109.4	46%	0.458	52%	0.519	S	S	.	.	H	α-helix	trans	-58.1	-48.3	176.8	-68.5	176.1	144.4	0	0	112.1	L559 V565 L566 Q567	L559-E563 PolarHBondContact O-N 3.08Å; E563-V565 VanDerWaalsContact C-N 3.26Å; E563-V565 PolarHBondContact O-N 3.49Å; E563-L566 PolarHBondContact O-N 3Å; E563-L566 VanDerWaalsContact O-N 3.15Å; E563-Q567 WeakPolarHBondContact O-CB 3.13Å; E563-Q567 PolarHBondContact O-N 2.77Å
564	R	72.8	Confident	67.1	Low	150 Å²	150	110 Å²	110	57%	0.566	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-30.2	178	-68.3	171.6	-158.6	-164.5	9.5	112.7	Q560 I561 G562 R568	Q560-R564 WeakPolarHBondContact O-CB 3.42Å; Q560-R564 WeakPolarHBondContact O-CD 3.47Å; Q560-R564 WeakPolarHBondContact O-CG 3.49Å; Q560-R564 PolarHBondContact O-N 3.06Å; Q560-R564 VanDerWaalsContact O-N 3.1Å; I561-R564 PolarHBondContact O-N 3.35Å; G562-R564 PolarHBondContact O-N 2.91Å; R564-R568 VanDerWaalsContact O-CB 3.3Å; R564-R568 WeakPolarHBondContact O-CB 3.32Å; R564-R568 WeakPolarHBondContact O-CD 3.28Å; R564-R568 WeakPolarHBondContact O-CG 3.39Å; R564-R568 PolarHBondContact O-N 3.37Å
565	V	69.6	Low	67.7	Low	83 Å²	83	107.5 Å²	107.5	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-75.4	-41.5	173.2	168.2	0	0	0	0	110.9	I561 G562 E563 R568 T569	I561-V565 WeakPolarHBondContact O-CB 3.38Å; I561-V565 VanDerWaalsContact O-CG2 3.32Å; I561-V565 WeakPolarHBondContact O-CG2 3.36Å; I561-V565 PolarHBondContact O-N 2.85Å; G562-V565 PolarHBondContact O-N 2.91Å; E563-V565 VanDerWaalsContact C-N 3.26Å; E563-V565 PolarHBondContact O-N 3.49Å; V565-R568 PolarHBondContact O-N 2.91Å; V565-T569 WeakPolarHBondContact O-CB 3.41Å; V565-T569 PolarHBondContact O-N 3.31Å; V565-T569 PolarHBondContact O-OG1 2.75Å
566	L	68	Low	68.2	Low	109 Å²	109	104.7 Å²	104.7	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-62.5	-51.8	178.1	-147.5	110.8	0	0	0	110.4	G562 E563 R568 T569 E570	G562-L566 WeakPolarHBondContact O-CB 3.06Å; G562-L566 PolarHBondContact O-N 2.92Å; E563-L566 PolarHBondContact O-N 3Å; E563-L566 VanDerWaalsContact O-N 3.15Å; L566-R568 PolarHBondContact O-N 3.46Å; L566-T569 CarbonylContact O-C 3.57Å; L566-T569 WeakPolarHBondContact O-CA 3.32Å; L566-T569 VanDerWaalsContact O-CB 3.32Å; L566-T569 WeakPolarHBondContact O-CB 3.32Å; L566-T569 PolarHBondContact O-N 2.93Å; L566-E570 PolarHBondContact O-N 3.07Å
567	Q	71.3	Confident	68.2	Low	113 Å²	113	101.7 Å²	101.7	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-35.4	-179.9	-162.7	174	24.1	0	0	112.4	E563 T569 E570 N571	E563-Q567 WeakPolarHBondContact O-CB 3.13Å; E563-Q567 PolarHBondContact O-N 2.77Å; Q567-T569 VanDerWaalsContact C-N 3.3Å; Q567-T569 PolarHBondContact O-N 3.49Å; Q567-E570 PolarHBondContact O-N 2.99Å; Q567-N571 VanDerWaalsContact O-CB 3.3Å; Q567-N571 WeakPolarHBondContact O-CB 3.28Å; Q567-N571 PolarHBondContact O-N 3.45Å; Q567-N571 PolarHBondContact O-OD1 3.21Å
568	R	70.4	Confident	68.3	Low	195 Å²	195	101.4 Å²	101.4	74%	0.736	49%	0.491	S	S	*	.	H	α-helix	trans	-64.8	-33.4	169.1	-80.2	175.2	172.1	-179.8	-2.9	112.7	R564 V565 L566 R572	R564-R568 VanDerWaalsContact O-CB 3.3Å; R564-R568 WeakPolarHBondContact O-CB 3.32Å; R564-R568 WeakPolarHBondContact O-CD 3.28Å; R564-R568 WeakPolarHBondContact O-CG 3.39Å; R564-R568 PolarHBondContact O-N 3.37Å; V565-R568 PolarHBondContact O-N 2.91Å; L566-R568 PolarHBondContact O-N 3.46Å; R568-R572 WeakPolarHBondContact O-CB 3.4Å; R568-R572 PolarHBondContact O-N 2.83Å
569	T	64.1	Low	69	Low	71 Å²	71	102.7 Å²	102.7	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-74.7	-37.4	177.8	-56.2	0	0	0	0	111.5	V565 L566 Q567 R573	V565-T569 WeakPolarHBondContact O-CB 3.41Å; V565-T569 PolarHBondContact O-N 3.31Å; V565-T569 PolarHBondContact O-OG1 2.75Å; L566-T569 CarbonylContact O-C 3.57Å; L566-T569 WeakPolarHBondContact O-CA 3.32Å; L566-T569 VanDerWaalsContact O-CB 3.32Å; L566-T569 WeakPolarHBondContact O-CB 3.32Å; L566-T569 PolarHBondContact O-N 2.93Å; Q567-T569 VanDerWaalsContact C-N 3.3Å; Q567-T569 PolarHBondContact O-N 3.49Å; T569-R573 WeakPolarHBondContact O-CB 3.06Å; T569-R573 WeakPolarHBondContact O-CG 3.24Å; T569-R573 PolarHBondContact O-N 2.89Å
570	E	72.6	Confident	69	Low	111 Å²	111	100.9 Å²	100.9	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-69.1	-48.2	173.8	-69.6	-175.4	147.5	0	0	111.8	L566 Q567 R572 R573 H574	L566-E570 PolarHBondContact O-N 3.07Å; Q567-E570 PolarHBondContact O-N 2.99Å; E570-R572 VanDerWaalsContact C-N 3.28Å; E570-R572 PolarHBondContact O-N 3.39Å; E570-R573 CarbonylContact O-C 3.6Å; E570-R573 WeakPolarHBondContact O-CB 3.37Å; E570-R573 PolarHBondContact O-N 3.2Å; E570-R573 VanDerWaalsContact O-N 3.11Å; E570-H574 PolarHBondContact O-N 3.27Å
571	N	74.8	Confident	68.5	Low	100 Å²	100	105.1 Å²	105.1	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-56.9	-43	174	-70.6	6	0	0	0	111.3	Q567 H574 E575	Q567-N571 VanDerWaalsContact O-CB 3.3Å; Q567-N571 WeakPolarHBondContact O-CB 3.28Å; Q567-N571 PolarHBondContact O-N 3.45Å; Q567-N571 PolarHBondContact O-OD1 3.21Å; N571-H574 PolarHBondContact O-N 2.97Å; N571-E575 PolarHBondContact O-N 3.01Å
572	R	69.2	Low	67.9	Low	171 Å²	171	105.4 Å²	105.4	65%	0.645	50%	0.498	S	S	*	.	H	α-helix	trans	-72.2	-29.8	178.1	-164.3	168	-173.6	154.5	2.6	113	R568 E570 L576	R568-R572 WeakPolarHBondContact O-CB 3.4Å; R568-R572 PolarHBondContact O-N 2.83Å; E570-R572 VanDerWaalsContact C-N 3.28Å; E570-R572 PolarHBondContact O-N 3.39Å; R572-L576 HydrophobicContact CG-CD1 4.45Å; R572-L576 WeakPolarHBondContact O-CB 3.06Å; R572-L576 WeakPolarHBondContact O-CD1 3.36Å; R572-L576 WeakPolarHBondContact O-CG 3.39Å; R572-L576 PolarHBondContact O-N 3.16Å
573	R	67.3	Low	66.9	Low	181 Å²	181	107.8 Å²	107.8	68%	0.683	50%	0.502	S	S	*	.	H	α-helix	trans	-64.9	-40.1	166.7	-88.3	178.1	162.5	170.2	-4.7	111.4	T569 E570 L576 A577	T569-R573 WeakPolarHBondContact O-CB 3.06Å; T569-R573 WeakPolarHBondContact O-CG 3.24Å; T569-R573 PolarHBondContact O-N 2.89Å; E570-R573 CarbonylContact O-C 3.6Å; E570-R573 WeakPolarHBondContact O-CB 3.37Å; E570-R573 PolarHBondContact O-N 3.2Å; E570-R573 VanDerWaalsContact O-N 3.11Å; R573-L576 PolarHBondContact O-N 3.3Å; R573-A577 WeakPolarHBondContact O-CB 3.39Å; R573-A577 PolarHBondContact O-N 3.5Å
574	H	69.6	Low	66.1	Low	76 Å²	76	108.2 Å²	108.2	35%	0.352	51%	0.513	S	S	.	.	H	α-helix	trans	-69.3	-44	179.2	-158	2.3	0	0	0	111.5	E570 N571 L576 A577 M578	E570-H574 PolarHBondContact O-N 3.27Å; N571-H574 PolarHBondContact O-N 2.97Å; H574-L576 VanDerWaalsContact C-N 3.31Å; H574-L576 PolarHBondContact O-N 2.91Å; H574-A577 PolarHBondContact O-N 3.29Å; H574-M578 WeakPolarHBondContact O-CB 3.22Å; H574-M578 WeakPolarHBondContact O-CG 3.41Å; H574-M578 PolarHBondContact O-N 2.86Å
575	E	71.7	Confident	64.8	Low	97 Å²	97	109.4 Å²	109.4	45%	0.453	53%	0.525	S	S	.	.	H	α-helix	trans	-53.7	-45.8	168.8	-85.6	-160	87.8	0	0	112.2	N571 K579	N571-E575 PolarHBondContact O-N 3.01Å; E575-K579 VanDerWaalsContact O-CB 3.26Å; E575-K579 WeakPolarHBondContact O-CB 3.31Å; E575-K579 WeakPolarHBondContact O-CD 3.33Å; E575-K579 VanDerWaalsContact O-CG 3.24Å; E575-K579 WeakPolarHBondContact O-CG 3.32Å; E575-K579 PolarHBondContact O-N 3.31Å; E575-K579 IonicContact OE1-NZ 2.76Å; E575-K579 PolarHBondContact OE1-NZ 2.65Å
576	L	70.2	Confident	63.9	Low	91 Å²	91	112.8 Å²	112.8	48%	0.476	54%	0.54	S	S	.	.	H	α-helix	trans	-69.5	-38.2	-179.6	-73.9	168.4	0	0	0	111.8	R572 R573 H574 K579 E580	R572-L576 HydrophobicContact CG-CD1 4.45Å; R572-L576 WeakPolarHBondContact O-CB 3.06Å; R572-L576 WeakPolarHBondContact O-CD1 3.36Å; R572-L576 WeakPolarHBondContact O-CG 3.39Å; R572-L576 PolarHBondContact O-N 3.16Å; R573-L576 PolarHBondContact O-N 3.3Å; H574-L576 VanDerWaalsContact C-N 3.31Å; H574-L576 PolarHBondContact O-N 2.91Å; L576-K579 CarbonylContact O-C 3.59Å; L576-K579 PolarHBondContact O-N 2.63Å; L576-E580 WeakPolarHBondContact O-CB 3.5Å; L576-E580 WeakPolarHBondContact O-CG 3.5Å; L576-E580 PolarHBondContact O-N 2.79Å
577	A	69.6	Low	62.7	Low	26 Å²	26	115.3 Å²	115.3	22%	0.215	55%	0.549	C	S	.	.	H	α-helix	trans	-66.4	-39.4	175.4	0	0	0	0	0	112.5	R573 H574 E580 N581 K582 L583	R573-A577 WeakPolarHBondContact O-CB 3.39Å; R573-A577 PolarHBondContact O-N 3.5Å; H574-A577 PolarHBondContact O-N 3.29Å; A577-E580 PolarHBondContact O-N 3.17Å; A577-N581 PolarHBondContact O-N 3.05Å; A577-K582 PolarHBondContact O-N 3.14Å; A577-L583 HydrophobicContact CB-CD1 4.16Å
578	M	69.5	Low	61.2	Low	86 Å²	86	117.5 Å²	117.5	42%	0.424	56%	0.559	S	S	.	*	H	α-helix	trans	-61.3	-50.3	169.6	-73	-67.6	-169.2	0	0	110.4	H574 E580 N581	H574-M578 WeakPolarHBondContact O-CB 3.22Å; H574-M578 WeakPolarHBondContact O-CG 3.41Å; H574-M578 PolarHBondContact O-N 2.86Å; M578-E580 PolarHBondContact O-N 2.7Å; M578-N581 PolarHBondContact O-N 2.88Å; M578-N581 VanDerWaalsContact O-N 3.1Å
579	K	73.3	Confident	59.7	Low	113 Å²	113	112.1 Å²	112.1	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-67.1	-14.7	178.8	-73.2	164.9	178.3	166.7	0	114	R36 E575 L576	R36-K579 PolarHBondContact NH1-O 3.28Å; R36-K579 PolarHBondContact NH2-O 3.23Å; E575-K579 VanDerWaalsContact O-CB 3.26Å; E575-K579 WeakPolarHBondContact O-CB 3.31Å; E575-K579 WeakPolarHBondContact O-CD 3.33Å; E575-K579 VanDerWaalsContact O-CG 3.24Å; E575-K579 WeakPolarHBondContact O-CG 3.32Å; E575-K579 PolarHBondContact O-N 3.31Å; E575-K579 IonicContact OE1-NZ 2.76Å; E575-K579 PolarHBondContact OE1-NZ 2.65Å; L576-K579 CarbonylContact O-C 3.59Å; L576-K579 PolarHBondContact O-N 2.63Å
580	E	64.6	Low	58.6	Low	49 Å²	49	113.1 Å²	113.1	23%	0.229	55%	0.55	C	S	.	*	T	Hydrogen-bonded Turn	trans	-96.5	2.7	174	-80.7	-168.4	-141	0	0	113.7	N34 L576 A577 M578 K582	N34-E580 VanDerWaalsContact ND2-CD 3.33Å; N34-E580 PolarHBondContact ND2-OE1 2.96Å; N34-E580 PolarHBondContact ND2-OE2 2.92Å; L576-E580 WeakPolarHBondContact O-CB 3.5Å; L576-E580 WeakPolarHBondContact O-CG 3.5Å; L576-E580 PolarHBondContact O-N 2.79Å; A577-E580 PolarHBondContact O-N 3.17Å; M578-E580 PolarHBondContact O-N 2.7Å; E580-K582 HydrophobicContact CB-CD 4.13Å; E580-K582 HydrophobicContact CB-CG 4.27Å; E580-K582 PolarHBondContact O-N 2.75Å; E580-K582 WeakPolarHBondContact OE2-CD 3.41Å; E580-K582 WeakPolarHBondContact OE2-CE 3.36Å; E580-K582 IonicContact OE2-NZ 3.83Å; E580-K582 PolarHBondContact OE2-NZ 3.17Å
581	N	53.5	Low	57.1	Low	148 Å²	148	116.9 Å²	116.9	79%	0.791	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.8	34.3	-175.6	-66.9	12.4	0	0	0	113.9	A577 M578	A577-N581 PolarHBondContact O-N 3.05Å; M578-N581 PolarHBondContact O-N 2.88Å; M578-N581 VanDerWaalsContact O-N 3.1Å
582	K	54.9	Low	55.5	Low	110 Å²	110	116.6 Å²	116.6	48%	0.478	57%	0.567	S	S	.	*			trans	-99.8	3.4	-173.3	-83.9	178.1	178.1	166.6	0	115.7	N34 A577 E580	N34-K582 VanDerWaalsContact CG-NZ 3.3Å; N34-K582 PolarHBondContact OD1-NZ 3.03Å; A577-K582 PolarHBondContact O-N 3.14Å; E580-K582 HydrophobicContact CB-CD 4.13Å; E580-K582 HydrophobicContact CB-CG 4.27Å; E580-K582 PolarHBondContact O-N 2.75Å; E580-K582 WeakPolarHBondContact OE2-CD 3.41Å; E580-K582 WeakPolarHBondContact OE2-CE 3.36Å; E580-K582 IonicContact OE2-NZ 3.83Å; E580-K582 PolarHBondContact OE2-NZ 3.17Å
583	L	42.9	Very low	54.1	Low	85 Å²	85	112.3 Å²	112.3	45%	0.445	56%	0.559	S	S	.	*	S	Bend	trans	-140.1	138.6	176.8	-82.3	165.6	0	0	0	110.2	A577	A577-L583 HydrophobicContact CB-CD1 4.16Å
584	P	48.1	Very low	52.8	Low	108 Å²	108	108.8 Å²	108.8	70%	0.701	55%	0.554	S	S	*	*			trans	-67.3	148.3	166.5	-16.4	31.1	0	0	0	111.3	N586	P584-N586 PolarHBondContact O-N 3.28Å; P584-N586 VanDerWaalsContact O-N 3.08Å
585	E	46.4	Very low	51.5	Low	175 Å²	175	114 Å²	114	82%	0.818	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-11.9	-166.5	-65.6	177	116.3	0	0	115.8
586	N	50.5	Low	50.1	Low	154 Å²	154	113.8 Å²	113.8	82%	0.824	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	15.6	-166.2	-73.6	-21.1	0	0	0	116.6	P584 H588	P584-N586 PolarHBondContact O-N 3.28Å; P584-N586 VanDerWaalsContact O-N 3.08Å; N586-H588 PolarHBondContact O-N 3.06Å
587	H	42.8	Very low	48.9	Very low	161 Å²	161	111.9 Å²	111.9	75%	0.745	57%	0.566	S	S	*	*			trans	-93.6	84.9	-176.6	-133.4	-49.9	0	0	0	113.9
588	H	38.6	Very low	48.1	Very low	159 Å²	159	116.4 Å²	116.4	74%	0.736	59%	0.586	S	S	*	*			trans	-53.8	137.4	177.9	-105.6	-100.5	0	0	0	114.3	N586 D590	N586-H588 PolarHBondContact O-N 3.06Å; H588-D590 IonicContact CE1-OD2 3.61Å; H588-D590 IonicContact CG-OD2 3.27Å; H588-D590 IonicContact ND1-OD2 3.11Å; H588-D590 PolarHBondContact ND1-OD2 2.77Å
589	V	39.5	Very low	46.9	Very low	83 Å²	83	118.6 Å²	118.6	50%	0.503	60%	0.596	S	S	.	*			trans	-103	26.2	-168.8	-165.3	0	0	0	0	113.1
590	D	41.4	Very low	45.7	Very low	92 Å²	92	116.6 Å²	116.6	49%	0.492	59%	0.59	S	S	.	*	H	α-helix	trans	-81.4	-18.5	-172.4	-64.4	-74.5	0	0	0	115.6	H588 N594	H588-D590 IonicContact CE1-OD2 3.61Å; H588-D590 IonicContact CG-OD2 3.27Å; H588-D590 IonicContact ND1-OD2 3.11Å; H588-D590 PolarHBondContact ND1-OD2 2.77Å; D590-N594 PolarHBondContact O-ND2 3.44Å
591	K	41.2	Very low	45.3	Very low	190 Å²	190	121 Å²	121	83%	0.826	61%	0.608	S	S	*	*	H	α-helix	trans	-89.2	-13.1	-171.6	-77.5	-176.9	176.2	174.9	0	116
592	V	40.4	Very low	45.6	Very low	94 Å²	94	117.4 Å²	117.4	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-96.8	-47.7	179.7	-177.2	0	0	0	0	111.4	N594 R595 N596	V592-N594 VanDerWaalsContact C-N 3.27Å; V592-N594 PolarHBondContact O-N 3.06Å; V592-R595 PolarHBondContact O-N 2.93Å; V592-R595 VanDerWaalsContact O-N 3.14Å; V592-N596 PolarHBondContact O-N 2.87Å
593	V	39.9	Very low	45.7	Very low	80 Å²	80	118.3 Å²	118.3	49%	0.485	60%	0.597	S	S	.	*	H	α-helix	trans	-57.5	-39.8	-179	-177.2	0	0	0	0	111.9	S597	V593-S597 VanDerWaalsContact O-CB 3.25Å; V593-S597 WeakPolarHBondContact O-CB 3.49Å; V593-S597 PolarHBondContact O-N 3.36Å; V593-S597 PolarHBondContact O-OG 2.77Å
594	N	40.4	Very low	46.2	Very low	107 Å²	107	119.2 Å²	119.2	57%	0.572	60%	0.599	S	S	*	*	H	α-helix	trans	-66.8	-35.5	178.8	-85.3	-59.8	0	0	0	113.8	D590 V592 L598	D590-N594 PolarHBondContact O-ND2 3.44Å; V592-N594 VanDerWaalsContact C-N 3.27Å; V592-N594 PolarHBondContact O-N 3.06Å; N594-L598 WeakPolarHBondContact O-CB 3.31Å; N594-L598 PolarHBondContact O-N 3.2Å
595	R	41.3	Very low	46.8	Very low	187 Å²	187	121.1 Å²	121.1	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-50.6	178.9	-97.8	-177.1	170.2	155.5	-1.8	111.6	V592 S597 L598 E599	V592-R595 PolarHBondContact O-N 2.93Å; V592-R595 VanDerWaalsContact O-N 3.14Å; R595-S597 VanDerWaalsContact C-N 3.29Å; R595-S597 PolarHBondContact O-N 2.85Å; R595-L598 PolarHBondContact O-N 2.96Å; R595-L598 VanDerWaalsContact O-N 3.12Å; R595-E599 PolarHBondContact O-N 2.82Å
596	N	43.8	Very low	47.3	Very low	91 Å²	91	116.6 Å²	116.6	49%	0.487	58%	0.578	S	S	.	*	H	α-helix	trans	-61.1	-41.8	177.9	-65	8.5	0	0	0	110.6	V592 L598 E599 I600	V592-N596 PolarHBondContact O-N 2.87Å; N596-L598 VanDerWaalsContact C-N 3.3Å; N596-L598 PolarHBondContact O-N 2.7Å; N596-E599 PolarHBondContact O-N 2.73Å; N596-I600 WeakPolarHBondContact O-CB 3.27Å; N596-I600 WeakPolarHBondContact O-CD1 3.44Å; N596-I600 WeakPolarHBondContact O-CG1 3.33Å; N596-I600 PolarHBondContact O-N 3.09Å
597	S	45.1	Very low	47.2	Very low	51 Å²	51	114.6 Å²	114.6	36%	0.357	57%	0.567	S	S	.	*	H	α-helix	trans	-62.7	-32.9	176.8	-65.5	0	0	0	0	113.5	V593 R595 K601	V593-S597 VanDerWaalsContact O-CB 3.25Å; V593-S597 WeakPolarHBondContact O-CB 3.49Å; V593-S597 PolarHBondContact O-N 3.36Å; V593-S597 PolarHBondContact O-OG 2.77Å; R595-S597 VanDerWaalsContact C-N 3.29Å; R595-S597 PolarHBondContact O-N 2.85Å; S597-K601 WeakPolarHBondContact O-CB 3.17Å; S597-K601 VanDerWaalsContact O-CG 3.29Å; S597-K601 WeakPolarHBondContact O-CG 3.37Å; S597-K601 PolarHBondContact O-N 3.08Å; S597-K601 VanDerWaalsContact O-N 3.1Å
598	L	51.2	Low	47.4	Very low	121 Å²	121	109.5 Å²	109.5	63%	0.634	55%	0.549	S	S	*	.	H	α-helix	trans	-77.5	-40.6	177.7	-158.4	75.6	0	0	0	112	N594 R595 N596 T602	N594-L598 WeakPolarHBondContact O-CB 3.31Å; N594-L598 PolarHBondContact O-N 3.2Å; R595-L598 PolarHBondContact O-N 2.96Å; R595-L598 VanDerWaalsContact O-N 3.12Å; N596-L598 VanDerWaalsContact C-N 3.3Å; N596-L598 PolarHBondContact O-N 2.7Å; L598-T602 WeakPolarHBondContact O-CB 3.18Å; L598-T602 PolarHBondContact O-N 2.95Å; L598-T602 PolarHBondContact O-OG1 3.03Å
599	E	45.5	Very low	48.1	Very low	132 Å²	132	108.7 Å²	108.7	62%	0.617	54%	0.543	S	S	*	.	H	α-helix	trans	-65.8	-41.7	174.8	-69.8	-173.1	168.8	0	0	111.6	R595 N596 T602 H603	R595-E599 PolarHBondContact O-N 2.82Å; N596-E599 PolarHBondContact O-N 2.73Å; E599-T602 WeakPolarHBondContact O-CB 3.35Å; E599-T602 PolarHBondContact O-N 2.8Å; E599-H603 PolarHBondContact O-CD2 2.76Å; E599-H603 PolarHBondContact O-N 3.07Å
600	I	48.5	Very low	48.3	Very low	72 Å²	72	110.1 Å²	110.1	37%	0.369	55%	0.548	S	S	.	.	H	α-helix	trans	-63.2	-49.8	175.1	-67.1	168	0	0	0	110.8	N596 T602 H603 E604	N596-I600 WeakPolarHBondContact O-CB 3.27Å; N596-I600 WeakPolarHBondContact O-CD1 3.44Å; N596-I600 WeakPolarHBondContact O-CG1 3.33Å; N596-I600 PolarHBondContact O-N 3.09Å; I600-T602 PolarHBondContact O-N 3.44Å; I600-H603 CarbonylContact O-C 3.5Å; I600-H603 WeakPolarHBondContact O-CA 3.18Å; I600-H603 PolarHBondContact O-N 2.81Å; I600-E604 HydrophobicContact CG2-CG 4.44Å; I600-E604 PolarHBondContact O-N 3.2Å
601	K	54.9	Low	48.2	Very low	140 Å²	140	109 Å²	109	61%	0.609	54%	0.544	S	S	*	.	H	α-helix	trans	-58.8	-32.2	174.8	-78.8	177.5	177.5	178.6	0	112.8	S597 K605	S597-K601 WeakPolarHBondContact O-CB 3.17Å; S597-K601 VanDerWaalsContact O-CG 3.29Å; S597-K601 WeakPolarHBondContact O-CG 3.37Å; S597-K601 PolarHBondContact O-N 3.08Å; S597-K601 VanDerWaalsContact O-N 3.1Å; K601-K605 VanDerWaalsContact O-CB 3.24Å; K601-K605 WeakPolarHBondContact O-CB 3.2Å; K601-K605 PolarHBondContact O-N 2.9Å
602	T	61.2	Low	48.4	Very low	73 Å²	73	104.2 Å²	104.2	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-70.9	-40.9	174.8	-56.3	0	0	0	0	111.2	L598 E599 I600 K605 N606	L598-T602 WeakPolarHBondContact O-CB 3.18Å; L598-T602 PolarHBondContact O-N 2.95Å; L598-T602 PolarHBondContact O-OG1 3.03Å; E599-T602 WeakPolarHBondContact O-CB 3.35Å; E599-T602 PolarHBondContact O-N 2.8Å; I600-T602 PolarHBondContact O-N 3.44Å; T602-K605 PolarHBondContact O-N 3.46Å; T602-N606 WeakPolarHBondContact O-CB 3.47Å; T602-N606 VanDerWaalsContact O-CG 3.26Å; T602-N606 PolarHBondContact O-N 3.45Å; T602-N606 PolarHBondContact O-ND2 3.3Å
603	H	56.4	Low	48.5	Very low	129 Å²	129	107.3 Å²	107.3	60%	0.597	53%	0.53	S	S	*	.	H	α-helix	trans	-65	-41.7	172.9	-92.3	-79.6	0	0	0	113	E599 I600 N606 L607	E599-H603 PolarHBondContact O-CD2 2.76Å; E599-H603 PolarHBondContact O-N 3.07Å; I600-H603 CarbonylContact O-C 3.5Å; I600-H603 WeakPolarHBondContact O-CA 3.18Å; I600-H603 PolarHBondContact O-N 2.81Å; H603-N606 PolarHBondContact O-N 2.86Å; H603-L607 WeakPolarHBondContact O-CB 3.48Å; H603-L607 PolarHBondContact O-N 3.35Å
604	E	54	Low	48.5	Very low	104 Å²	104	109.8 Å²	109.8	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-62.4	-41.4	173.2	-70.1	-174.5	131.3	0	0	111.9	I600 N606 L607 S608	I600-E604 HydrophobicContact CG2-CG 4.44Å; I600-E604 PolarHBondContact O-N 3.2Å; E604-N606 VanDerWaalsContact C-N 3.28Å; E604-N606 PolarHBondContact O-N 3.39Å; E604-L607 PolarHBondContact O-N 2.96Å; E604-S608 WeakPolarHBondContact O-CB 3.4Å; E604-S608 PolarHBondContact O-N 3.14Å; E604-S608 PolarHBondContact O-OG 2.94Å
605	K	60.3	Low	48.5	Very low	148 Å²	148	110.3 Å²	110.3	64%	0.643	54%	0.536	S	S	*	.	H	α-helix	trans	-69.6	-24.1	177.2	-158.1	167.1	-171.7	176.6	0	113	K601 T602 S608 K609	K601-K605 VanDerWaalsContact O-CB 3.24Å; K601-K605 WeakPolarHBondContact O-CB 3.2Å; K601-K605 PolarHBondContact O-N 2.9Å; T602-K605 PolarHBondContact O-N 3.46Å; K605-S608 WeakPolarHBondContact CA-OG 3.39Å; K605-S608 PolarHBondContact O-OG 3.19Å; K605-K609 WeakPolarHBondContact O-CG 3.43Å; K605-K609 PolarHBondContact O-N 3.07Å
606	N	57.1	Low	48.6	Very low	81 Å²	81	105.7 Å²	105.7	43%	0.433	53%	0.525	S	S	.	.	H	α-helix	trans	-84.5	-36.5	172.1	-71.9	-21	0	0	0	112.5	T602 H603 E604 K609 L610	T602-N606 WeakPolarHBondContact O-CB 3.47Å; T602-N606 VanDerWaalsContact O-CG 3.26Å; T602-N606 PolarHBondContact O-N 3.45Å; T602-N606 PolarHBondContact O-ND2 3.3Å; H603-N606 PolarHBondContact O-N 2.86Å; E604-N606 VanDerWaalsContact C-N 3.28Å; E604-N606 PolarHBondContact O-N 3.39Å; N606-K609 PolarHBondContact O-N 3.25Å; N606-L610 PolarHBondContact O-N 3.41Å
607	L	48.7	Very low	48.5	Very low	112 Å²	112	107.6 Å²	107.6	59%	0.586	53%	0.529	S	S	*	.	H	α-helix	trans	-65.5	-44.6	173.7	-91.6	158.9	0	0	0	111.9	H603 E604 L610 T611	H603-L607 WeakPolarHBondContact O-CB 3.48Å; H603-L607 PolarHBondContact O-N 3.35Å; E604-L607 PolarHBondContact O-N 2.96Å; L607-L610 CarbonylContact O-C 3.49Å; L607-L610 WeakPolarHBondContact O-CA 3.41Å; L607-L610 WeakPolarHBondContact O-CB 3.45Å; L607-L610 PolarHBondContact O-N 3.46Å; L607-T611 PolarHBondContact O-N 3.28Å; L607-T611 PolarHBondContact O-OG1 2.72Å
608	S	46.6	Very low	48.3	Very low	54 Å²	54	109.9 Å²	109.9	38%	0.378	54%	0.541	S	S	.	.	H	α-helix	trans	-64.3	-37.2	174.8	47.2	0	0	0	0	112.6	E604 K605 L610 T611 N612	E604-S608 WeakPolarHBondContact O-CB 3.4Å; E604-S608 PolarHBondContact O-N 3.14Å; E604-S608 PolarHBondContact O-OG 2.94Å; K605-S608 WeakPolarHBondContact CA-OG 3.39Å; K605-S608 PolarHBondContact O-OG 3.19Å; S608-L610 VanDerWaalsContact C-N 3.33Å; S608-L610 PolarHBondContact O-N 2.89Å; S608-T611 WeakPolarHBondContact CA-OG1 3.48Å; S608-T611 PolarHBondContact O-N 3.03Å; S608-T611 PolarHBondContact O-OG1 3.38Å; S608-N612 WeakPolarHBondContact O-CB 3.35Å; S608-N612 VanDerWaalsContact O-CG 3.3Å; S608-N612 PolarHBondContact O-N 3.19Å; S608-N612 PolarHBondContact O-OD1 2.99Å
609	K	52.4	Low	47.7	Very low	141 Å²	141	110.6 Å²	110.6	61%	0.613	54%	0.54	S	S	*	.	H	α-helix	trans	-59.4	-42.2	167.4	-82.7	-179.2	172.6	-169.5	0	112.2	K605 N606 Y613	K605-K609 WeakPolarHBondContact O-CG 3.43Å; K605-K609 PolarHBondContact O-N 3.07Å; N606-K609 PolarHBondContact O-N 3.25Å; K609-Y613 WeakPolarHBondContact O-CB 3.43Å; K609-Y613 PolarHBondContact O-N 3.23Å
610	L	43.9	Very low	47.6	Very low	113 Å²	113	110.5 Å²	110.5	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-67.4	-40.1	178.4	-114.1	78.9	0	0	0	113.1	N606 L607 S608 Q614	N606-L610 PolarHBondContact O-N 3.41Å; L607-L610 CarbonylContact O-C 3.49Å; L607-L610 WeakPolarHBondContact O-CA 3.41Å; L607-L610 WeakPolarHBondContact O-CB 3.45Å; L607-L610 PolarHBondContact O-N 3.46Å; S608-L610 VanDerWaalsContact C-N 3.33Å; S608-L610 PolarHBondContact O-N 2.89Å; L610-Q614 WeakPolarHBondContact O-CG 3.17Å; L610-Q614 PolarHBondContact O-N 3.17Å; L610-Q614 VanDerWaalsContact O-N 3.13Å
611	T	40.5	Very low	47.1	Very low	68 Å²	68	113.8 Å²	113.8	42%	0.417	56%	0.562	S	S	.	*	H	α-helix	trans	-66.5	-46.6	177.5	50.3	0	0	0	0	111	L607 S608 Y613 Q614 E615	L607-T611 PolarHBondContact O-N 3.28Å; L607-T611 PolarHBondContact O-OG1 2.72Å; S608-T611 WeakPolarHBondContact CA-OG1 3.48Å; S608-T611 PolarHBondContact O-N 3.03Å; S608-T611 PolarHBondContact O-OG1 3.38Å; T611-Y613 VanDerWaalsContact C-N 3.33Å; T611-Y613 PolarHBondContact O-N 3.24Å; T611-Q614 PolarHBondContact O-N 3.41Å; T611-E615 PolarHBondContact O-N 2.93Å
612	N	45.2	Very low	46.3	Very low	91 Å²	91	112 Å²	112	49%	0.487	56%	0.559	S	S	.	*	H	α-helix	trans	-61.1	-43.1	178	-68.6	31.9	0	0	0	110.9	S608 Q614 E615 D616	S608-N612 WeakPolarHBondContact O-CB 3.35Å; S608-N612 VanDerWaalsContact O-CG 3.3Å; S608-N612 PolarHBondContact O-N 3.19Å; S608-N612 PolarHBondContact O-OD1 2.99Å; N612-Q614 PolarHBondContact O-N 3.42Å; N612-E615 PolarHBondContact O-N 3.4Å; N612-E615 VanDerWaalsContact O-N 3.1Å; N612-D616 WeakPolarHBondContact O-CB 3.21Å; N612-D616 PolarHBondContact O-N 2.86Å
613	Y	40.8	Very low	45	Very low	159 Å²	159	115.1 Å²	115.1	62%	0.624	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-17	177.1	-152.2	-104.8	0	0	0	114.2	K609 T611	K609-Y613 WeakPolarHBondContact O-CB 3.43Å; K609-Y613 PolarHBondContact O-N 3.23Å; T611-Y613 VanDerWaalsContact C-N 3.33Å; T611-Y613 PolarHBondContact O-N 3.24Å
614	Q	41.1	Very low	43.9	Very low	132 Å²	132	116.6 Å²	116.6	62%	0.617	59%	0.585	S	S	*	*	H	α-helix	trans	-85.8	-40.2	167.8	-74.6	-170.5	-13.7	0	0	112	L610 T611 N612 K617 V618	L610-Q614 WeakPolarHBondContact O-CG 3.17Å; L610-Q614 PolarHBondContact O-N 3.17Å; L610-Q614 VanDerWaalsContact O-N 3.13Å; T611-Q614 PolarHBondContact O-N 3.41Å; N612-Q614 PolarHBondContact O-N 3.42Å; Q614-K617 PolarHBondContact O-N 2.87Å; Q614-V618 VanDerWaalsContact O-CG2 3.31Å; Q614-V618 WeakPolarHBondContact O-CG2 3.44Å; Q614-V618 PolarHBondContact O-N 2.94Å
615	E	40.6	Very low	42.7	Very low	118 Å²	118	117.4 Å²	117.4	55%	0.551	60%	0.6	S	S	*	*	H	α-helix	trans	-66	-43	176.6	-69.4	-171.6	154.4	0	0	111.9	T611 N612 K617 V618 Q619	T611-E615 PolarHBondContact O-N 2.93Å; N612-E615 PolarHBondContact O-N 3.4Å; N612-E615 VanDerWaalsContact O-N 3.1Å; E615-K617 VanDerWaalsContact C-N 3.27Å; E615-K617 PolarHBondContact O-N 3.03Å; E615-V618 CarbonylContact O-C 3.6Å; E615-V618 PolarHBondContact O-N 2.75Å; E615-Q619 WeakPolarHBondContact O-CG 3.32Å; E615-Q619 PolarHBondContact O-N 3.4Å
616	D	42.9	Very low	41.5	Very low	90 Å²	90	116.3 Å²	116.3	48%	0.481	61%	0.606	S	S	.	*	H	α-helix	trans	-59.5	-36.8	174.9	-70.3	-32.6	0	0	0	112.1	N612 N620	N612-D616 WeakPolarHBondContact O-CB 3.21Å; N612-D616 PolarHBondContact O-N 2.86Å; D616-N620 WeakPolarHBondContact O-CB 3.4Å; D616-N620 PolarHBondContact O-N 2.86Å; D616-N620 VanDerWaalsContact O-N 3.16Å; D616-N620 PolarHBondContact O-ND2 3.19Å
617	K	42.4	Very low	40.2	Very low	131 Å²	131	121.4 Å²	121.4	57%	0.57	62%	0.624	S	S	*	*	H	α-helix	trans	-74.5	-32.5	173.8	-80.6	-166.7	172.5	-169.5	0	113.3	Q614 E615 L621	Q614-K617 PolarHBondContact O-N 2.87Å; E615-K617 VanDerWaalsContact C-N 3.27Å; E615-K617 PolarHBondContact O-N 3.03Å; K617-L621 WeakPolarHBondContact O-CD1 3.36Å; K617-L621 WeakPolarHBondContact O-CG 3.42Å; K617-L621 PolarHBondContact O-N 3.48Å
618	V	39.5	Very low	39.2	Very low	99 Å²	99	124.3 Å²	124.3	60%	0.6	64%	0.639	S	S	*	*	H	α-helix	trans	-74.4	-34.1	176	168.7	0	0	0	0	111.6	Q614 E615	Q614-V618 VanDerWaalsContact O-CG2 3.31Å; Q614-V618 WeakPolarHBondContact O-CG2 3.44Å; Q614-V618 PolarHBondContact O-N 2.94Å; E615-V618 CarbonylContact O-C 3.6Å; E615-V618 PolarHBondContact O-N 2.75Å
619	Q	39	Very low	38.3	Very low	135 Å²	135	127.3 Å²	127.3	63%	0.631	66%	0.655	S	S	*	*	H	α-helix	trans	-72.9	-43.5	176.4	-68.2	-169	28.9	0	0	112.2	E615 L621 N622	E615-Q619 WeakPolarHBondContact O-CG 3.32Å; E615-Q619 PolarHBondContact O-N 3.4Å; Q619-L621 PolarHBondContact O-N 3.12Å; Q619-N622 PolarHBondContact O-N 3.48Å
620	N	43.4	Very low	36.9	Very low	130 Å²	130	129.3 Å²	129.3	70%	0.695	67%	0.669	S	S	*	*	H	α-helix	trans	-65.9	-16.9	176.5	-80.7	-71.2	0	0	0	114.2	D616 N622	D616-N620 WeakPolarHBondContact O-CB 3.4Å; D616-N620 PolarHBondContact O-N 2.86Å; D616-N620 VanDerWaalsContact O-N 3.16Å; D616-N620 PolarHBondContact O-ND2 3.19Å; N620-N622 VanDerWaalsContact C-N 3.3Å; N620-N622 PolarHBondContact O-N 2.84Å
621	L	37.2	Very low	36.1	Very low	141 Å²	141	129 Å²	129	74%	0.738	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	2.5	179.4	-87.9	170.3	0	0	0	115.5	K617 Q619	K617-L621 WeakPolarHBondContact O-CD1 3.36Å; K617-L621 WeakPolarHBondContact O-CG 3.42Å; K617-L621 PolarHBondContact O-N 3.48Å; Q619-L621 PolarHBondContact O-N 3.12Å
622	N	38.1	Very low	35.5	Very low	103 Å²	103	131.3 Å²	131.3	55%	0.551	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-10.3	178.1	-79.3	-44.2	0	0	0	115.1	R538 Q619 N620	R538-N622 PolarHBondContact NH2-OD1 2.97Å; Q619-N622 PolarHBondContact O-N 3.48Å; N620-N622 VanDerWaalsContact C-N 3.3Å; N620-N622 PolarHBondContact O-N 2.84Å
623	N	34.8	Very low	34.5	Very low	138 Å²	138	135.9 Å²	135.9	74%	0.738	70%	0.702	S	S	*	*	S	Bend	trans	-110.5	65.4	-173	-70.2	-9.5	0	0	0	113.6
624	N	32.4	Very low	33.7	Very low	160 Å²	160	133.5 Å²	133.5	86%	0.856	70%	0.704	S	S	*	*			trans	164.7	119.9	148.6	-91	-31.5	0	0	0	111.6
625	P	30.6	Very low	33	Very low	122 Å²	122	133 Å²	133	79%	0.792	71%	0.711	S	S	*	*			trans	-120.6	78	-179.5	39.2	-27.1	0	0	0	113.9
626	T	34.5	Very low	32.4	Very low	125 Å²	125	133.3 Å²	133.3	77%	0.767	72%	0.72	S	S	*	*			trans	-151.9	137.2	169.2	-38.8	0	0	0	0	114
627	K	29.9	Very low	31.9	Very low	187 Å²	187	136 Å²	136	81%	0.813	73%	0.733	S	S	*	*			trans	17.2	121.8	161	-62.6	171.2	178.3	176.9	0	118.9
628	L	27.3	Very low	31.4	Very low	173 Å²	173	135.7 Å²	135.7	91%	0.906	74%	0.738	S	S	*	*				-171.5	173.1	106.2	-101.6	162.1	0	0	0	112.5
629	T	28.3	Very low	31.1	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	74%	0.739	S	S	*	*			trans	-110	148.8	-166.2	44.6	0	0	0	0	114.1
630	M	23.2	Very low	30.9	Very low	183 Å²	183	136.4 Å²	136.4	90%	0.901	74%	0.743	S	S	*	*			trans	15.9	105.9	153.3	-71.7	-73.8	-73.7	0	0	118.4
631	S	26.1	Very low	30.4	Very low	106 Å²	106	137 Å²	137	74%	0.741	75%	0.746	S	S	*	*			trans	-177.3	144.3	136.4	37.9	0	0	0	0	115
632	T	27.8	Very low	30.3	Very low	116 Å²	116	134.1 Å²	134.1	71%	0.712	74%	0.743	S	S	*	*			trans	43.6	120.5	144	57.4	0	0	0	0	124.6
633	Y	24.8	Very low	30.2	Very low	187 Å²	187	137 Å²	137	73%	0.733	75%	0.753	S	S	*	*				63.4	108.9	126.2	-71.6	-69.6	0	0	0	124.2
634	T	24.4	Very low	30.1	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	75%	0.749	S	S	*	*				53.3	135.5	126.6	52.3	0	0	0	0	124.8
635	T	25.9	Very low	30	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	74%	0.739	S	S	*	*			trans	63.4	128.8	143.9	49.6	0	0	0	0	121.2
636	T	28.2	Very low	30.2	Very low	123 Å²	123	137 Å²	137	76%	0.755	74%	0.736	S	S	*	*				179.3	168.2	108.7	26.7	0	0	0	0	111.2
637	I	31.5	Very low	30.2	Very low	147 Å²	147	139 Å²	139	75%	0.754	74%	0.741	S	S	*	*			trans	67.8	127.1	153.3	-73.3	154.6	0	0	0	115.4
638	D	32.3	Very low	30.2	Very low	124 Å²	124	133.1 Å²	133.1	66%	0.663	73%	0.734	S	S	*	*			cis	-167.6	172.7	11.1	-122.1	20.7	0	0	0	110
639	N	33.4	Very low	30.7	Very low	117 Å²	117	130.5 Å²	130.5	63%	0.626	73%	0.727	S	S	*	*			cis	-159.3	-153.5	-11.7	-152	-38.6	0	0	0	108.8
640	N	34.9	Very low	30.9	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	73%	0.732	S	S	*	*			trans	79.2	85.1	164.1	-63.3	13.2	0	0	0	118.2
641	D	33.4	Very low	31.3	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	73%	0.727	S	S	*	*			trans	58.9	119.4	131.2	-55.9	-34	0	0	0	120.7
642	A	35.1	Very low	31.5	Very low	81 Å²	81	129.8 Å²	129.8	67%	0.669	73%	0.732	S	S	*	*				73.5	134.6	63.3	0	0	0	0	0	113.2
643	Q	36	Very low	31.6	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.762	74%	0.741	S	S	*	*			cis	-154.9	-171.5	-0.9	-113.8	-179.8	111.7	0	0	107.4
644	I	32.5	Very low	31.7	Very low	127 Å²	127	128.9 Å²	128.9	65%	0.651	74%	0.737	S	S	*	*			cis	-155.7	141.1	8.5	-127.6	153.1	0	0	0	105.5
645	N	30.9	Very low	32	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	75%	0.745	S	S	*	*				49	151.1	90	-78	-40.8	0	0	0	116.4
646	K	34.5	Very low	32.1	Very low	168 Å²	168	136.2 Å²	136.2	73%	0.73	75%	0.752	S	S	*	*			cis	-168.8	163	9.2	-129	172.7	-176	179.1	0	111.3
647	I	33.4	Very low	32.1	Very low	168 Å²	168	139.1 Å²	139.1	86%	0.862	76%	0.756	S	S	*	*			trans	69.5	148.4	156.9	-58.3	155.5	0	0	0	116.4
648	G	31.4	Very low	32	Very low	64 Å²	64	137.4 Å²	137.4	66%	0.66	76%	0.758	S	S	*	*			cis	-179	165	-7.7	0	0	0	0	0	112.4
649	P	37.2	Very low	31.8	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	76%	0.755	S	S	*	*			trans	-127.2	163.8	-159.3	41.9	-28.9	0	0	0	118
650	H	33.2	Very low	31.4	Very low	178 Å²	178	139.4 Å²	139.4	82%	0.824	77%	0.766	S	S	*	*			trans	-159.4	109.3	157.6	-98.7	-71.4	0	0	0	110.8
651	T	30.5	Very low	31.1	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	77%	0.769	S	S	*	*				65.5	109.8	99.7	60	0	0	0	0	117.5
652	G	30.7	Very low	30.8	Very low	83 Å²	83	138.6 Å²	138.6	86%	0.856	77%	0.765	S	S	*	*			trans	-177.9	124.4	171.4	0	0	0	0	0	114
653	E	29.3	Very low	30.6	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	77%	0.771	S	S	*	*			trans	-69.7	162.5	-175.4	-77.3	175	-171.1	0	0	115.8
654	S	28	Very low	30.3	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	77%	0.769	S	S	*	*			cis	-163.2	178.6	-10.6	56.7	0	0	0	0	112.2
655	K	30.2	Very low	30.1	Very low	192 Å²	192	140.2 Å²	140.2	84%	0.835	77%	0.771	S	S	*	*			trans	72.4	68.6	161.4	-66.8	174.5	-176.9	171.1	0	119.3
656	Q	26.9	Very low	30.1	Very low	195 Å²	195	142.7 Å²	142.7	91%	0.911	78%	0.776	S	S	*	*			trans	47.5	77.5	137	-67	-174.1	-12.3	0	0	118.5
657	H	29.7	Very low	30	Very low	183 Å²	183	142.2 Å²	142.2	85%	0.847	78%	0.78	S	S	*	*			trans	-108.7	173.8	140.6	-119.3	-96.5	0	0	0	109.1
658	S	28.4	Very low	29.7	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	77%	0.773	S	S	*	*			trans	75	173.5	175.9	85.6	0	0	0	0	116.8
659	S	27.3	Very low	29.4	Very low	85 Å²	85	143 Å²	143	59%	0.594	78%	0.778	S	S	*	*				179.6	156.4	-79.5	57.4	0	0	0	0	112.1
660	K	26.9	Very low	29	Very low	198 Å²	198	144 Å²	144	86%	0.861	77%	0.772	S	S	*	*			trans	65.1	-175.8	165.7	-63	-179.4	172.9	-178.5	0	115.2
661	L	26.7	Very low	28.8	Very low	147 Å²	147	142.6 Å²	142.6	77%	0.77	76%	0.764	S	S	*	*			trans	74.5	94.3	173.6	-64.4	144.3	0	0	0	112.6
662	T	28.6	Very low	28.7	Very low	111 Å²	111	145.8 Å²	145.8	68%	0.681	77%	0.767	S	S	*	*				90.7	154.2	91.6	54.4	0	0	0	0	110.3
663	D	30.7	Very low	28.5	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	76%	0.759	S	S	*	*			cis	-138.7	172.4	31.8	-98	-70.3	0	0	0	116.9
664	Q	28.3	Very low	28.5	Very low	157 Å²	157	147.3 Å²	147.3	73%	0.734	76%	0.761	S	S	*	*			trans	-105.7	176.4	165.4	-59.3	-178.1	-91.6	0	0	110.1
665	S	30.2	Very low	28.6	Very low	99 Å²	99	150.3 Å²	150.3	69%	0.692	77%	0.765	S	S	*	*			trans	85.8	173.2	166.5	85.9	0	0	0	0	117.8
666	F	29.5	Very low	28.5	Very low	176 Å²	176	147.7 Å²	147.7	77%	0.772	76%	0.755	S	S	*	*			trans	58.8	102.9	-162.8	-68.1	-87.3	0	0	0	113.5
667	I	32	Very low	28.7	Very low	159 Å²	159	146.8 Å²	146.8	82%	0.815	76%	0.756	S	S	*	*			cis	62.6	140.8	20.6	-57.7	-179.5	0	0	0	112.9
668	A	27.7	Very low	28.8	Very low	84 Å²	84	145.1 Å²	145.1	69%	0.694	75%	0.746	S	S	*	*	S	Bend	trans	-82.7	168.9	-162.9	0	0	0	0	0	115.3
669	Q	25.7	Very low	28.8	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	74%	0.742	S	S	*	*			trans	83.3	157.8	173.2	-49.7	-169.3	-25.6	0	0	116.4
670	Q	27.8	Very low	28.8	Very low	138 Å²	138	147.9 Å²	147.9	65%	0.645	75%	0.75	S	S	*	*			trans	64.6	144	-176	-89.6	67.4	4.1	0	0	116.7
671	F	28.8	Very low	29.1	Very low	149 Å²	149	144 Å²	144	65%	0.654	74%	0.743	S	S	*	*			cis	-138.7	135	-7.6	-127.2	-45.5	0	0	0	112.1	L673	F671-L673 PolarHBondContact O-N 3.21Å
672	K	28.7	Very low	29.2	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.857	74%	0.739	S	S	*	*			trans	-77	86.7	160.8	178.2	-167.7	177.2	-176.9	0	108.8
673	L	27	Very low	29.3	Very low	134 Å²	134	142 Å²	142	70%	0.702	74%	0.741	S	S	*	*			trans	-150.2	98.9	168.4	-148.9	85.6	0	0	0	113	F671	F671-L673 PolarHBondContact O-N 3.21Å
674	N	28.5	Very low	29.4	Very low	174 Å²	174	140.2 Å²	140.2	93%	0.93	74%	0.735	S	S	*	*			trans	-154	59.2	147.2	-111.5	-18.3	0	0	0	108.9
675	Q	30.9	Very low	29.7	Very low	154 Å²	154	138.5 Å²	138.5	72%	0.72	73%	0.731	S	S	*	*	S	Bend	trans	-115.7	139.8	158.1	-72.9	-169.5	1.8	0	0	107.6
676	Q	27.6	Very low	29.9	Very low	136 Å²	136	139.7 Å²	139.7	64%	0.636	73%	0.729	S	S	*	*			trans	61.9	68.1	165.9	-55	-169.7	30.6	0	0	118.3
677	L	32.2	Very low	30.1	Very low	177 Å²	177	137.7 Å²	137.7	93%	0.927	73%	0.727	S	S	*	*				-117.1	78.4	128.1	-72.6	174.7	0	0	0	106.4
678	K	31.5	Very low	30.2	Very low	148 Å²	148	135.4 Å²	135.4	64%	0.643	72%	0.72	S	S	*	*				49	102.8	81.5	-89.9	-173.1	176.4	179.3	0	113.3
679	T	27.5	Very low	30.5	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.693	72%	0.722	S	S	*	*			trans	50.2	107.5	136.8	57.7	0	0	0	0	118.3
680	N	29	Very low	30.9	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	72%	0.716	S	S	*	*				-170.3	157.9	94.7	-92.5	-22	0	0	0	113.5
681	T	32.2	Very low	31.1	Very low	116 Å²	116	133.1 Å²	133.1	71%	0.712	72%	0.72	S	S	*	*			trans	44.5	106.1	153.9	51.6	0	0	0	0	118.2
682	S	28.5	Very low	31.2	Very low	99 Å²	99	131 Å²	131	69%	0.692	72%	0.72	S	S	*	*				59	130.3	81.7	73.1	0	0	0	0	113.3
683	V	32	Very low	31.2	Very low	118 Å²	118	130.5 Å²	130.5	72%	0.715	72%	0.717	S	S	*	*				-160.3	138.3	73.8	149.2	0	0	0	0	111
684	T	32.2	Very low	31.4	Very low	110 Å²	110	130.9 Å²	130.9	68%	0.675	72%	0.72	S	S	*	*			trans	19.2	153.5	151.6	77.6	0	0	0	0	121.5
685	N	34.5	Very low	31.5	Very low	121 Å²	121	131.2 Å²	131.2	65%	0.647	71%	0.714	S	S	*	*			cis	-171	158.1	44.4	-129.7	-13	0	0	0	112.1
686	N	34.1	Very low	31.6	Very low	123 Å²	123	130.7 Å²	130.7	66%	0.658	72%	0.715	S	S	*	*			trans	38.6	126.3	136.8	-63.2	-4.3	0	0	0	119.3
687	N	34.4	Very low	31.7	Very low	135 Å²	135	128.3 Å²	128.3	72%	0.722	71%	0.714	S	S	*	*			cis	-172.4	169.1	38.2	-93.4	-19.5	0	0	0	108.2
688	T	34	Very low	31.7	Very low	110 Å²	110	126.7 Å²	126.7	68%	0.675	71%	0.706	S	S	*	*			cis	-165.8	152.4	-8.1	22.4	0	0	0	0	108.8
689	S	34.4	Very low	31.8	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	71%	0.711	S	S	*	*			trans	54.5	143.8	146.3	63.2	0	0	0	0	121.6
690	S	32.5	Very low	31.8	Very low	92 Å²	92	124.7 Å²	124.7	64%	0.643	71%	0.71	S	S	*	*			cis	178.2	170.1	-9.6	51.3	0	0	0	0	110.2
691	I	32.2	Very low	31.9	Very low	143 Å²	143	123.2 Å²	123.2	73%	0.733	71%	0.711	S	S	*	*			trans	66	104.9	152	-72	157.9	0	0	0	115.7
692	T	31.7	Very low	31.9	Very low	105 Å²	105	124.1 Å²	124.1	64%	0.644	72%	0.716	S	S	*	*			cis	96.1	121	41	64.9	0	0	0	0	115.7
693	K	28.5	Very low	32	Very low	185 Å²	185	126.4 Å²	126.4	80%	0.804	72%	0.719	S	S	*	*			trans	52.1	117.1	133.9	-57.9	173.5	-179	177.2	0	119.7
694	N	32	Very low	32.1	Very low	142 Å²	142	126.5 Å²	126.5	76%	0.759	72%	0.716	S	S	*	*				-176.7	143.9	110	-81.1	-20.2	0	0	0	107
695	K	29.2	Very low	32	Very low	182 Å²	182	129.6 Å²	129.6	79%	0.791	72%	0.72	S	S	*	*				72.5	148.5	50.1	-93.3	-161	173.1	-167.6	0	114.7
696	D	33.5	Very low	32	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	72%	0.72	S	S	*	*			trans	72.6	154.6	177	-46.9	-28.8	0	0	0	115.1
697	S	29.6	Very low	31.9	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	73%	0.732	S	S	*	*			cis	-168.5	167.5	-29.9	57.2	0	0	0	0	109.3
698	N	31.2	Very low	31.8	Very low	143 Å²	143	129 Å²	129	77%	0.765	73%	0.73	S	S	*	*			trans	66.2	165.4	157.2	-57.5	-24	0	0	0	116.6
699	T	34	Very low	31.6	Very low	122 Å²	122	130.7 Å²	130.7	75%	0.748	74%	0.735	S	S	*	*			cis	-154.4	135.9	-9.5	0.6	0	0	0	0	112.5
700	S	28.7	Very low	31.5	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	73%	0.734	S	S	*	*			trans	33.2	139.6	140.5	62.6	0	0	0	0	125.5
701	S	30.8	Very low	31.3	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	74%	0.735	S	S	*	*			trans	72.1	150.8	149.5	75.3	0	0	0	0	117.2
702	V	32.1	Very low	31.1	Very low	134 Å²	134	131.8 Å²	131.8	81%	0.812	73%	0.734	S	S	*	*			cis	-134.4	161.4	38.1	165.3	0	0	0	0	113.5
703	I	29.8	Very low	31.1	Very low	147 Å²	147	133.3 Å²	133.3	75%	0.754	74%	0.737	S	S	*	*			trans	-114.8	143.7	-174.9	-66.3	161.6	0	0	0	111
704	N	34	Very low	31.1	Very low	121 Å²	121	129.6 Å²	129.6	65%	0.647	73%	0.73	S	S	*	*			trans	-178.2	122.6	135.6	-97.1	-50.3	0	0	0	114.2
705	K	31.8	Very low	30.8	Very low	174 Å²	174	132.8 Å²	132.8	76%	0.757	74%	0.737	S	S	*	*				56.7	147.7	128.5	-63.6	172.5	-171.5	157.1	0	120
706	T	32.6	Very low	30.8	Very low	107 Å²	107	127.9 Å²	127.9	66%	0.656	74%	0.738	S	S	*	*			cis	-157.4	143.9	18.2	-16.6	0	0	0	0	113.6
707	Q	32.1	Very low	30.5	Very low	193 Å²	193	130.1 Å²	130.1	90%	0.902	74%	0.741	S	S	*	*			trans	53.5	144.3	144.6	-79.1	160.2	-15	0	0	123.8
708	G	32.9	Very low	30.4	Very low	67 Å²	67	134.1 Å²	134.1	69%	0.691	75%	0.75	S	S	*	*			trans	112	79.5	169.5	0	0	0	0	0	113.9
709	N	30.5	Very low	30.3	Very low	146 Å²	146	132.2 Å²	132.2	78%	0.781	75%	0.748	S	S	*	*				53.2	132.1	59.5	-78.2	6.4	0	0	0	113.5
710	L	31	Very low	30	Very low	134 Å²	134	135.2 Å²	135.2	70%	0.702	75%	0.753	S	S	*	*			cis	-164.5	130.3	8.2	-116	163.4	0	0	0	111.8
711	S	29.3	Very low	30	Very low	95 Å²	95	139 Å²	139	66%	0.664	76%	0.76	S	S	*	*			trans	61.3	176	137.7	86.3	0	0	0	0	119.5
712	N	28.6	Very low	29.8	Very low	134 Å²	134	138.6 Å²	138.6	72%	0.717	75%	0.753	S	S	*	*			cis	-163.8	171.1	-20.2	-125	-8.5	0	0	0	110.9
713	I	30.5	Very low	29.4	Very low	137 Å²	137	139.7 Å²	139.7	70%	0.703	75%	0.753	S	S	*	*			trans	62.8	110.5	152.7	-64.7	158.9	0	0	0	116.6
714	T	27.9	Very low	29.4	Very low	106 Å²	106	141.3 Å²	141.3	65%	0.65	76%	0.758	S	S	*	*				78.3	129.3	60.3	-37.6	0	0	0	0	116.2
715	F	26.7	Very low	29.2	Very low	210 Å²	210	140.4 Å²	140.4	92%	0.921	76%	0.761	S	S	*	*			trans	62.1	147.3	168.8	-73.9	-61.3	0	0	0	119.4
716	G	28.9	Very low	29	Very low	78 Å²	78	138.3 Å²	138.3	80%	0.804	76%	0.758	S	S	*	*			trans	148.6	111.7	158.6	0	0	0	0	0	115.9
717	K	27.9	Very low	29.2	Very low	189 Å²	189	141.6 Å²	141.6	82%	0.822	77%	0.766	S	S	*	*			trans	-70.3	166.7	174.6	-65.2	169.1	173	171.6	0	113.5
718	Q	27	Very low	29	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.804	76%	0.76	S	S	*	*			trans	87	151.1	140.9	-87.1	163.5	-44	0	0	121.8
719	S	28.7	Very low	29	Very low	102 Å²	102	142 Å²	142	71%	0.713	76%	0.762	S	S	*	*			trans	54.4	106.8	156.4	45.9	0	0	0	0	120.7
720	H	28.9	Very low	29	Very low	186 Å²	186	143 Å²	143	86%	0.861	76%	0.759	S	S	*	*				35.7	147.7	106.4	-78.5	-76.6	0	0	0	121.6
721	Q	28.6	Very low	29	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	76%	0.761	S	S	*	*			trans	105.1	117.9	149.5	-81.4	-177.6	22	0	0	120.1
722	T	26.5	Very low	29.1	Very low	103 Å²	103	147 Å²	147	63%	0.632	76%	0.76	S	S	*	*				79.6	93.4	127	-53.7	0	0	0	0	120.4
723	L	23.6	Very low	29.3	Very low	156 Å²	156	146.3 Å²	146.3	82%	0.817	76%	0.756	S	S	*	*				55.1	163.1	121.5	-72.3	160.4	0	0	0	121.9
724	Q	29.6	Very low	29.4	Very low	181 Å²	181	146.4 Å²	146.4	85%	0.846	76%	0.758	S	S	*	*			trans	81.3	144.5	171.1	-51.8	-165.5	36.3	0	0	115.2
725	S	30.1	Very low	29.7	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	77%	0.768	S	S	*	*			cis	-155.2	176.1	-7.6	42.4	0	0	0	0	113.4
726	N	27.1	Very low	29.9	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	76%	0.763	S	S	*	*			trans	-55.6	157.2	-173.1	-45.1	-65.8	0	0	0	117.3
727	H	36.2	Very low	30.2	Very low	177 Å²	177	146.8 Å²	146.8	82%	0.819	76%	0.759	S	S	*	*				173.2	130	111.9	-88.2	-75.4	0	0	0	108.7
728	N	28.6	Very low	30.3	Very low	148 Å²	148	143 Å²	143	79%	0.791	75%	0.754	S	S	*	*			cis	88.7	151.9	38	-101.2	-30.2	0	0	0	116.3
729	V	32.1	Very low	30.6	Very low	120 Å²	120	141.3 Å²	141.3	73%	0.727	75%	0.751	S	S	*	*			trans	90.8	104.1	175.7	-175.9	0	0	0	0	114.2
730	K	30.6	Very low	30.7	Very low	166 Å²	166	141.4 Å²	141.4	72%	0.722	74%	0.744	S	S	*	*				76.6	149.4	82.2	-72.5	174	-176.1	171.2	0	113.5
731	R	31.6	Very low	30.7	Very low	196 Å²	196	141.8 Å²	141.8	74%	0.74	74%	0.743	S	S	*	*			cis	-169	158.3	6.4	-116.5	179.4	179.1	160.1	-7.6	110.3
732	N	31.4	Very low	30.7	Very low	119 Å²	119	136.9 Å²	136.9	64%	0.636	74%	0.739	S	S	*	*			trans	58.5	157.7	144.8	-67.3	42.2	0	0	0	120.3
733	D	33.3	Very low	30.8	Very low	119 Å²	119	142.4 Å²	142.4	64%	0.636	76%	0.755	S	S	*	*			cis	-162.7	161.4	-11	-104.6	-7.1	0	0	0	113.5
734	N	32.2	Very low	31.1	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	75%	0.75	S	S	*	*			trans	76.9	143	145.4	-70.5	-22.5	0	0	0	126.7
735	T	33.9	Very low	30.9	Very low	142 Å²	142	139.8 Å²	139.8	87%	0.871	74%	0.741	S	S	*	*			trans	87.1	130.8	151.2	33.8	0	0	0	0	123.7
736	N	31.9	Very low	30.8	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	74%	0.744	S	S	*	*			trans	-95.4	-175.3	174.9	-81	-28.5	0	0	0	110
737	P	35.5	Very low	31	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	75%	0.746	S	S	*	*			cis	-146.5	168.1	15.5	44.4	-24.3	0	0	0	120.6
738	C	29.2	Very low	30.7	Very low	109 Å²	109	142.3 Å²	142.3	74%	0.736	75%	0.751	S	S	*	*			trans	58	124.4	138.8	-72.6	0	0	0	0	125.4
739	N	32.2	Very low	30.8	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	75%	0.751	S	S	*	*				104.3	108.9	121.9	-81	-19.6	0	0	0	123.7
740	N	31.1	Very low	30.7	Very low	105 Å²	105	141.8 Å²	141.8	56%	0.561	75%	0.752	S	S	*	*			trans	78.8	103.9	130.5	-76.4	-54.2	0	0	0	122.9
741	K	29.1	Very low	30.8	Very low	194 Å²	194	139 Å²	139	84%	0.843	75%	0.749	S	S	*	*				72.4	116.2	122.8	-68.2	168.7	-178	152.2	0	120.4
742	G	30	Very low	30.7	Very low	73 Å²	73	136.6 Å²	136.6	75%	0.753	75%	0.751	S	S	*	*			trans	170.9	54.3	162.2	0	0	0	0	0	113.8	I744	G742-I744 PolarHBondContact O-N 3.11Å
743	F	27.8	Very low	30.7	Very low	219 Å²	219	137.7 Å²	137.7	96%	0.961	76%	0.755	S	S	*	*			trans	-84.2	114.3	-170.4	-113.6	-76	0	0	0	114.1
744	I	29.3	Very low	30.7	Very low	140 Å²	140	139.3 Å²	139.3	72%	0.718	76%	0.764	S	S	*	*			trans	-138.1	127.9	173.4	-66.8	179.7	0	0	0	107.9	G742	G742-I744 PolarHBondContact O-N 3.11Å
745	E	25.9	Very low	30.6	Very low	141 Å²	141	141.7 Å²	141.7	66%	0.659	77%	0.768	S	S	*	*			trans	49.8	149.3	159.1	-65.4	-168.6	115.6	0	0	124.6
746	K	28.9	Very low	30.6	Very low	177 Å²	177	141.3 Å²	141.3	77%	0.77	77%	0.767	S	S	*	*			trans	78.5	145.3	147	-72.4	148.7	-173.7	159.5	0	121.3
747	G	30.5	Very low	30.3	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	76%	0.76	S	S	*	*			trans	98.4	112.4	178	0	0	0	0	0	112.9
748	K	30.7	Very low	30	Very low	215 Å²	215	142.5 Å²	142.5	94%	0.935	77%	0.77	S	S	*	*				64.3	130.2	52.4	-65.9	-170	174.9	-176.7	0	113.7
749	S	29.9	Very low	30.1	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	77%	0.771	S	S	*	*			cis	-127.9	-138.1	0.7	-150.4	0	0	0	0	110.6
750	L	30.4	Very low	29.9	Very low	146 Å²	146	144.5 Å²	144.5	76%	0.764	77%	0.772	S	S	*	*			cis	-161.5	147.4	5.5	-171.1	58.2	0	0	0	110.4
751	V	31.5	Very low	30	Very low	106 Å²	106	145.2 Å²	145.2	64%	0.642	78%	0.776	S	S	*	*			trans	48.1	110.6	160.9	167.2	0	0	0	0	118.1
752	D	29.9	Very low	30	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	77%	0.769	S	S	*	*				74.7	148	64.5	-70.6	-56.5	0	0	0	114.2
753	I	32.2	Very low	30.1	Very low	143 Å²	143	145.6 Å²	145.6	73%	0.733	77%	0.772	S	S	*	*			cis	-142.3	163.6	31.8	-57.2	162.8	0	0	0	111.8
754	N	32.9	Very low	30	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	77%	0.766	S	S	*	*			trans	97.8	94.3	162.9	-71	-46.8	0	0	0	119.7
755	K	30.4	Very low	30.1	Very low	189 Å²	189	145.7 Å²	145.7	82%	0.822	77%	0.773	S	S	*	*			trans	-152.3	134.4	153.8	-108.3	-176.5	-179.9	176.5	0	110.2
756	P	32.5	Very low	30.2	Very low	134 Å²	134	145.8 Å²	145.8	87%	0.87	78%	0.778	S	S	*	*			trans	-73.6	150.1	158.9	-9.3	26.5	0	0	0	110.2
757	V	26.9	Very low	30.1	Very low	109 Å²	109	145.1 Å²	145.1	66%	0.661	78%	0.777	S	S	*	*			trans	-127.9	141.9	-175.5	170.4	0	0	0	0	110.2	I759	V757-I759 HydrophobicContact CG1-CD1 3.94Å; V757-I759 HydrophobicContact CG1-CG1 3.69Å
758	L	29.3	Very low	29.9	Very low	176 Å²	176	148 Å²	148	92%	0.921	78%	0.776	S	S	*	*			trans	-133.2	133.4	160.4	-108.5	165.7	0	0	0	107.9
759	I	30.6	Very low	29.9	Very low	146 Å²	146	146 Å²	146	75%	0.749	77%	0.77	S	S	*	*			trans	-105.9	144.2	-165.9	-79.9	161	0	0	0	111	V757	V757-I759 HydrophobicContact CG1-CD1 3.94Å; V757-I759 HydrophobicContact CG1-CG1 3.69Å
760	N	27.8	Very low	29.7	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	77%	0.769	S	S	*	*			trans	-84	153.4	171.3	-63.8	-47.9	0	0	0	111.1
761	D	32.7	Very low	29.7	Very low	121 Å²	121	148.6 Å²	148.6	65%	0.647	77%	0.772	S	S	*	*			trans	151.5	155.4	139	-82.4	-12	0	0	0	110.7
762	K	30.4	Very low	29.5	Very low	160 Å²	160	150.5 Å²	150.5	70%	0.696	78%	0.779	S	S	*	*			cis	-162.6	170.5	-20.5	-115	164.4	-166.7	139.1	0	108.8
763	S	30.8	Very low	29.7	Very low	115 Å²	115	151.5 Å²	151.5	80%	0.804	78%	0.784	S	S	*	*			trans	61.5	150.9	156	35.8	0	0	0	0	120.6
764	K	27	Very low	29.5	Very low	195 Å²	195	151.6 Å²	151.6	85%	0.848	78%	0.781	S	S	*	*			trans	-73.9	153.5	165.6	-48.5	166.6	176	-178.8	0	109.7
765	I	30	Very low	29.4	Very low	165 Å²	165	150.1 Å²	150.1	85%	0.846	77%	0.774	S	S	*	*				-169.1	167.8	129	-98.3	154.4	0	0	0	107.5
766	D	29.2	Very low	29.6	Very low	143 Å²	143	149.1 Å²	149.1	77%	0.765	78%	0.777	S	S	*	*			trans	-84	165.5	-160.6	-53	-83.4	0	0	0	115.9
767	E	26.2	Very low	29.5	Very low	164 Å²	164	149.9 Å²	149.9	77%	0.766	77%	0.774	S	S	*	*			trans	31.3	127.2	147.9	-68.9	-169.4	178.6	0	0	123.6
768	N	26.7	Very low	29.8	Very low	130 Å²	130	152 Å²	152	70%	0.695	78%	0.78	S	S	*	*			trans	74.5	144.5	141.1	-61	-34.3	0	0	0	121
769	H	30	Very low	29.8	Very low	175 Å²	175	151.1 Å²	151.1	81%	0.81	77%	0.771	S	S	*	*			trans	79.5	114.8	-170.9	-57.8	-74	0	0	0	114.4
770	I	26.8	Very low	29.9	Very low	149 Å²	149	152.4 Å²	152.4	76%	0.764	78%	0.778	S	S	*	*			cis	61.2	93.4	38	-43.6	177.1	0	0	0	112.9
771	I	30	Very low	29.8	Very low	162 Å²	162	152.6 Å²	152.6	83%	0.831	77%	0.774	S	S	*	*				-167.4	146.3	125.3	-97.1	154.6	0	0	0	107.6
772	N	26.9	Very low	29.7	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	78%	0.778	S	S	*	*			trans	-82.8	156.4	172.6	-66.8	-24.2	0	0	0	109.9
773	D	33.9	Very low	29.8	Very low	167 Å²	167	153.9 Å²	153.9	89%	0.893	78%	0.784	S	S	*	*			trans	-142	160.4	139.3	-133.1	-29.9	0	0	0	111.3
774	Q	29.7	Very low	29.6	Very low	145 Å²	145	156.9 Å²	156.9	68%	0.678	79%	0.79	S	S	*	*			trans	-112.6	167.5	-158.9	-90.4	-169.5	-120.4	0	0	115.4
775	D	30.8	Very low	29.6	Very low	122 Å²	122	156.8 Å²	156.8	65%	0.652	79%	0.793	S	S	*	*			trans	56	111.5	152.4	-55.9	-18.6	0	0	0	119.4
776	N	34.3	Very low	29.7	Very low	168 Å²	168	158.3 Å²	158.3	90%	0.898	79%	0.793	S	S	*	*				-147.4	116.9	127.2	-107.5	-76.4	0	0	0	109.3
777	N	29.2	Very low	29.7	Very low	150 Å²	150	159.4 Å²	159.4	80%	0.802	80%	0.796	S	S	*	*			trans	-128.5	118.9	-170.8	-160.8	3.9	0	0	0	108.4
778	I	33.6	Very low	29.9	Very low	154 Å²	154	158.7 Å²	158.7	79%	0.79	80%	0.797	S	S	*	*			trans	-122.6	123	-179.5	-65.2	-178.6	0	0	0	109.1
779	Q	29.7	Very low	30	Very low	156 Å²	156	159.9 Å²	159.9	73%	0.729	80%	0.803	S	S	*	*			trans	-79.9	144.4	-177.1	-60.2	167.6	-69.8	0	0	111.9
780	I	31.7	Very low	30.2	Very low	173 Å²	173	157.7 Å²	157.7	89%	0.887	80%	0.802	S	S	*	*			trans	-129.6	111.2	145.3	-60.9	-177.4	0	0	0	107
781	E	25.5	Very low	30.4	Very low	146 Å²	146	155 Å²	155	68%	0.682	80%	0.797	S	S	*	*			trans	-122.5	169.7	-179.1	-116.2	-164.5	159.8	0	0	111.5
782	T	31.6	Very low	30.5	Very low	119 Å²	119	154.9 Å²	154.9	73%	0.73	80%	0.798	S	S	*	*			trans	71.4	140	177.4	83.9	0	0	0	0	114.4
783	K	31.9	Very low	30.7	Very low	188 Å²	188	151.9 Å²	151.9	82%	0.817	79%	0.793	S	S	*	*			cis	-144.6	140.7	19.6	-63.4	164.1	-176.7	166.1	0	110.8
784	L	27.6	Very low	30.6	Very low	178 Å²	178	150.2 Å²	150.2	93%	0.932	79%	0.789	S	S	*	*			trans	177.4	67.7	132.2	-97.1	165.1	0	0	0	111.8
785	Q	26.4	Very low	30.7	Very low	193 Å²	193	152 Å²	152	90%	0.902	80%	0.795	S	S	*	*			trans	-135.5	115.5	159.2	-81.7	-171.6	-18	0	0	109.3
786	K	32.5	Very low	30.6	Very low	197 Å²	197	151.4 Å²	151.4	86%	0.857	80%	0.8	S	S	*	*			trans	-165.3	135.3	171.5	-84.7	-157.7	178.4	-169.3	0	105.8
787	M	28.8	Very low	30.6	Very low	166 Å²	166	149.4 Å²	149.4	82%	0.818	79%	0.789	S	S	*	*			cis	-136	154	-1.4	-78.1	123.2	67.9	0	0	110.1
788	D	30.9	Very low	31	Very low	149 Å²	149	150.2 Å²	150.2	80%	0.797	79%	0.788	S	S	*	*			trans	-115.3	153	154	-82.1	-51.8	0	0	0	108.8
789	N	28.2	Very low	31	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	78%	0.783	S	S	*	*			trans	59.2	84.7	160.7	-57.9	-28.7	0	0	0	120.1
790	V	33.3	Very low	31.4	Very low	130 Å²	130	146 Å²	146	79%	0.788	79%	0.786	S	S	*	*			trans	-146	92.3	146.5	-179.6	0	0	0	0	105.6
791	S	32.8	Very low	31.5	Very low	92 Å²	92	141.1 Å²	141.1	64%	0.643	78%	0.779	S	S	*	*				58.2	111.8	89.9	71.9	0	0	0	0	116.1
792	D	31	Very low	31.8	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.785	S	S	*	*			trans	75.3	121.3	147.8	-58.4	-43	0	0	0	124.1
793	A	31.1	Very low	31.6	Very low	83 Å²	83	143.7 Å²	143.7	69%	0.686	79%	0.786	S	S	*	*			trans	88.3	142.1	132.2	0	0	0	0	0	122.4
794	T	33	Very low	31.6	Very low	131 Å²	131	141.5 Å²	141.5	80%	0.804	78%	0.777	S	S	*	*			trans	68.1	148.8	165.2	64.7	0	0	0	0	118.6
795	K	30.5	Very low	31.7	Very low	184 Å²	184	139.2 Å²	139.2	80%	0.8	76%	0.761	S	S	*	*			cis	-175.7	138.6	-35.8	-117.9	179.1	-179.6	-178.3	0	108
796	S	29.7	Very low	31.7	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	75%	0.752	S	S	*	*			trans	58.3	157.7	159.2	54.9	0	0	0	0	118.8
797	D	33.8	Very low	31.5	Very low	126 Å²	126	132.4 Å²	132.4	67%	0.674	75%	0.747	S	S	*	*			cis	-158.8	-177.4	-16.4	-119.9	-115	0	0	0	107.5
798	H	36.4	Very low	31.5	Very low	167 Å²	167	128.9 Å²	128.9	77%	0.773	74%	0.739	S	S	*	*			cis	-122.3	179.8	5.2	-88.2	-38	0	0	0	109.6
799	S	34.5	Very low	31.3	Very low	98 Å²	98	129 Å²	129	69%	0.685	74%	0.735	S	S	*	*			cis	76.5	156.3	27.4	-103.7	0	0	0	0	116.3
800	P	38.1	Very low	31.3	Very low	124 Å²	124	128.3 Å²	128.3	81%	0.805	73%	0.725	S	S	*	*			cis	-135.2	174.3	-5.7	41.6	-25	0	0	0	117
801	G	33	Very low	31	Very low	71 Å²	71	131.8 Å²	131.8	73%	0.732	73%	0.729	S	S	*	*			trans	101	140.1	154.4	0	0	0	0	0	116.5
802	I	31.9	Very low	30.9	Very low	158 Å²	158	132.9 Å²	132.9	81%	0.81	74%	0.737	S	S	*	*			cis	-143.2	123.7	-0.6	-68.5	-177.9	0	0	0	104.7
803	Q	28.5	Very low	30.8	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	74%	0.735	S	S	*	*				52	139.9	95.2	-85.3	-172.7	40.3	0	0	113.7
804	K	31.8	Very low	31	Very low	142 Å²	142	134.8 Å²	134.8	62%	0.617	74%	0.741	S	S	*	*			cis	-160.2	171.2	11.8	-94.1	161	159.5	-75.3	0	106.2
805	E	28.8	Very low	30.8	Very low	129 Å²	129	133.1 Å²	133.1	60%	0.603	74%	0.741	S	S	*	*			cis	-160.6	143.1	-9.9	-112.4	161	171.2	0	0	108.8
806	I	28	Very low	30.9	Very low	139 Å²	139	133 Å²	133	71%	0.713	74%	0.743	S	S	*	*				61.6	130.4	103.3	-64.2	-177.7	0	0	0	117.2
807	S	27.3	Very low	31	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	75%	0.748	S	S	*	*			trans	69	159.5	158.8	73.9	0	0	0	0	118
808	S	28.9	Very low	30.8	Very low	93 Å²	93	136.7 Å²	136.7	65%	0.65	75%	0.749	S	S	*	*			cis	-175.8	150.1	-24.9	53.3	0	0	0	0	110.4
809	E	27.7	Very low	30.6	Very low	152 Å²	152	135 Å²	135	71%	0.71	75%	0.75	S	S	*	*			trans	61.3	169.1	157.1	-64.5	-164.4	166.7	0	0	117
810	K	27.4	Very low	30.5	Very low	140 Å²	140	137.9 Å²	137.9	61%	0.609	76%	0.757	S	S	*	*			cis	-164.4	140.5	-30.5	-105.3	173.9	-166.9	147.7	0	106.3
811	K	27.7	Very low	30.1	Very low	202 Å²	202	139.2 Å²	139.2	88%	0.878	76%	0.757	S	S	*	*			trans	65.2	167.8	168.7	-49.4	161.4	179.7	179.1	0	112.9
812	S	30.2	Very low	30	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	75%	0.754	S	S	*	*			cis	-143.5	169.3	2.3	55	0	0	0	0	113.2
813	L	28.1	Very low	30.1	Very low	158 Å²	158	139.4 Å²	139.4	83%	0.827	75%	0.749	S	S	*	*			trans	-58.2	175.5	159.5	-72.4	152.1	0	0	0	112.1
814	P	35.5	Very low	30.2	Very low	125 Å²	125	139 Å²	139	81%	0.812	75%	0.747	S	S	*	*			cis	-136.7	-164.4	16.7	41.7	-21	0	0	0	116.5
815	A	29	Very low	30.2	Very low	96 Å²	96	139 Å²	139	79%	0.793	75%	0.754	S	S	*	*			trans	-104.5	166	-170.5	0	0	0	0	0	115.2
816	E	32.4	Very low	30.1	Very low	180 Å²	180	138 Å²	138	84%	0.841	76%	0.761	S	S	*	*			trans	-137.6	113.4	159.8	-152.9	158.8	-139.3	0	0	106.2
817	R	32	Very low	30.3	Very low	229 Å²	229	136.9 Å²	136.9	86%	0.864	76%	0.763	S	S	*	*				57.4	142.3	80	-71.2	179.5	168.4	160.6	-4.2	113.5
818	A	29.7	Very low	30.3	Very low	83 Å²	83	140.8 Å²	140.8	69%	0.686	77%	0.766	S	S	*	*			cis	-170.2	-159.7	-16.6	0	0	0	0	0	107.2
819	V	32.4	Very low	30.2	Very low	133 Å²	133	143.8 Å²	143.8	81%	0.806	77%	0.774	S	S	*	*			trans	74.6	119.1	170.6	-173.4	0	0	0	0	113.2
820	L	33	Very low	30.4	Very low	157 Å²	157	142.4 Å²	142.4	82%	0.822	78%	0.779	S	S	*	*			cis	-145.9	146.6	5.9	-120.9	160.6	0	0	0	111.1
821	N	27.7	Very low	30.2	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	79%	0.787	S	S	*	*			trans	-78.3	176.5	158.2	-60.4	-46.3	0	0	0	108.6
822	A	32.7	Very low	30.2	Very low	79 Å²	79	139.5 Å²	139.5	65%	0.653	78%	0.776	S	S	*	*			cis	-151.4	-161.8	13.5	0	0	0	0	0	107.8
823	Q	32.5	Very low	30.2	Very low	154 Å²	154	142.4 Å²	142.4	72%	0.72	77%	0.774	S	S	*	*			cis	-164	155.7	11.1	-142.9	148.4	-19.6	0	0	109.1
824	Q	32.2	Very low	30.2	Very low	151 Å²	151	139.5 Å²	139.5	71%	0.706	76%	0.763	S	S	*	*			trans	22.7	147.3	139.4	-62.5	171.3	2.7	0	0	121
825	N	31.3	Very low	29.9	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	76%	0.762	S	S	*	*			cis	-165.8	174.9	-0.1	-103.2	-16.5	0	0	0	111.1
826	S	25.8	Very low	30.2	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	75%	0.754	S	S	*	*			trans	-71.5	175.5	173.5	62	0	0	0	0	114.4
827	P	33.4	Very low	30.2	Very low	115 Å²	115	143 Å²	143	75%	0.747	75%	0.746	S	S	*	*			cis	-152	179.5	24.4	44.6	-22.3	0	0	0	121.1
828	K	27.6	Very low	30.3	Very low	190 Å²	190	138.8 Å²	138.8	83%	0.826	74%	0.741	S	S	*	*			trans	0.2	137.3	156.5	-62.4	174.3	177.1	175.1	0	123.9
829	L	24.9	Very low	30.3	Very low	157 Å²	157	140.2 Å²	140.2	82%	0.822	74%	0.74	S	S	*	*			trans	66.3	169	139.7	-75	162.7	0	0	0	118.6
830	P	32.5	Very low	30.4	Very low	123 Å²	123	140 Å²	140	80%	0.799	74%	0.735	S	S	*	*			cis	-129	-163.2	-2.7	41.9	-23.9	0	0	0	115.8
831	M	24.3	Very low	30.3	Very low	158 Å²	158	140.1 Å²	140.1	78%	0.778	73%	0.731	S	S	*	*			trans	-75.2	161.1	-171.9	-55.8	-140.3	-61.4	0	0	118.8
832	N	27.2	Very low	30.4	Very low	122 Å²	122	140.3 Å²	140.3	65%	0.652	73%	0.731	S	S	*	*				106.1	135.9	123.2	-114.7	-8.8	0	0	0	122.5
833	K	31	Very low	30.4	Very low	177 Å²	177	141.6 Å²	141.6	77%	0.77	73%	0.732	S	S	*	*			trans	69.2	165.2	157	-59.8	172.5	-179.3	179.7	0	119.7
834	T	27.3	Very low	30.3	Very low	96 Å²	96	143.7 Å²	143.7	59%	0.589	74%	0.739	S	S	*	*			cis	179.8	158.9	-42.8	-68	0	0	0	0	105.8
835	Y	29.9	Very low	30.4	Very low	204 Å²	204	144.5 Å²	144.5	80%	0.8	74%	0.743	S	S	*	*			trans	78.7	150.6	171.4	-53.9	-74.3	0	0	0	115.8
836	D	34.5	Very low	30.5	Very low	114 Å²	114	143.1 Å²	143.1	61%	0.61	74%	0.736	S	S	*	*			cis	-146.1	-175.7	-15.2	-135.7	-34.6	0	0	0	112.6
837	K	33	Very low	30.9	Very low	157 Å²	157	145 Å²	145	68%	0.683	74%	0.737	S	S	*	*			trans	-76.8	161.3	179.8	-35.2	116.6	-173.6	157.9	0	113.9
838	D	33.7	Very low	31.1	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	74%	0.736	S	S	*	*				171.9	125.7	113.1	-88.2	-19.8	0	0	0	109.8
839	V	30.4	Very low	31.4	Very low	112 Å²	112	143.7 Å²	143.7	68%	0.679	73%	0.733	S	S	*	*				75.7	95.8	79.5	175.6	0	0	0	0	114.4
840	N	32.8	Very low	31.9	Very low	129 Å²	129	143 Å²	143	69%	0.69	73%	0.728	S	S	*	*				172.5	133	124.9	-92.1	-50.7	0	0	0	116.5
841	Q	32.3	Very low	32	Very low	160 Å²	160	142.8 Å²	142.8	75%	0.748	73%	0.725	S	S	*	*			trans	33.8	117.1	133.9	-56.5	178	67.9	0	0	123.2
842	I	28.9	Very low	32.3	Very low	156 Å²	156	146.2 Å²	146.2	80%	0.8	73%	0.729	S	S	*	*				39.5	140.5	106.4	-59.2	170.1	0	0	0	118.2
843	P	34	Very low	32.5	Very low	106 Å²	106	145.5 Å²	145.5	69%	0.688	73%	0.733	S	S	*	*			cis	-135.7	179.1	10.1	31.1	-7.3	0	0	0	118.4
844	K	29.6	Very low	32.4	Very low	198 Å²	198	145 Å²	145	86%	0.861	74%	0.738	S	S	*	*			trans	20.9	136.3	146	-59.2	173.3	-179.8	179.4	0	121.9
845	E	33.8	Very low	32.7	Very low	169 Å²	169	145 Å²	145	79%	0.79	75%	0.748	S	S	*	*				-171.9	150	103.9	-105.3	-169.4	-156.3	0	0	116.5
846	N	33.2	Very low	32.6	Very low	115 Å²	115	142.9 Å²	142.9	62%	0.615	75%	0.751	S	S	*	*			trans	31.1	115.4	145.6	-56.5	-28.7	0	0	0	123
847	N	35.3	Very low	32.6	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	76%	0.757	S	S	*	*				178.7	147.3	91.3	-94.9	-50	0	0	0	117
848	N	36.4	Very low	32.5	Very low	135 Å²	135	142.5 Å²	142.5	72%	0.722	76%	0.76	S	S	*	*			trans	-28.6	141.2	175.1	-51.2	-37.1	0	0	0	122.5
849	D	35.3	Very low	32.4	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	76%	0.762	S	S	*	*				-163.6	121.4	110.1	-93.9	-23.6	0	0	0	108.8
850	I	35.2	Very low	32.4	Very low	142 Å²	142	143.2 Å²	143.2	73%	0.728	76%	0.763	S	S	*	*				61.7	115.2	85.8	-61.4	179.1	0	0	0	111.7
851	T	34.2	Very low	32.2	Very low	119 Å²	119	141.8 Å²	141.8	73%	0.73	76%	0.759	S	S	*	*			cis	-146.5	150.9	17.3	-13.8	0	0	0	0	114.5
852	R	30	Very low	32.2	Very low	231 Å²	231	141.7 Å²	141.7	87%	0.872	76%	0.758	S	S	*	*			trans	15.2	148.9	140.2	-79.4	179.9	157.5	135.9	-4.6	121.5
853	C	31	Very low	32.3	Very low	106 Å²	106	140.7 Å²	140.7	72%	0.716	75%	0.75	S	S	*	*			cis	-150.8	153.7	15.4	-112.3	0	0	0	0	112.7
854	N	29.4	Very low	32.1	Very low	166 Å²	166	141.3 Å²	141.3	89%	0.888	75%	0.748	S	S	*	*			trans	-117.1	153.9	162.8	-80.7	-35.8	0	0	0	109.5
855	A	34.3	Very low	32.2	Very low	96 Å²	96	138 Å²	138	79%	0.793	74%	0.739	S	S	*	*			trans	-169.6	154.4	143.6	0	0	0	0	0	111.7
856	N	28.6	Very low	31.9	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	74%	0.736	S	S	*	*			trans	-120.1	-177.1	176.8	-76.6	-41.1	0	0	0	110.6
857	V	33.8	Very low	31.6	Very low	122 Å²	122	135.2 Å²	135.2	74%	0.739	74%	0.737	S	S	*	*			trans	109.7	105.5	150	-172.5	0	0	0	0	117
858	N	30	Very low	31.5	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	74%	0.743	S	S	*	*			trans	23.7	134.3	135.9	-42.7	-13.1	0	0	0	120.2
859	I	32.6	Very low	31.2	Very low	154 Å²	154	134.2 Å²	134.2	79%	0.79	74%	0.744	S	S	*	*				-172.2	146.6	95.5	-95.8	167.3	0	0	0	112.2
860	T	29.5	Very low	31.3	Very low	115 Å²	115	132.4 Å²	132.4	71%	0.706	74%	0.74	S	S	*	*			trans	-16.4	150.8	155.6	-19.2	0	0	0	0	115.8
861	T	30.2	Very low	31	Very low	98 Å²	98	132.1 Å²	132.1	60%	0.601	74%	0.74	S	S	*	*			cis	-173.3	136.6	48.5	-40.6	0	0	0	0	113.4
862	Q	30.8	Very low	30.7	Very low	158 Å²	158	132.5 Å²	132.5	74%	0.738	74%	0.742	S	S	*	*			trans	59.2	164.6	148	-76.6	173	30.1	0	0	119.2
863	Q	31.7	Very low	30.7	Very low	135 Å²	135	127 Å²	127	63%	0.631	73%	0.734	S	S	*	*			cis	-153.9	154.4	6.4	-134.2	174.9	67.9	0	0	110.4
864	N	30.6	Very low	30.7	Very low	120 Å²	120	127.4 Å²	127.4	64%	0.642	73%	0.733	S	S	*	*			trans	64.5	154.9	150.9	-60.6	-17.5	0	0	0	121.2
865	L	29.9	Very low	30.6	Very low	129 Å²	129	126.1 Å²	126.1	68%	0.675	73%	0.726	S	S	*	*			cis	-160.9	157.2	-22.7	-108.5	167.9	0	0	0	109.3
866	N	28.5	Very low	30.5	Very low	133 Å²	133	129.4 Å²	129.4	71%	0.711	73%	0.73	S	S	*	*			trans	32.2	108.6	147.5	-70	8.7	0	0	0	119.9
867	S	27.4	Very low	30.5	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	72%	0.719	S	S	*	*				85.1	122.5	69.5	73.6	0	0	0	0	115.4
868	N	32.1	Very low	30.4	Very low	170 Å²	170	129.9 Å²	129.9	91%	0.909	73%	0.726	S	S	*	*			trans	-174.8	164.7	130.9	-90.9	-21	0	0	0	110.7
869	A	31	Very low	30.2	Very low	90 Å²	90	129 Å²	129	74%	0.744	73%	0.725	S	S	*	*			trans	-139.3	-172.6	178.4	0	0	0	0	0	108.1
870	P	36.3	Very low	30.1	Very low	105 Å²	105	128.6 Å²	128.6	68%	0.682	73%	0.73	S	S	*	*			cis	-130.1	-148	-13.2	25.9	0.4	0	0	0	111.4
871	D	29.5	Very low	30.1	Very low	135 Å²	135	127.4 Å²	127.4	72%	0.722	73%	0.732	S	S	*	*			trans	98	101.9	141.6	-68.2	-15.2	0	0	0	124.6
872	V	27.7	Very low	30.1	Very low	127 Å²	127	127.3 Å²	127.3	77%	0.77	74%	0.742	S	S	*	*				65	157.6	127.5	-157.9	0	0	0	0	121.2
873	V	29.1	Very low	30.1	Very low	117 Å²	117	125.5 Å²	125.5	71%	0.709	74%	0.741	S	S	*	*			trans	108.6	104.3	151.1	-163.4	0	0	0	0	117.8
874	T	31.4	Very low	30.1	Very low	113 Å²	113	125.6 Å²	125.6	69%	0.693	75%	0.746	S	S	*	*			trans	52.1	122.7	154.6	59.7	0	0	0	0	123.6
875	N	27.4	Very low	30.2	Very low	139 Å²	139	126.2 Å²	126.2	74%	0.743	75%	0.75	S	S	*	*				22.4	127.4	115.7	-50.4	-13.9	0	0	0	118.9
876	N	32.5	Very low	30.1	Very low	166 Å²	166	126 Å²	126	89%	0.888	75%	0.749	S	S	*	*				-159.2	162.3	104.8	-102.5	-30.9	0	0	0	113.3
877	I	28	Very low	30.2	Very low	123 Å²	123	128.1 Å²	128.1	63%	0.631	75%	0.754	S	S	*	*			trans	-100.3	140.7	-176	-62.9	160.4	0	0	0	109.3
878	I	31.8	Very low	30.3	Very low	169 Å²	169	130.9 Å²	130.9	87%	0.867	77%	0.768	S	S	*	*			trans	-163.3	148	137.7	-102.7	150.8	0	0	0	110.4
879	T	26.2	Very low	30.3	Very low	121 Å²	121	128.7 Å²	128.7	74%	0.742	77%	0.765	S	S	*	*			trans	-107.8	134.7	-172.4	-51.7	0	0	0	0	111.8
880	T	31.8	Very low	30.1	Very low	146 Å²	146	130.1 Å²	130.1	90%	0.896	77%	0.77	S	S	*	*			trans	-146.9	162.3	150.5	23.1	0	0	0	0	108.8
881	A	28.6	Very low	29.8	Very low	91 Å²	91	131.9 Å²	131.9	75%	0.752	78%	0.778	S	S	*	*			trans	-135.7	163	-157.3	0	0	0	0	0	114.9
882	A	29.4	Very low	29.8	Very low	96 Å²	96	134.5 Å²	134.5	79%	0.793	78%	0.784	S	S	*	*			trans	69.4	147.1	177.8	0	0	0	0	0	114.6
883	T	32.3	Very low	29.7	Very low	119 Å²	119	136.2 Å²	136.2	73%	0.73	79%	0.788	S	S	*	*			cis	-138.9	154.3	17.6	47.6	0	0	0	0	113.4
884	N	30.1	Very low	29.8	Very low	137 Å²	137	138.3 Å²	138.3	73%	0.733	79%	0.794	S	S	*	*			trans	35.2	125.6	142.2	-57.1	-2.3	0	0	0	118.8
885	N	32.4	Very low	29.6	Very low	134 Å²	134	140.8 Å²	140.8	72%	0.717	80%	0.803	S	S	*	*				-173.7	161.4	52.2	-116	-15	0	0	0	115
886	N	29.4	Very low	30.1	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	80%	0.799	S	S	*	*			trans	80.5	139.4	148.1	-65.2	-9.6	0	0	0	124.4
887	H	29.6	Very low	30.3	Very low	177 Å²	177	135.8 Å²	135.8	82%	0.819	79%	0.787	S	S	*	*			trans	64.4	96	158.3	-58	-51.2	0	0	0	122.2
888	T	30.2	Very low	30.8	Very low	150 Å²	150	135.3 Å²	135.3	92%	0.92	79%	0.786	S	S	*	*				-148	154.3	122.8	26.8	0	0	0	0	109.4
889	S	30.9	Very low	31	Very low	123 Å²	123	130.1 Å²	130.1	86%	0.86	77%	0.774	S	S	*	*			trans	-101	143.5	-165.6	42	0	0	0	0	115
890	S	28.5	Very low	31.6	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	76%	0.755	S	S	*	*			trans	-92	144.9	-174.9	-34.9	0	0	0	0	113.1
891	V	29.7	Very low	31.9	Very low	142 Å²	142	123.2 Å²	123.2	86%	0.861	73%	0.73	S	S	*	*			trans	-114.3	128	167.3	179.5	0	0	0	0	108.9
892	K	28.9	Very low	32.2	Very low	191 Å²	191	126.6 Å²	126.6	83%	0.83	73%	0.73	S	S	*	*			trans	-75.9	141	-177.8	-64.8	-179.7	178.2	179.8	0	111.6
893	L	26.3	Very low	32.5	Very low	163 Å²	163	130.1 Å²	130.1	85%	0.853	73%	0.728	S	S	*	*			trans	-79.5	158.7	154	-98.3	69.5	0	0	0	109.7
894	L	29.6	Very low	32.6	Very low	161 Å²	161	129.3 Å²	129.3	84%	0.843	72%	0.718	S	S	*	*			trans	-130.3	125.6	170.9	-77.5	166.5	0	0	0	108.1
895	D	29.1	Very low	32.9	Very low	164 Å²	164	127.2 Å²	127.2	88%	0.877	71%	0.706	S	S	*	*			trans	-73.9	143.6	176.4	-69	-54.8	0	0	0	111.7
896	V	37.2	Very low	32.8	Very low	108 Å²	108	124 Å²	124	66%	0.655	71%	0.705	S	S	*	*			trans	-137.1	129.7	174.3	-177.4	0	0	0	0	109	A900	V896-A900 HydrophobicContact CG1-CB 4.19Å
897	S	36.9	Very low	33	Very low	92 Å²	92	123.6 Å²	123.6	64%	0.643	70%	0.703	S	S	*	*			trans	-69.9	152.9	-165.4	56.6	0	0	0	0	115.9	G899 A900	S897-G899 PolarHBondContact O-N 2.91Å; S897-A900 WeakPolarHBondContact O-CB 3.32Å; S897-A900 PolarHBondContact O-N 3.37Å
898	D	38.9	Very low	33.1	Very low	113 Å²	113	119.9 Å²	119.9	60%	0.604	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	-27.6	-173.7	-56.8	-27	0	0	0	115.7	A900 Q901 Q902	D898-A900 PolarHBondContact O-N 3.17Å; D898-A900 VanDerWaalsContact O-N 3.15Å; D898-Q901 PolarHBondContact O-N 2.87Å; D898-Q901 VanDerWaalsContact O-N 3.14Å; D898-Q902 PolarHBondContact O-N 3.19Å
899	G	36	Very low	33.1	Very low	60 Å²	60	122.3 Å²	122.3	62%	0.619	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-20.2	176.2	0	0	0	0	0	114.1	S897	S897-G899 PolarHBondContact O-N 2.91Å
900	A	38.4	Very low	33.1	Very low	41 Å²	41	119.7 Å²	119.7	34%	0.339	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	-44.2	172.1	0	0	0	0	0	112.5	V896 S897 D898 Q902 K903	V896-A900 HydrophobicContact CG1-CB 4.19Å; S897-A900 WeakPolarHBondContact O-CB 3.32Å; S897-A900 PolarHBondContact O-N 3.37Å; D898-A900 PolarHBondContact O-N 3.17Å; D898-A900 VanDerWaalsContact O-N 3.15Å; A900-Q902 PolarHBondContact O-N 3.37Å; A900-K903 VanDerWaalsContact O-CB 3.31Å; A900-K903 WeakPolarHBondContact O-CB 3.41Å; A900-K903 PolarHBondContact O-N 3.14Å
901	Q	37.5	Very low	33.3	Very low	81 Å²	81	119.9 Å²	119.9	38%	0.379	67%	0.669	S	S	.	*	H	α-helix	trans	-61.4	-42	-175.6	-62.9	-175.3	9.6	0	0	111.8	D898 K903 L904 I905	D898-Q901 PolarHBondContact O-N 2.87Å; D898-Q901 VanDerWaalsContact O-N 3.14Å; Q901-K903 PolarHBondContact O-N 3.13Å; Q901-L904 PolarHBondContact O-N 3.14Å; Q901-I905 PolarHBondContact O-N 3.18Å
902	Q	35.9	Very low	33.2	Very low	162 Å²	162	118.4 Å²	118.4	76%	0.757	67%	0.665	S	S	*	*	H	α-helix	trans	-63.3	-11.1	176.8	-61.4	-173.9	16.4	0	0	113.9	D898 A900	D898-Q902 PolarHBondContact O-N 3.19Å; A900-Q902 PolarHBondContact O-N 3.37Å
903	K	35.3	Very low	33.2	Very low	171 Å²	171	112.7 Å²	112.7	74%	0.743	66%	0.66	S	S	*	*	H	α-helix	trans	-97.1	-14.7	177	-130.2	173.1	-174.1	174.6	0	113.7	A900 Q901 N907	A900-K903 VanDerWaalsContact O-CB 3.31Å; A900-K903 WeakPolarHBondContact O-CB 3.41Å; A900-K903 PolarHBondContact O-N 3.14Å; Q901-K903 PolarHBondContact O-N 3.13Å; K903-N907 PolarHBondContact O-ND2 3.11Å
904	L	34.8	Very low	33.4	Very low	101 Å²	101	113.2 Å²	113.2	53%	0.529	66%	0.663	S	S	.	*	H	α-helix	trans	-89.4	-45.8	179.1	-88.3	137.4	0	0	0	112.4	Q901 G906 N907 N1280	Q901-L904 PolarHBondContact O-N 3.14Å; L904-G906 PolarHBondContact O-N 3.27Å; L904-N907 PolarHBondContact O-N 3.19Å; L904-N1280 VanDerWaalsContact CB-O 3.3Å; L904-N1280 WeakPolarHBondContact CB-O 3.31Å
905	I	35.1	Very low	33.5	Very low	93 Å²	93	114.9 Å²	114.9	48%	0.477	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52	-24.6	-177.7	-64.9	166.7	0	0	0	113.6	Q901	Q901-I905 PolarHBondContact O-N 3.18Å
906	G	31.8	Very low	33.6	Very low	68 Å²	68	116.4 Å²	116.4	70%	0.701	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-11.8	177.9	0	0	0	0	0	116.8	L904	L904-G906 PolarHBondContact O-N 3.27Å
907	N	32	Very low	33.4	Very low	114 Å²	114	115.3 Å²	115.3	61%	0.61	66%	0.657	S	S	*	*			trans	-102.8	-8	-164.7	-77.8	-44.2	0	0	0	116.6	K903 L904 F909	K903-N907 PolarHBondContact O-ND2 3.11Å; L904-N907 PolarHBondContact O-N 3.19Å; N907-F909 PolarHBondContact O-N 3.42Å
908	C	32.1	Very low	33.1	Very low	99 Å²	99	118.2 Å²	118.2	67%	0.669	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	15.7	-172.1	-65.9	0	0	0	0	116.6
909	F	30.3	Very low	32.7	Very low	201 Å²	201	120 Å²	120	88%	0.882	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.6	27	-178.6	-75.7	-76.8	0	0	0	115.5	N907	N907-F909 PolarHBondContact O-N 3.42Å
910	T	30.6	Very low	32.6	Very low	68 Å²	68	124.4 Å²	124.4	42%	0.417	68%	0.684	S	S	.	*			trans	-144.2	108	158.7	43.6	0	0	0	0	112.6	S912	T910-S912 PolarHBondContact O-N 3.33Å
911	V	33	Very low	32.6	Very low	125 Å²	125	131.9 Å²	131.9	76%	0.758	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	76	169.6	-174.8	0	0	0	0	109.3
912	S	28.7	Very low	32.7	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.7	2.1	-178.4	-48.4	0	0	0	0	114.4	T910	T910-S912 PolarHBondContact O-N 3.33Å
913	G	28.1	Very low	33.6	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	73%	0.728	S	S	*	*			trans	-113.3	-10.1	-171	0	0	0	0	0	116.8	K915	G913-K915 PolarHBondContact O-N 3.01Å; G913-K915 VanDerWaalsContact O-N 3.16Å
914	L	31.2	Very low	35.2	Very low	173 Å²	173	128.8 Å²	128.8	91%	0.906	70%	0.701	S	S	*	*			trans	-81.4	98.4	-176.2	-65.8	177.8	0	0	0	111.3
915	K	30.3	Very low	37.2	Very low	196 Å²	196	128.7 Å²	128.7	85%	0.852	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-56	139	154.2	-78.8	-174.9	174.3	-178	0	108.2	G913	G913-K915 PolarHBondContact O-N 3.01Å; G913-K915 VanDerWaalsContact O-N 3.16Å
916	K	31.8	Very low	39.4	Very low	197 Å²	197	125.1 Å²	125.1	86%	0.857	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-57.9	128.3	172	-73	-175.4	175.1	-176.1	0	109.3
917	P	32	Very low	41.7	Very low	84 Å²	84	125.5 Å²	125.5	55%	0.545	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-66.2	153.2	159.4	30.8	-33.4	0	0	0	109.2	L922	P917-L922 HydrophobicContact CG-CD2 3.99Å; P917-L922 HydrophobicContact CG-CG 4.33Å
918	N	32	Very low	43.6	Very low	153 Å²	153	122.2 Å²	122.2	82%	0.818	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-66.9	162.5	174.9	-75.2	-11.5	0	0	0	111.3	D920	N918-D920 PolarHBondContact O-N 3Å
919	N	30.8	Very low	45.7	Very low	151 Å²	151	119.2 Å²	119.2	81%	0.807	64%	0.64	S	S	*	*	S	Bend	trans	-63.9	101.4	179.3	-65.6	-19.2	0	0	0	111
920	D	33.2	Very low	48.1	Very low	152 Å²	152	111.4 Å²	111.4	81%	0.813	62%	0.616	S	S	*	*	S	Bend		-169.5	139.5	128.2	-99.7	-30.2	0	0	0	111.6	N918 L922	N918-D920 PolarHBondContact O-N 3Å; D920-L922 PolarHBondContact O-N 3.4Å
921	K	37.3	Very low	50.7	Low	199 Å²	199	108.2 Å²	108.2	87%	0.865	60%	0.597	S	S	*	*			trans	42.7	56.9	179.3	-70	178.4	178.8	168.7	0	115.1	K923	K921-K923 PolarHBondContact O-N 3.12Å
922	L	40.6	Very low	53.4	Low	128 Å²	128	105.9 Å²	105.9	67%	0.67	58%	0.583	S	S	*	*			trans	-56.4	96.8	160.8	-101.1	155	0	0	0	109.9	P917 D920 S924	P917-L922 HydrophobicContact CG-CD2 3.99Å; P917-L922 HydrophobicContact CG-CG 4.33Å; D920-L922 PolarHBondContact O-N 3.4Å; L922-S924 PolarHBondContact O-N 3.48Å
923	K	54	Low	56.4	Low	196 Å²	196	106.1 Å²	106.1	85%	0.852	57%	0.568	S	S	*	*			trans	-59.6	122.5	168.9	-74.8	179.3	179.8	171.1	0	108.1	K921	K921-K923 PolarHBondContact O-N 3.12Å
924	S	68.9	Low	59.4	Low	25 Å²	25	103.3 Å²	103.3	18%	0.175	54%	0.536	C	S	.	.			trans	-63.6	138.7	178.8	170.9	0	0	0	0	111.7	L922 Y926 T927 E1010	L922-S924 PolarHBondContact O-N 3.48Å; S924-Y926 PolarHBondContact O-N 3.44Å; S924-Y926 WeakPolarHBondContact OG-CB 3.25Å; S924-Y926 WeakPolarHBondContact OG-CD2 3.43Å; S924-Y926 PolarHBondContact OG-N 2.9Å; S924-T927 PolarHBondContact O-N 2.88Å; S924-E1010 WeakPolarHBondContact CB-OE2 3.35Å; S924-E1010 PolarHBondContact OG-OE1 3.47Å; S924-E1010 VanDerWaalsContact OG-OE1 3.06Å; S924-E1010 PolarHBondContact OG-OE2 3.46Å
925	V	77.5	Confident	62	Low	98 Å²	98	100 Å²	100	59%	0.594	53%	0.527	S	S	*	.	S	Bend	trans	-64	-29.7	171.5	-169.4	0	0	0	0	110.8	T927 A928 L988	V925-T927 VanDerWaalsContact C-N 3.35Å; V925-T927 PolarHBondContact O-N 2.88Å; V925-A928 VanDerWaalsContact O-CB 3.26Å; V925-A928 WeakPolarHBondContact O-CB 3.2Å; V925-A928 PolarHBondContact O-N 3.33Å; V925-L988 HydrophobicContact CG1-CD1 3.76Å
926	Y	82.2	Confident	64.6	Low	18 Å²	18	93.4 Å²	93.4	7%	0.071	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-72.4	-27.4	-179.1	-55.9	-76.2	0	0	0	112.5	S924 A928 V929 V931 E984 L987 L988 E1010 I1015	S924-Y926 PolarHBondContact O-N 3.44Å; S924-Y926 WeakPolarHBondContact OG-CB 3.25Å; S924-Y926 WeakPolarHBondContact OG-CD2 3.43Å; S924-Y926 PolarHBondContact OG-N 2.9Å; Y926-A928 PolarHBondContact O-N 3.48Å; Y926-A928 VanDerWaalsContact O-N 3.14Å; Y926-V929 VanDerWaalsContact O-CG2 3.31Å; Y926-V929 WeakPolarHBondContact O-CG2 3.41Å; Y926-V929 PolarHBondContact O-N 3.49Å; Y926-V931 WeakPolarHBondContact O-CB 3.48Å; Y926-V931 WeakPolarHBondContact O-CG2 3.29Å; Y926-V931 PolarHBondContact O-N 2.82Å; Y926-E984 VanDerWaalsContact OH-CG 3.3Å; Y926-E984 WeakPolarHBondContact OH-CG 3.34Å; Y926-L987 HydrophobicContact CE1-CD2 4.04Å; Y926-L987 HydrophobicContact CE1-CG 4.46Å; Y926-L988 HydrophobicContact CD1-CD2 3.52Å; Y926-L988 HydrophobicContact CD1-CG 4.14Å; Y926-L988 HydrophobicContact CE1-CD2 4.06Å; Y926-L988 HydrophobicContact CE1-CG 4.17Å; Y926-L988 HydrophobicContact CG-CD2 4.3Å; Y926-E1010 WeakPolarHBondContact CD2-OE1 3.44Å; Y926-I1015 HydrophobicContact CD1-CD1 3.72Å; Y926-I1015 HydrophobicContact CD2-CD1 3.75Å; Y926-I1015 HydrophobicContact CE1-CD1 3.48Å; Y926-I1015 VanDerWaalsContact CE1-CD1 3.48Å; Y926-I1015 HydrophobicContact CE2-CD1 3.51Å; Y926-I1015 HydrophobicContact CG-CD1 3.86Å
927	T	78.6	Confident	66.5	Low	76 Å²	76	89.1 Å²	89.1	47%	0.466	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-60.7	-22.7	172.5	-50.9	0	0	0	0	112.5	S924 V925 V929 G930	S924-T927 PolarHBondContact O-N 2.88Å; V925-T927 VanDerWaalsContact C-N 3.35Å; V925-T927 PolarHBondContact O-N 2.88Å; T927-V929 VanDerWaalsContact C-N 3.29Å; T927-V929 PolarHBondContact O-N 3.49Å; T927-G930 PolarHBondContact O-N 2.8Å
928	A	73.3	Confident	69	Low	45 Å²	45	89.3 Å²	89.3	37%	0.372	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-65.8	-27.5	174.6	0	0	0	0	0	113.7	V925 Y926 L1278	V925-A928 VanDerWaalsContact O-CB 3.26Å; V925-A928 WeakPolarHBondContact O-CB 3.2Å; V925-A928 PolarHBondContact O-N 3.33Å; Y926-A928 PolarHBondContact O-N 3.48Å; Y926-A928 VanDerWaalsContact O-N 3.14Å; A928-L1278 HydrophobicContact CB-CD1 3.78Å
929	V	76.5	Confident	71.8	Confident	36 Å²	36	86.3 Å²	86.3	22%	0.218	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-100.5	12.1	176.3	-58.8	0	0	0	0	113.3	Y926 T927 V931 L988 I991	Y926-V929 VanDerWaalsContact O-CG2 3.31Å; Y926-V929 WeakPolarHBondContact O-CG2 3.41Å; Y926-V929 PolarHBondContact O-N 3.49Å; T927-V929 VanDerWaalsContact C-N 3.29Å; T927-V929 PolarHBondContact O-N 3.49Å; V929-V931 HydrophobicContact CG2-CG2 3.9Å; V929-L988 HydrophobicContact CG1-CB 4.44Å; V929-L988 HydrophobicContact CG1-CD2 4.02Å; V929-L988 HydrophobicContact CG2-CD2 3.71Å; V929-I991 HydrophobicContact CB-CG2 4.32Å; V929-I991 HydrophobicContact CG2-CB 4.21Å; V929-I991 HydrophobicContact CG2-CD1 4.47Å; V929-I991 HydrophobicContact CG2-CG2 3.75Å
930	G	78.7	Confident	74.7	Confident	37 Å²	37	79.2 Å²	79.2	38%	0.381	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	102	-8.3	175.5	0	0	0	0	0	115.7	T927 T932	T927-G930 PolarHBondContact O-N 2.8Å; G930-T932 PolarHBondContact O-N 2.86Å
931	V	85.5	Confident	77.4	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.012	41%	0.405	C	S	.	.			trans	-61	126.9	-173.3	-171.9	0	0	0	0	111.6	Y926 V929 Y933 I991 E1008 E1010	Y926-V931 WeakPolarHBondContact O-CB 3.48Å; Y926-V931 WeakPolarHBondContact O-CG2 3.29Å; Y926-V931 PolarHBondContact O-N 2.82Å; V929-V931 HydrophobicContact CG2-CG2 3.9Å; V931-Y933 PolarHBondContact O-N 2.89Å; V931-I991 HydrophobicContact CG2-CD1 3.9Å; V931-I991 HydrophobicContact CG2-CG2 4.44Å; V931-E1008 HydrophobicContact CB-CG 4.18Å; V931-E1008 HydrophobicContact CG1-CG 4.23Å; V931-E1008 HydrophobicContact CG2-CG 3.71Å; V931-E1010 HydrophobicContact CG1-CB 3.74Å
932	T	90.9	Very high	80	Confident	75 Å²	75	70.2 Å²	70.2	46%	0.46	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	113.9	-178.7	-63.7	0	0	0	0	109.8	G930 V934 E1008 F1009 E1010	G930-T932 PolarHBondContact O-N 2.86Å; T932-V934 HydrophobicContact CG2-CG2 4.45Å; T932-E1008 PolarHBondContact N-O 2.83Å; T932-E1008 VanDerWaalsContact N-O 3.12Å; T932-F1009 HydrophobicContact CG2-CD1 4.2Å; T932-F1009 HydrophobicContact CG2-CE1 4.45Å; T932-F1009 CarbonylContact O-C 3.53Å; T932-F1009 VanDerWaalsContact O-CA 3.31Å; T932-F1009 WeakPolarHBondContact O-CA 3.36Å; T932-E1010 PolarHBondContact O-N 2.97Å
933	Y	91.3	Very high	82.5	Confident	117 Å²	117	66.6 Å²	66.6	46%	0.459	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.8	173.2	-171.8	-94.2	0	0	0	110.8	V931 E1010	V931-Y933 PolarHBondContact O-N 2.89Å; Y933-E1010 CarbonylContact C-O 3.58Å; Y933-E1010 WeakPolarHBondContact CA-O 3.31Å; Y933-E1010 HydrophobicContact CD2-CB 4.16Å; Y933-E1010 HydrophobicContact CD2-CG 3.83Å; Y933-E1010 HydrophobicContact CE2-CG 4.2Å
934	V	90.5	Very high	84.5	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	33%	0.326	C	S	.	.			trans	-122.9	111.3	-175.7	175.2	0	0	0	0	108.3	T932 D936 Y939 L940 F1009 E1010	T932-V934 HydrophobicContact CG2-CG2 4.45Å; V934-D936 WeakPolarHBondContact CG1-O 3.19Å; V934-Y939 HydrophobicContact CG1-CD1 3.69Å; V934-Y939 HydrophobicContact CG1-CG 3.88Å; V934-Y939 HydrophobicContact CG2-CD1 3.93Å; V934-Y939 HydrophobicContact CG2-CE1 4.24Å; V934-L940 HydrophobicContact CG1-CG 4.48Å; V934-F1009 HydrophobicContact CG2-CB 4.1Å; V934-F1009 HydrophobicContact CG2-CD1 3.76Å; V934-F1009 HydrophobicContact CG2-CG 4.31Å; V934-E1010 PolarHBondContact N-O 3.18Å
935	S	85.3	Confident	85.8	Confident	103 Å²	103	60.8 Å²	60.8	72%	0.72	34%	0.34	S	S	*	.			trans	-86.5	-31	-179.5	52.6	0	0	0	0	114	P937	S935-P937 WeakPolarHBondContact O-CD 3.3Å
936	D	85.2	Confident	86.6	Confident	58 Å²	58	59.6 Å²	59.6	31%	0.31	33%	0.329	S	S	.	.			trans	-77.3	114	174.3	171.1	18.8	0	0	0	109.7	V934 D938 Y939 K942	V934-D936 WeakPolarHBondContact CG1-O 3.19Å; D936-D938 PolarHBondContact O-N 3.16Å; D936-D938 PolarHBondContact OD1-N 2.95Å; D936-Y939 WeakPolarHBondContact O-CB 3.18Å; D936-Y939 PolarHBondContact O-N 2.75Å; D936-Y939 VanDerWaalsContact O-N 3.15Å; D936-Y939 PolarHBondContact OD2-N 2.59Å; D936-K942 IonicContact OD1-NZ 3.33Å; D936-K942 IonicContact OD2-NZ 3.26Å; D936-K942 PolarHBondContact OD2-NZ 3.25Å
937	P	72.4	Confident	87.1	Confident	108 Å²	108	60.5 Å²	60.5	70%	0.701	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.8	177.7	-23	34.7	0	0	0	112.9	S935	S935-P937 WeakPolarHBondContact O-CD 3.3Å
938	D	84.6	Confident	87.9	Confident	88 Å²	88	65.4 Å²	65.4	47%	0.471	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-7.8	-177.3	-73.2	-47.5	0	0	0	113.9	D936 L940 S941 K942	D936-D938 PolarHBondContact O-N 3.16Å; D936-D938 PolarHBondContact OD1-N 2.95Å; D938-L940 PolarHBondContact O-N 3.29Å; D938-S941 VanDerWaalsContact CA-OG 3.3Å; D938-S941 WeakPolarHBondContact CA-OG 3.3Å; D938-S941 PolarHBondContact O-N 3.09Å; D938-S941 VanDerWaalsContact O-N 3.09Å; D938-S941 PolarHBondContact O-OG 2.93Å; D938-S941 PolarHBondContact OD1-OG 2.81Å; D938-S941 VanDerWaalsContact OD1-OG 3.08Å; D938-K942 HydrophobicContact CB-CD 4.14Å; D938-K942 VanDerWaalsContact CB-CE 3.47Å; D938-K942 HydrophobicContact CB-CG 4.44Å; D938-K942 VanDerWaalsContact O-CB 3.27Å; D938-K942 WeakPolarHBondContact O-CB 3.46Å; D938-K942 VanDerWaalsContact O-CD 3.3Å; D938-K942 WeakPolarHBondContact O-CD 3.26Å; D938-K942 WeakPolarHBondContact O-CG 3.43Å; D938-K942 PolarHBondContact O-N 2.86Å
939	Y	91.1	Very high	88.8	Confident	89 Å²	89	68.1 Å²	68.1	35%	0.349	36%	0.358	S	S	.	.	H	α-helix	trans	-55.9	-40.1	177.1	175.3	-91.9	0	0	0	111.5	V934 D936 R943 F1009	V934-Y939 HydrophobicContact CG1-CD1 3.69Å; V934-Y939 HydrophobicContact CG1-CG 3.88Å; V934-Y939 HydrophobicContact CG2-CD1 3.93Å; V934-Y939 HydrophobicContact CG2-CE1 4.24Å; D936-Y939 WeakPolarHBondContact O-CB 3.18Å; D936-Y939 PolarHBondContact O-N 2.75Å; D936-Y939 VanDerWaalsContact O-N 3.15Å; D936-Y939 PolarHBondContact OD2-N 2.59Å; Y939-R943 WeakPolarHBondContact O-CB 3.13Å; Y939-R943 PolarHBondContact O-N 3.48Å; Y939-R943 PolarHBondContact OH-NH1 2.99Å; Y939-F1009 HydrophobicContact CE1-CD1 4.38Å; Y939-F1009 HydrophobicContact CE1-CE1 4.04Å
940	L	91.1	Very high	89.5	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-76	-30.8	178.7	-62.1	175.8	0	0	0	112.8	V934 D938 Y944 F1009 T1011 W1016	V934-L940 HydrophobicContact CG1-CG 4.48Å; D938-L940 PolarHBondContact O-N 3.29Å; L940-Y944 PolarHBondContact O-N 3.4Å; L940-F1009 HydrophobicContact CD2-CB 4.02Å; L940-F1009 HydrophobicContact CD2-CD1 4.33Å; L940-F1009 HydrophobicContact CD2-CD2 3.77Å; L940-F1009 HydrophobicContact CD2-CE2 4.34Å; L940-F1009 HydrophobicContact CD2-CG 3.78Å; L940-T1011 HydrophobicContact CD1-CG2 3.5Å; L940-W1016 HydrophobicContact CB-CH2 4.21Å; L940-W1016 HydrophobicContact CB-CZ3 4.17Å; L940-W1016 HydrophobicContact CD1-CD2 3.71Å; L940-W1016 HydrophobicContact CD1-CE3 4.08Å; L940-W1016 HydrophobicContact CD1-CG 3.97Å; L940-W1016 HydrophobicContact CD1-CZ2 4.2Å; L940-W1016 HydrophobicContact CD1-CZ3 4.46Å
941	S	89.4	Confident	89.8	Confident	40 Å²	40	69.1 Å²	69.1	28%	0.28	36%	0.359	S	S	.	.	H	α-helix	trans	-75.9	-34.7	176.1	72.7	0	0	0	0	112	D938 R964	D938-S941 VanDerWaalsContact CA-OG 3.3Å; D938-S941 WeakPolarHBondContact CA-OG 3.3Å; D938-S941 PolarHBondContact O-N 3.09Å; D938-S941 VanDerWaalsContact O-N 3.09Å; D938-S941 PolarHBondContact O-OG 2.93Å; D938-S941 PolarHBondContact OD1-OG 2.81Å; D938-S941 VanDerWaalsContact OD1-OG 3.08Å; S941-R964 PolarHBondContact O-NE 3.06Å; S941-R964 PolarHBondContact O-NH2 2.75Å
942	K	91.7	Very high	89.7	Confident	122 Å²	122	72.9 Å²	72.9	53%	0.53	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-42.7	168.2	-67.3	159.6	-170.9	157.4	0	110.9	D936 D938 R964	D936-K942 IonicContact OD1-NZ 3.33Å; D936-K942 IonicContact OD2-NZ 3.26Å; D936-K942 PolarHBondContact OD2-NZ 3.25Å; D938-K942 HydrophobicContact CB-CD 4.14Å; D938-K942 VanDerWaalsContact CB-CE 3.47Å; D938-K942 HydrophobicContact CB-CG 4.44Å; D938-K942 VanDerWaalsContact O-CB 3.27Å; D938-K942 WeakPolarHBondContact O-CB 3.46Å; D938-K942 VanDerWaalsContact O-CD 3.3Å; D938-K942 WeakPolarHBondContact O-CD 3.26Å; D938-K942 WeakPolarHBondContact O-CG 3.43Å; D938-K942 PolarHBondContact O-N 2.86Å; K942-R964 WeakPolarHBondContact O-CD 3.3Å; K942-R964 WeakPolarHBondContact O-CG 3.27Å; K942-R964 PolarHBondContact O-NE 2.9Å
943	R	94.4	Very high	88.9	Confident	51 Å²	51	71.3 Å²	71.3	19%	0.192	38%	0.378	C	S	.	.	H	α-helix	trans	-80	-37.1	-176.3	-169.2	170.4	179.2	158.5	1	114.9	Y939 R964 E1007	Y939-R943 WeakPolarHBondContact O-CB 3.13Å; Y939-R943 PolarHBondContact O-N 3.48Å; Y939-R943 PolarHBondContact OH-NH1 2.99Å; R943-R964 PolarHBondContact O-N 2.96Å; R943-E1007 IonicContact CZ-OE1 2.98Å; R943-E1007 IonicContact CZ-OE2 3.47Å; R943-E1007 IonicContact NE-OE2 2.86Å; R943-E1007 IonicContact NH1-OE1 3.91Å; R943-E1007 IonicContact NH2-OE1 3.8Å; R943-E1007 PolarHBondContact NH2-OE1 3.11Å; R943-E1007 IonicContact NH2-OE2 3.83Å; R943-E1007 PolarHBondContact NH2-OE2 2.85Å
944	Y	95.5	Very high	88.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.2	179.9	-53.8	-87.4	0	0	0	111.9	L940 I946 K962 R963 Y970 L972 E1007 F1009 V1018	L940-Y944 PolarHBondContact O-N 3.4Å; Y944-I946 PolarHBondContact O-N 2.75Å; Y944-K962 CarbonylContact C-O 3.59Å; Y944-K962 WeakPolarHBondContact CA-O 3.28Å; Y944-R963 HydrophobicContact CD1-CB 3.81Å; Y944-R963 HydrophobicContact CD1-CG 3.98Å; Y944-R963 HydrophobicContact CE1-CB 3.81Å; Y944-R963 HydrophobicContact CE1-CG 3.66Å; Y944-Y970 HydrophobicContact CE1-CD2 4.43Å; Y944-L972 HydrophobicContact CD1-CD2 4.43Å; Y944-E1007 PolarHBondContact OH-OE2 2.78Å; Y944-F1009 AromaticContact CE2-CE2 3.99Å; Y944-F1009 HydrophobicContact CE2-CE2 3.99Å; Y944-V1018 HydrophobicContact CE1-CG1 3.99Å; Y944-V1018 HydrophobicContact CE1-CG2 4.48Å; Y944-V1018 HydrophobicContact CE2-CG2 4.25Å
945	Q	95.7	Very high	87.5	Confident	100 Å²	100	73.6 Å²	73.6	47%	0.467	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.5	162	-176.9	-175.2	20.4	0	0	108.2	G961 K962 R964	Q945-G961 CarbonylContact O-C 3.46Å; Q945-G961 WeakPolarHBondContact O-CA 3.11Å; Q945-K962 HydrophobicContact CB-CB 4.27Å; Q945-K962 PolarHBondContact N-O 2.92Å; Q945-K962 PolarHBondContact O-N 3.04Å; Q945-R964 HydrophobicContact CB-CG 4.5Å
946	I	94.4	Very high	87.6	Confident	72 Å²	72	69.3 Å²	69.3	37%	0.369	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.2	-179.8	-50.4	169.3	0	0	0	109	Y944 K959 W1016	Y944-I946 PolarHBondContact O-N 2.75Å; I946-K959 HydrophobicContact CG2-CB 4.25Å; I946-K959 HydrophobicContact CG2-CD 3.39Å; I946-K959 HydrophobicContact CG2-CG 4.46Å; I946-W1016 HydrophobicContact CD1-CH2 3.74Å; I946-W1016 HydrophobicContact CD1-CZ3 4.49Å; I946-W1016 HydrophobicContact CG1-CH2 4.31Å
947	G	94.1	Very high	88	Confident	38 Å²	38	68.7 Å²	68.7	39%	0.392	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-157.2	177.9	0	0	0	0	0	113.6	L960	G947-L960 WeakPolarHBondContact CA-O 3.1Å; G947-L960 PolarHBondContact N-O 3.2Å
948	R	94.1	Very high	89	Confident	178 Å²	178	65.4 Å²	65.4	67%	0.672	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.9	149.6	-175.9	71.7	-175.3	-176.4	-153.9	1.6	113.4	L950 L960	R948-L950 HydrophobicContact CG-CD2 4.37Å; R948-L960 HydrophobicContact CG-CB 4.42Å; R948-L960 PolarHBondContact O-N 3.37Å
949	K	93.3	Very high	89.5	Confident	102 Å²	102	64.3 Å²	64.3	44%	0.443	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.1	169.5	-172.9	165.9	177.9	167.5	0	109.9	G951 D952 I957	K949-G951 VanDerWaalsContact CE-O 3.31Å; K949-G951 WeakPolarHBondContact CE-O 3.47Å; K949-D952 VanDerWaalsContact CE-OD1 3.26Å; K949-D952 WeakPolarHBondContact CE-OD1 3.22Å; K949-D952 WeakPolarHBondContact CE-OD2 3.5Å; K949-D952 IonicContact NZ-OD1 2.76Å; K949-D952 PolarHBondContact NZ-OD1 2.96Å; K949-D952 IonicContact NZ-OD2 3.08Å; K949-D952 PolarHBondContact NZ-OD2 3.42Å; K949-I957 HydrophobicContact CD-CG2 4.01Å; K949-I957 HydrophobicContact CG-CG2 4.08Å
950	L	89.8	Confident	89.7	Confident	68 Å²	68	61.4 Å²	61.4	36%	0.356	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-38.3	177.3	-61.9	175	0	0	0	111.4	R948 V958 L960 A971 F1021	R948-L950 HydrophobicContact CG-CD2 4.37Å; L950-V958 HydrophobicContact CB-CB 4.49Å; L950-V958 HydrophobicContact CB-CG1 4.21Å; L950-V958 HydrophobicContact CD1-CG1 4.38Å; L950-V958 PolarHBondContact N-O 2.97Å; L950-L960 HydrophobicContact CD1-CB 4.11Å; L950-L960 HydrophobicContact CD2-CB 4.31Å; L950-L960 HydrophobicContact CG-CB 4.21Å; L950-A971 HydrophobicContact CD1-CB 4.5Å; L950-F1021 HydrophobicContact CD1-CD2 3.71Å; L950-F1021 HydrophobicContact CD1-CE2 3.59Å; L950-F1021 HydrophobicContact CD2-CE2 3.94Å; L950-F1021 HydrophobicContact CG-CE2 4.44Å
951	G	84.7	Confident	90	Very high	27 Å²	27	61.2 Å²	61.2	28%	0.278	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	163.1	-174.9	0	0	0	0	0	113.7	K949 V958	K949-G951 VanDerWaalsContact CE-O 3.31Å; K949-G951 WeakPolarHBondContact CE-O 3.47Å; G951-V958 PolarHBondContact N-O 2.76Å; G951-V958 PolarHBondContact O-N 2.8Å; G951-V958 VanDerWaalsContact O-N 3.09Å
952	D	85.2	Confident	90.3	Very high	81 Å²	81	62.5 Å²	62.5	43%	0.433	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	102.6	-176.2	-151.6	18.3	0	0	0	111.4	K949	K949-D952 VanDerWaalsContact CE-OD1 3.26Å; K949-D952 WeakPolarHBondContact CE-OD1 3.22Å; K949-D952 WeakPolarHBondContact CE-OD2 3.5Å; K949-D952 IonicContact NZ-OD1 2.76Å; K949-D952 PolarHBondContact NZ-OD1 2.96Å; K949-D952 IonicContact NZ-OD2 3.08Å; K949-D952 PolarHBondContact NZ-OD2 3.42Å
953	G	73.3	Confident	90.5	Very high	41 Å²	41	59.3 Å²	59.3	42%	0.423	30%	0.304	S	S	.	.			trans	-111.9	166.2	178.1	0	0	0	0	0	112.5	F955 A956	G953-F955 PolarHBondContact O-N 2.78Å; G953-F955 VanDerWaalsContact O-N 3.09Å; G953-A956 PolarHBondContact N-O 3.38Å; G953-A956 PolarHBondContact O-N 2.68Å
954	N	73.5	Confident	90.5	Very high	92 Å²	92	63.2 Å²	63.2	49%	0.492	32%	0.319	S	S	.	.	S	Bend	trans	-59.1	-26.8	-175	-81.8	-35.3	0	0	0	114.6	Q111	Q111-N954 PolarHBondContact NE2-OD1 3.45Å
955	F	79.2	Confident	90.4	Very high	84 Å²	84	68 Å²	68	37%	0.368	35%	0.345	S	S	.	.	S	Bend	trans	-114.7	-20.2	-176.7	-50.1	-72.6	0	0	0	113.3	G953 I975 K979 K983	G953-F955 PolarHBondContact O-N 2.78Å; G953-F955 VanDerWaalsContact O-N 3.09Å; F955-I975 HydrophobicContact CB-CG2 4.45Å; F955-I975 WeakPolarHBondContact O-CG2 3.47Å; F955-K979 HydrophobicContact CD1-CB 4.18Å; F955-K979 WeakPolarHBondContact CD1-O 3.22Å; F955-K983 HydrophobicContact CE1-CD 4.22Å; F955-K983 HydrophobicContact CZ-CD 4.34Å
956	A	87.7	Confident	90.4	Very high	13 Å²	13	66.4 Å²	66.4	11%	0.107	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.4	-166.3	0	0	0	0	0	113	G953 K973 I974 I975	G953-A956 PolarHBondContact N-O 3.38Å; G953-A956 PolarHBondContact O-N 2.68Å; A956-K973 HydrophobicContact CB-CG 4.02Å; A956-I974 CarbonylContact C-O 3.54Å; A956-I974 WeakPolarHBondContact CA-O 3.47Å; A956-I975 HydrophobicContact CB-CB 4.33Å; A956-I975 HydrophobicContact CB-CG1 3.85Å; A956-I975 HydrophobicContact CB-CG2 4.27Å
957	I	91.8	Very high	90.3	Very high	45 Å²	45	67.4 Å²	67.4	23%	0.231	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.7	171.1	-65.3	174.4	0	0	0	107.9	K949 K959 I974	K949-I957 HydrophobicContact CD-CG2 4.01Å; K949-I957 HydrophobicContact CG-CG2 4.08Å; I957-K959 HydrophobicContact CG2-CG 3.97Å; I957-I974 PolarHBondContact N-O 3.39Å; I957-I974 PolarHBondContact O-N 2.94Å
958	V	93.7	Very high	90.4	Very high	40 Å²	40	69.6 Å²	69.6	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.1	172.9	-171.1	0	0	0	0	108.9	L950 G951 A971 L972 K973	L950-V958 HydrophobicContact CB-CB 4.49Å; L950-V958 HydrophobicContact CB-CG1 4.21Å; L950-V958 HydrophobicContact CD1-CG1 4.38Å; L950-V958 PolarHBondContact N-O 2.97Å; G951-V958 PolarHBondContact N-O 2.76Å; G951-V958 PolarHBondContact O-N 2.8Å; G951-V958 VanDerWaalsContact O-N 3.09Å; V958-A971 HydrophobicContact CG1-CB 4.15Å; V958-L972 CarbonylContact C-O 3.48Å; V958-L972 WeakPolarHBondContact CA-O 3.48Å; V958-K973 HydrophobicContact CG2-CB 4.21Å; V958-K973 HydrophobicContact CG2-CG 4.33Å
959	K	95.7	Very high	90.6	Very high	64 Å²	64	66.3 Å²	66.3	28%	0.278	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	155.8	174.8	-57.5	-177.2	-172.8	169.5	0	110.5	I946 I957 L972 I974	I946-K959 HydrophobicContact CG2-CB 4.25Å; I946-K959 HydrophobicContact CG2-CD 3.39Å; I946-K959 HydrophobicContact CG2-CG 4.46Å; I957-K959 HydrophobicContact CG2-CG 3.97Å; K959-L972 PolarHBondContact N-O 3.3Å; K959-L972 PolarHBondContact O-N 3.38Å; K959-I974 HydrophobicContact CD-CD1 4Å; K959-I974 HydrophobicContact CG-CD1 4.47Å
960	L	96.3	Very high	90.7	Very high	28 Å²	28	62.3 Å²	62.3	15%	0.147	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.8	161.8	-178.3	62.2	0	0	0	108.1	G947 R948 L950 Q969 F1021	G947-L960 WeakPolarHBondContact CA-O 3.1Å; G947-L960 PolarHBondContact N-O 3.2Å; R948-L960 HydrophobicContact CG-CB 4.42Å; R948-L960 PolarHBondContact O-N 3.37Å; L950-L960 HydrophobicContact CD1-CB 4.11Å; L950-L960 HydrophobicContact CD2-CB 4.31Å; L950-L960 HydrophobicContact CG-CB 4.21Å; L960-Q969 HydrophobicContact CD1-CB 4.21Å; L960-Q969 HydrophobicContact CD1-CG 4.47Å; L960-F1021 HydrophobicContact CD1-CD1 3.72Å; L960-F1021 HydrophobicContact CD1-CD2 3.94Å; L960-F1021 HydrophobicContact CD1-CE1 3.8Å; L960-F1021 HydrophobicContact CD1-CE2 4.04Å; L960-F1021 HydrophobicContact CD1-CG 3.8Å; L960-F1021 HydrophobicContact CD1-CZ 3.97Å
961	G	96.2	Very high	91.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147.8	167.8	0	0	0	0	0	110.2	Q945 Q969 Y970	Q945-G961 CarbonylContact O-C 3.46Å; Q945-G961 WeakPolarHBondContact O-CA 3.11Å; G961-Q969 WeakPolarHBondContact O-CA 3.38Å; G961-Y970 PolarHBondContact N-O 3.04Å; G961-Y970 PolarHBondContact O-N 3.34Å
962	K	96.8	Very high	91.6	Very high	67 Å²	67	58.5 Å²	58.5	29%	0.291	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.9	168.4	-160.1	-165.7	-166.2	-161.9	0	108.1	Y944 Q945 N967 D968	Y944-K962 CarbonylContact C-O 3.59Å; Y944-K962 WeakPolarHBondContact CA-O 3.28Å; Q945-K962 HydrophobicContact CB-CB 4.27Å; Q945-K962 PolarHBondContact N-O 2.92Å; Q945-K962 PolarHBondContact O-N 3.04Å; K962-N967 WeakPolarHBondContact CE-O 3.23Å; K962-N967 WeakPolarHBondContact CE-OD1 3.19Å; K962-N967 VanDerWaalsContact CG-O 3.26Å; K962-N967 WeakPolarHBondContact CG-O 3.34Å; K962-N967 PolarHBondContact NZ-OD1 3.29Å; K962-D968 CarbonylContact C-O 3.48Å; K962-D968 VanDerWaalsContact CA-O 3.29Å; K962-D968 WeakPolarHBondContact CA-O 3.29Å
963	R	95.8	Very high	92	Very high	54 Å²	54	55.5 Å²	55.5	20%	0.204	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.8	-179.8	-167.2	-173.2	148.5	159	-11.5	108.5	Y944 D965 T966 N967 D968 Y970 E1007	Y944-R963 HydrophobicContact CD1-CB 3.81Å; Y944-R963 HydrophobicContact CD1-CG 3.98Å; Y944-R963 HydrophobicContact CE1-CB 3.81Å; Y944-R963 HydrophobicContact CE1-CG 3.66Å; R963-D965 WeakPolarHBondContact CD-OD1 3.48Å; R963-D965 VanDerWaalsContact CG-OD1 3.23Å; R963-D965 WeakPolarHBondContact CG-OD1 3.3Å; R963-D965 IonicContact CZ-OD1 2.58Å; R963-D965 IonicContact CZ-OD2 3.55Å; R963-D965 VanDerWaalsContact CZ-OD2 3.27Å; R963-D965 VanDerWaalsContact NE-CG 3.31Å; R963-D965 IonicContact NE-OD1 3.29Å; R963-D965 PolarHBondContact NE-OD1 3.03Å; R963-D965 IonicContact NE-OD2 2.72Å; R963-D965 PolarHBondContact NE-OD2 3.17Å; R963-D965 IonicContact NH2-OD1 3.2Å; R963-D965 IonicContact NH2-OD2 3.45Å; R963-D965 PolarHBondContact NH2-OD2 3.46Å; R963-D965 PolarHBondContact O-N 2.92Å; R963-T966 WeakPolarHBondContact CD-OG1 3.4Å; R963-N967 VanDerWaalsContact O-CA 3.25Å; R963-N967 WeakPolarHBondContact O-CA 3.31Å; R963-N967 PolarHBondContact O-N 3.33Å; R963-D968 PolarHBondContact N-O 2.67Å; R963-Y970 HydrophobicContact CB-CD2 3.99Å; R963-Y970 HydrophobicContact CB-CE2 3.61Å; R963-Y970 HydrophobicContact CG-CE2 4.46Å; R963-E1007 IonicContact NH1-OE2 2.59Å; R963-E1007 PolarHBondContact NH1-OE2 3.03Å; R963-E1007 VanDerWaalsContact NH1-OE2 3.16Å
964	R	94.8	Very high	93	Very high	134 Å²	134	54 Å²	54	51%	0.506	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-29.7	-162.2	-65.1	-156.2	-166.1	-119.4	7.1	115	S941 K942 R943 Q945	S941-R964 PolarHBondContact O-NE 3.06Å; S941-R964 PolarHBondContact O-NH2 2.75Å; K942-R964 WeakPolarHBondContact O-CD 3.3Å; K942-R964 WeakPolarHBondContact O-CG 3.27Å; K942-R964 PolarHBondContact O-NE 2.9Å; R943-R964 PolarHBondContact O-N 2.96Å; Q945-R964 HydrophobicContact CB-CG 4.5Å
965	D	93.4	Very high	93.9	Very high	101 Å²	101	49.9 Å²	49.9	54%	0.54	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-32.6	-179.6	55.6	3.1	0	0	0	113.5	R963	R963-D965 WeakPolarHBondContact CD-OD1 3.48Å; R963-D965 VanDerWaalsContact CG-OD1 3.23Å; R963-D965 WeakPolarHBondContact CG-OD1 3.3Å; R963-D965 IonicContact CZ-OD1 2.58Å; R963-D965 IonicContact CZ-OD2 3.55Å; R963-D965 VanDerWaalsContact CZ-OD2 3.27Å; R963-D965 VanDerWaalsContact NE-CG 3.31Å; R963-D965 IonicContact NE-OD1 3.29Å; R963-D965 PolarHBondContact NE-OD1 3.03Å; R963-D965 IonicContact NE-OD2 2.72Å; R963-D965 PolarHBondContact NE-OD2 3.17Å; R963-D965 IonicContact NH2-OD1 3.2Å; R963-D965 IonicContact NH2-OD2 3.45Å; R963-D965 PolarHBondContact NH2-OD2 3.46Å; R963-D965 PolarHBondContact O-N 2.92Å
966	T	94.7	Very high	94.4	Very high	65 Å²	65	48.7 Å²	48.7	40%	0.399	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-16.2	-168.1	38.5	0	0	0	0	112.6	R963 D968	R963-T966 WeakPolarHBondContact CD-OG1 3.4Å; T966-D968 PolarHBondContact O-N 2.92Å; T966-D968 VanDerWaalsContact O-N 3.12Å
967	N	93.3	Very high	94.5	Very high	94 Å²	94	50.3 Å²	50.3	50%	0.503	24%	0.244	S	C	.	.			trans	60.4	6.5	-170.9	-75.1	-71.8	0	0	0	115.5	K962 R963	K962-N967 WeakPolarHBondContact CE-O 3.23Å; K962-N967 WeakPolarHBondContact CE-OD1 3.19Å; K962-N967 VanDerWaalsContact CG-O 3.26Å; K962-N967 WeakPolarHBondContact CG-O 3.34Å; K962-N967 PolarHBondContact NZ-OD1 3.29Å; R963-N967 VanDerWaalsContact O-CA 3.25Å; R963-N967 WeakPolarHBondContact O-CA 3.31Å; R963-N967 PolarHBondContact O-N 3.33Å
968	D	95.8	Very high	94.3	Very high	83 Å²	83	51.1 Å²	51.1	44%	0.444	25%	0.253	S	S	.	.			trans	-62.6	146.7	176.5	-82.9	-27.2	0	0	0	113	K962 R963 T966 Y970	K962-D968 CarbonylContact C-O 3.48Å; K962-D968 VanDerWaalsContact CA-O 3.29Å; K962-D968 WeakPolarHBondContact CA-O 3.29Å; R963-D968 PolarHBondContact N-O 2.67Å; T966-D968 PolarHBondContact O-N 2.92Å; T966-D968 VanDerWaalsContact O-N 3.12Å; D968-Y970 HydrophobicContact CB-CD2 4.3Å; D968-Y970 HydrophobicContact CB-CE2 3.38Å; D968-Y970 WeakPolarHBondContact O-CD2 3.43Å; D968-Y970 PolarHBondContact OD2-OH 2.85Å
969	Q	96.8	Very high	93.8	Very high	109 Å²	109	51.9 Å²	51.9	51%	0.509	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.4	-180	-67.6	-175	-5	0	0	112.8	L960 G961 F1021	L960-Q969 HydrophobicContact CD1-CB 4.21Å; L960-Q969 HydrophobicContact CD1-CG 4.47Å; G961-Q969 WeakPolarHBondContact O-CA 3.38Å; Q969-F1021 HydrophobicContact CB-CB 4.37Å; Q969-F1021 HydrophobicContact CB-CD1 3.85Å; Q969-F1021 HydrophobicContact CB-CG 4.47Å
970	Y	97	Very high	93.1	Very high	19 Å²	19	49.4 Å²	49.4	8%	0.075	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	153.7	-177	-63.1	-87.8	0	0	0	111.5	Y944 G961 R963 D968 Y1006 V1018 M1019	Y944-Y970 HydrophobicContact CE1-CD2 4.43Å; G961-Y970 PolarHBondContact N-O 3.04Å; G961-Y970 PolarHBondContact O-N 3.34Å; R963-Y970 HydrophobicContact CB-CD2 3.99Å; R963-Y970 HydrophobicContact CB-CE2 3.61Å; R963-Y970 HydrophobicContact CG-CE2 4.46Å; D968-Y970 HydrophobicContact CB-CD2 4.3Å; D968-Y970 HydrophobicContact CB-CE2 3.38Å; D968-Y970 WeakPolarHBondContact O-CD2 3.43Å; D968-Y970 PolarHBondContact OD2-OH 2.85Å; Y970-Y1006 HydrophobicContact CD1-CD2 4.11Å; Y970-Y1006 HydrophobicContact CD1-CE2 4.47Å; Y970-Y1006 HydrophobicContact CD1-CG 4.39Å; Y970-Y1006 HydrophobicContact CE1-CD1 4.11Å; Y970-Y1006 AromaticContact CE1-CD2 3.96Å; Y970-Y1006 HydrophobicContact CE1-CD2 3.96Å; Y970-Y1006 HydrophobicContact CE1-CE1 4.36Å; Y970-Y1006 HydrophobicContact CE1-CE2 4.24Å; Y970-Y1006 AromaticContact CE1-CG 3.89Å; Y970-Y1006 HydrophobicContact CE1-CG 3.89Å; Y970-V1018 HydrophobicContact CD1-CG1 3.63Å; Y970-V1018 HydrophobicContact CE1-CG1 4.36Å; Y970-V1018 HydrophobicContact CG-CG1 3.73Å; Y970-M1019 CarbonylContact C-O 3.56Å; Y970-M1019 WeakPolarHBondContact CA-O 3.46Å
971	A	96.6	Very high	92.2	Very high	13 Å²	13	51 Å²	51	11%	0.107	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.6	167.4	0	0	0	0	0	108.9	L950 V958 M1019	L950-A971 HydrophobicContact CD1-CB 4.5Å; V958-A971 HydrophobicContact CG1-CB 4.15Å; A971-M1019 HydrophobicContact CB-CB 4.34Å; A971-M1019 PolarHBondContact N-O 2.64Å; A971-M1019 WeakPolarHBondContact O-CB 3.49Å; A971-M1019 PolarHBondContact O-N 3.26Å
972	L	95.6	Very high	91.2	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	99.9	179.5	-55.3	179.8	0	0	0	109.1	Y944 V958 K959 I974 W1016 V1018	Y944-L972 HydrophobicContact CD1-CD2 4.43Å; V958-L972 CarbonylContact C-O 3.48Å; V958-L972 WeakPolarHBondContact CA-O 3.48Å; K959-L972 PolarHBondContact N-O 3.3Å; K959-L972 PolarHBondContact O-N 3.38Å; L972-I974 HydrophobicContact CB-CG1 4.36Å; L972-I974 PolarHBondContact O-N 3.37Å; L972-W1016 HydrophobicContact CD1-CE3 4.44Å; L972-W1016 HydrophobicContact CD1-CZ3 3.99Å; L972-V1018 HydrophobicContact CD2-CB 4.37Å; L972-V1018 HydrophobicContact CD2-CG1 4.09Å; L972-V1018 HydrophobicContact CD2-CG2 3.95Å
973	K	94.5	Very high	90.3	Very high	18 Å²	18	53.6 Å²	53.6	8%	0.078	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	97.1	173.1	176.1	173.9	167.5	-178.4	0	108	A956 V958 I975 E990 L1017 M1019 D1087	A956-K973 HydrophobicContact CB-CG 4.02Å; V958-K973 HydrophobicContact CG2-CB 4.21Å; V958-K973 HydrophobicContact CG2-CG 4.33Å; K973-I975 HydrophobicContact CG-CD1 4.4Å; K973-I975 HydrophobicContact CG-CG1 4.25Å; K973-E990 IonicContact NZ-OE1 3.82Å; K973-E990 PolarHBondContact NZ-OE1 3.49Å; K973-E990 IonicContact NZ-OE2 2.81Å; K973-E990 PolarHBondContact NZ-OE2 3.13Å; K973-L1017 HydrophobicContact CB-CB 4.26Å; K973-L1017 HydrophobicContact CD-CD1 4.31Å; K973-L1017 PolarHBondContact N-O 2.81Å; K973-L1017 PolarHBondContact O-N 3.12Å; K973-M1019 HydrophobicContact CB-SD 4.08Å; K973-M1019 HydrophobicContact CD-SD 4.14Å; K973-D1087 IonicContact NZ-OD1 2.77Å; K973-D1087 PolarHBondContact NZ-OD1 3.49Å
974	I	93.8	Very high	89.7	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.6	-177.3	-56.8	171.9	0	0	0	108.7	A956 I957 K959 L972 E1014 W1016	A956-I974 CarbonylContact C-O 3.54Å; A956-I974 WeakPolarHBondContact CA-O 3.47Å; I957-I974 PolarHBondContact N-O 3.39Å; I957-I974 PolarHBondContact O-N 2.94Å; K959-I974 HydrophobicContact CD-CD1 4Å; K959-I974 HydrophobicContact CG-CD1 4.47Å; L972-I974 HydrophobicContact CB-CG1 4.36Å; L972-I974 PolarHBondContact O-N 3.37Å; I974-E1014 HydrophobicContact CG2-CB 4.31Å; I974-E1014 HydrophobicContact CG2-CG 4.25Å; I974-W1016 HydrophobicContact CD1-CD2 4.2Å; I974-W1016 HydrophobicContact CD1-CE3 4.29Å; I974-W1016 HydrophobicContact CD1-CH2 3.89Å; I974-W1016 HydrophobicContact CD1-CZ2 3.76Å; I974-W1016 HydrophobicContact CD1-CZ3 4.16Å; I974-W1016 HydrophobicContact CG1-CD2 3.83Å; I974-W1016 HydrophobicContact CG1-CE3 4.15Å; I974-W1016 HydrophobicContact CG1-CG 4.23Å; I974-W1016 HydrophobicContact CG1-CZ2 4.25Å
975	I	91.8	Very high	88.7	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.2	-170.4	-38.9	-177.4	0	0	0	109.2	F955 A956 K973 K977 L980 L987 E1014 I1015 L1017	F955-I975 HydrophobicContact CB-CG2 4.45Å; F955-I975 WeakPolarHBondContact O-CG2 3.47Å; A956-I975 HydrophobicContact CB-CB 4.33Å; A956-I975 HydrophobicContact CB-CG1 3.85Å; A956-I975 HydrophobicContact CB-CG2 4.27Å; K973-I975 HydrophobicContact CG-CD1 4.4Å; K973-I975 HydrophobicContact CG-CG1 4.25Å; I975-K977 PolarHBondContact O-N 2.98Å; I975-L980 HydrophobicContact CB-CD1 4.42Å; I975-L980 HydrophobicContact CG2-CD1 3.74Å; I975-L980 HydrophobicContact CG2-CD2 3.91Å; I975-L980 HydrophobicContact CG2-CG 3.8Å; I975-L987 HydrophobicContact CD1-CD1 3.55Å; I975-L987 HydrophobicContact CD1-CD2 3.94Å; I975-L987 HydrophobicContact CD1-CG 4.43Å; I975-E1014 CarbonylContact O-C 3.53Å; I975-E1014 VanDerWaalsContact O-CA 3.27Å; I975-E1014 WeakPolarHBondContact O-CA 3.34Å; I975-I1015 PolarHBondContact N-O 3.33Å; I975-I1015 PolarHBondContact O-N 3.41Å; I975-L1017 HydrophobicContact CD1-CD1 4.15Å; I975-L1017 HydrophobicContact CD1-CG 4.32Å
976	E	90.5	Very high	87.9	Confident	60 Å²	60	49.7 Å²	49.7	28%	0.28	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	126.1	177.1	-68.1	165.1	-134	0	0	110.6	S978 K979 L980	E976-S978 PolarHBondContact O-N 3.19Å; E976-S978 PolarHBondContact OE2-OG 3.04Å; E976-K979 HydrophobicContact CB-CB 4.25Å; E976-K979 HydrophobicContact CB-CD 4.04Å; E976-K979 HydrophobicContact CB-CG 4.02Å; E976-K979 HydrophobicContact CG-CD 4.32Å; E976-K979 WeakPolarHBondContact O-CB 3.31Å; E976-K979 PolarHBondContact O-N 3.36Å; E976-K979 WeakPolarHBondContact OE1-CE 3.29Å; E976-K979 IonicContact OE1-NZ 2.63Å; E976-K979 PolarHBondContact OE1-NZ 2.82Å; E976-K979 WeakPolarHBondContact OE2-CD 3.45Å; E976-K979 WeakPolarHBondContact OE2-CE 3.47Å; E976-K979 IonicContact OE2-NZ 2.67Å; E976-L980 PolarHBondContact O-N 3.4Å
977	K	89.4	Confident	87.5	Confident	46 Å²	46	46.9 Å²	46.9	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-31.5	172.3	-65.2	-177.4	-172	-179.6	0	112.3	I975 K979 L980 T981 E1010 T1011 A1012 S1013 E1014 I1015	I975-K977 PolarHBondContact O-N 2.98Å; K977-K979 PolarHBondContact O-N 3.37Å; K977-K979 VanDerWaalsContact O-N 3.13Å; K977-L980 PolarHBondContact O-N 3.49Å; K977-L980 VanDerWaalsContact O-N 3.11Å; K977-T981 PolarHBondContact O-OG1 2.87Å; K977-E1010 VanDerWaalsContact CE-CG 3.43Å; K977-E1010 VanDerWaalsContact CE-OE1 3.24Å; K977-E1010 WeakPolarHBondContact CE-OE1 3.16Å; K977-E1010 IonicContact NZ-OE1 3.98Å; K977-E1010 PolarHBondContact NZ-OE1 2.86Å; K977-T1011 WeakPolarHBondContact CE-O 3.5Å; K977-T1011 PolarHBondContact NZ-O 3.14Å; K977-A1012 PolarHBondContact NZ-O 3.45Å; K977-S1013 WeakPolarHBondContact CB-O 3.37Å; K977-S1013 WeakPolarHBondContact CG-O 3.2Å; K977-S1013 PolarHBondContact N-O 3.25Å; K977-E1014 WeakPolarHBondContact CE-O 3.32Å; K977-I1015 HydrophobicContact CG-CD1 4.33Å; K977-I1015 HydrophobicContact CG-CG1 4.24Å
978	S	87.8	Confident	87.1	Confident	62 Å²	62	43.9 Å²	43.9	43%	0.434	24%	0.242	S	C	.	.	H	α-helix	trans	-55.8	-28.2	173.1	99.3	0	0	0	0	113	K50 E976	K50-S978 WeakPolarHBondContact CD-O 3.45Å; K50-S978 WeakPolarHBondContact CE-O 3.41Å; K50-S978 VanDerWaalsContact NZ-C 3.31Å; K50-S978 PolarHBondContact NZ-O 3.11Å; K50-S978 PolarHBondContact NZ-OG 3.39Å; K50-S978 VanDerWaalsContact NZ-OG 3.08Å; E976-S978 PolarHBondContact O-N 3.19Å; E976-S978 PolarHBondContact OE2-OG 3.04Å
979	K	83.2	Confident	86.5	Confident	56 Å²	56	41.8 Å²	41.8	24%	0.243	23%	0.231	C	C	.	.	H	α-helix	trans	-95.4	-16	-177.8	-68.3	176.8	172.8	165.3	0	112.7	F955 E976 K977	F955-K979 HydrophobicContact CD1-CB 4.18Å; F955-K979 WeakPolarHBondContact CD1-O 3.22Å; E976-K979 HydrophobicContact CB-CB 4.25Å; E976-K979 HydrophobicContact CB-CD 4.04Å; E976-K979 HydrophobicContact CB-CG 4.02Å; E976-K979 HydrophobicContact CG-CD 4.32Å; E976-K979 WeakPolarHBondContact O-CB 3.31Å; E976-K979 PolarHBondContact O-N 3.36Å; E976-K979 WeakPolarHBondContact OE1-CE 3.29Å; E976-K979 IonicContact OE1-NZ 2.63Å; E976-K979 PolarHBondContact OE1-NZ 2.82Å; E976-K979 WeakPolarHBondContact OE2-CD 3.45Å; E976-K979 WeakPolarHBondContact OE2-CE 3.47Å; E976-K979 IonicContact OE2-NZ 2.67Å; K977-K979 PolarHBondContact O-N 3.37Å; K977-K979 VanDerWaalsContact O-N 3.13Å
980	L	82.3	Confident	86	Confident	12 Å²	12	37 Å²	37	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-86.9	-7.9	-178.8	-73.8	168.6	0	0	0	114.6	I975 E976 K977 G982 K983 E984 L987 I1015	I975-L980 HydrophobicContact CB-CD1 4.42Å; I975-L980 HydrophobicContact CG2-CD1 3.74Å; I975-L980 HydrophobicContact CG2-CD2 3.91Å; I975-L980 HydrophobicContact CG2-CG 3.8Å; E976-L980 PolarHBondContact O-N 3.4Å; K977-L980 PolarHBondContact O-N 3.49Å; K977-L980 VanDerWaalsContact O-N 3.11Å; L980-G982 PolarHBondContact O-N 3.44Å; L980-K983 CarbonylContact O-C 3.57Å; L980-K983 WeakPolarHBondContact O-CA 3.35Å; L980-K983 WeakPolarHBondContact O-CB 3.49Å; L980-K983 PolarHBondContact O-N 3Å; L980-E984 PolarHBondContact O-N 3.35Å; L980-L987 HydrophobicContact CD1-CD2 3.44Å; L980-L987 VanDerWaalsContact CD1-CD2 3.44Å; L980-L987 HydrophobicContact CD2-CB 4.13Å; L980-L987 HydrophobicContact CD2-CD2 3.98Å; L980-L987 HydrophobicContact CG-CD2 4.38Å; L980-I1015 HydrophobicContact CD1-CD1 3.79Å
981	T	77	Confident	85.6	Confident	63 Å²	63	36.1 Å²	36.1	39%	0.387	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	120.5	-169.2	-33.1	0	0	0	0	112	H51 K977 E984	H51-T981 PolarHBondContact CE1-O 2.82Å; H51-T981 VanDerWaalsContact CE1-O 3.24Å; H51-T981 VanDerWaalsContact NE2-CG2 3.33Å; H51-T981 WeakPolarHBondContact NE2-CG2 3.5Å; K977-T981 PolarHBondContact O-OG1 2.87Å; T981-E984 VanDerWaalsContact CA-OE1 3.27Å; T981-E984 WeakPolarHBondContact CA-OE1 3.37Å
982	G	75	Confident	85.1	Confident	36 Å²	36	39.1 Å²	39.1	37%	0.371	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	9	-172.4	0	0	0	0	0	115.2	L980 E984	L980-G982 PolarHBondContact O-N 3.44Å; G982-E984 VanDerWaalsContact C-OE2 3.3Å; G982-E984 WeakPolarHBondContact CA-OE2 3.14Å; G982-E984 VanDerWaalsContact N-CD 3.27Å; G982-E984 PolarHBondContact N-OE1 2.9Å; G982-E984 PolarHBondContact N-OE2 3.21Å
983	K	76.6	Confident	84.7	Confident	85 Å²	85	39.2 Å²	39.2	37%	0.37	22%	0.217	S	C	.	.			trans	-133.7	9.9	178.5	-60.6	-169.9	178	-171.2	0	113	F955 L980 A985 M986	F955-K983 HydrophobicContact CE1-CD 4.22Å; F955-K983 HydrophobicContact CZ-CD 4.34Å; L980-K983 CarbonylContact O-C 3.57Å; L980-K983 WeakPolarHBondContact O-CA 3.35Å; L980-K983 WeakPolarHBondContact O-CB 3.49Å; L980-K983 PolarHBondContact O-N 3Å; K983-A985 PolarHBondContact O-N 2.97Å; K983-M986 HydrophobicContact CB-SD 4.13Å; K983-M986 HydrophobicContact CD-SD 4.23Å; K983-M986 HydrophobicContact CG-SD 4.27Å; K983-M986 VanDerWaalsContact O-CB 3.32Å; K983-M986 WeakPolarHBondContact O-CB 3.5Å; K983-M986 PolarHBondContact O-N 2.99Å
984	E	83	Confident	84.5	Confident	55 Å²	55	38.6 Å²	38.6	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-56	-39.5	-176.3	-56.8	85.4	169	0	0	111.4	Y926 L980 T981 G982 M986 L987 L988	Y926-E984 VanDerWaalsContact OH-CG 3.3Å; Y926-E984 WeakPolarHBondContact OH-CG 3.34Å; L980-E984 PolarHBondContact O-N 3.35Å; T981-E984 VanDerWaalsContact CA-OE1 3.27Å; T981-E984 WeakPolarHBondContact CA-OE1 3.37Å; G982-E984 VanDerWaalsContact C-OE2 3.3Å; G982-E984 WeakPolarHBondContact CA-OE2 3.14Å; G982-E984 VanDerWaalsContact N-CD 3.27Å; G982-E984 PolarHBondContact N-OE1 2.9Å; G982-E984 PolarHBondContact N-OE2 3.21Å; E984-M986 PolarHBondContact O-N 3.34Å; E984-L987 PolarHBondContact O-N 2.84Å; E984-L987 VanDerWaalsContact O-N 3.14Å; E984-L988 WeakPolarHBondContact O-CG 3.49Å; E984-L988 PolarHBondContact O-N 3.32Å
985	A	75.3	Confident	84.2	Confident	73 Å²	73	41 Å²	41	60%	0.603	23%	0.225	S	C	*	.	H	α-helix	trans	-59.2	-29.9	175.4	0	0	0	0	0	114	K983 N989	K983-A985 PolarHBondContact O-N 2.97Å; A985-N989 VanDerWaalsContact O-CB 3.28Å; A985-N989 WeakPolarHBondContact O-CB 3.47Å; A985-N989 PolarHBondContact O-N 3.28Å; A985-N989 VanDerWaalsContact O-N 3.16Å
986	M	76.4	Confident	83.8	Confident	79 Å²	79	46.1 Å²	46.1	39%	0.389	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-43.7	175.6	-59.7	178.9	63.6	0	0	110.8	K983 E984 N989 E990 L1090	K983-M986 HydrophobicContact CB-SD 4.13Å; K983-M986 HydrophobicContact CD-SD 4.23Å; K983-M986 HydrophobicContact CG-SD 4.27Å; K983-M986 VanDerWaalsContact O-CB 3.32Å; K983-M986 WeakPolarHBondContact O-CB 3.5Å; K983-M986 PolarHBondContact O-N 2.99Å; E984-M986 PolarHBondContact O-N 3.34Å; M986-N989 PolarHBondContact O-N 2.91Å; M986-E990 PolarHBondContact O-N 2.93Å; M986-L1090 HydrophobicContact CE-CD2 3.57Å
987	L	85.1	Confident	83.7	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-71.2	-40.3	178.9	178.3	59.7	0	0	0	112.3	Y926 I975 L980 E984 N989 E990 I991 I1015 L1017	Y926-L987 HydrophobicContact CE1-CD2 4.04Å; Y926-L987 HydrophobicContact CE1-CG 4.46Å; I975-L987 HydrophobicContact CD1-CD1 3.55Å; I975-L987 HydrophobicContact CD1-CD2 3.94Å; I975-L987 HydrophobicContact CD1-CG 4.43Å; L980-L987 HydrophobicContact CD1-CD2 3.44Å; L980-L987 VanDerWaalsContact CD1-CD2 3.44Å; L980-L987 HydrophobicContact CD2-CB 4.13Å; L980-L987 HydrophobicContact CD2-CD2 3.98Å; L980-L987 HydrophobicContact CG-CD2 4.38Å; E984-L987 PolarHBondContact O-N 2.84Å; E984-L987 VanDerWaalsContact O-N 3.14Å; L987-N989 PolarHBondContact O-N 2.94Å; L987-E990 PolarHBondContact O-N 2.9Å; L987-I991 HydrophobicContact CD1-CD1 3.91Å; L987-I991 HydrophobicContact CD1-CG1 4Å; L987-I991 HydrophobicContact CG-CD1 3.84Å; L987-I991 HydrophobicContact CG-CG1 4.38Å; L987-I991 WeakPolarHBondContact O-CG1 3.29Å; L987-I991 PolarHBondContact O-N 2.96Å; L987-I1015 HydrophobicContact CD2-CB 4.35Å; L987-I1015 HydrophobicContact CD2-CD1 3.59Å; L987-I1015 HydrophobicContact CD2-CG2 4.17Å; L987-L1017 HydrophobicContact CD1-CD1 4.21Å
988	L	85.4	Confident	83.8	Confident	32 Å²	32	50.3 Å²	50.3	17%	0.168	26%	0.262	C	S	.	.	H	α-helix	trans	-57.7	-40.2	173.9	-68.8	166.7	0	0	0	111.1	V925 Y926 V929 E984 H992	V925-L988 HydrophobicContact CG1-CD1 3.76Å; Y926-L988 HydrophobicContact CD1-CD2 3.52Å; Y926-L988 HydrophobicContact CD1-CG 4.14Å; Y926-L988 HydrophobicContact CE1-CD2 4.06Å; Y926-L988 HydrophobicContact CE1-CG 4.17Å; Y926-L988 HydrophobicContact CG-CD2 4.3Å; V929-L988 HydrophobicContact CG1-CB 4.44Å; V929-L988 HydrophobicContact CG1-CD2 4.02Å; V929-L988 HydrophobicContact CG2-CD2 3.71Å; E984-L988 WeakPolarHBondContact O-CG 3.49Å; E984-L988 PolarHBondContact O-N 3.32Å; L988-H992 VanDerWaalsContact O-CB 3.24Å; L988-H992 WeakPolarHBondContact O-CB 3.28Å; L988-H992 PolarHBondContact O-N 3.49Å
989	N	82.7	Confident	84.1	Confident	38 Å²	38	49 Å²	49	20%	0.203	25%	0.249	C	C	.	.	H	α-helix	trans	-72.5	-38.2	175.2	171.1	87.9	0	0	0	113	A985 M986 L987 H992 I993 A1091	A985-N989 VanDerWaalsContact O-CB 3.28Å; A985-N989 WeakPolarHBondContact O-CB 3.47Å; A985-N989 PolarHBondContact O-N 3.28Å; A985-N989 VanDerWaalsContact O-N 3.16Å; M986-N989 PolarHBondContact O-N 2.91Å; L987-N989 PolarHBondContact O-N 2.94Å; N989-H992 PolarHBondContact O-N 3.42Å; N989-I993 WeakPolarHBondContact O-CB 3.49Å; N989-I993 VanDerWaalsContact O-CG1 3.32Å; N989-I993 WeakPolarHBondContact O-CG1 3.38Å; N989-I993 PolarHBondContact O-N 2.87Å; N989-A1091 PolarHBondContact ND2-O 2.69Å
990	E	87.3	Confident	84.7	Confident	9 Å²	9	50.5 Å²	50.5	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-50.5	171.5	177.8	174.5	-170.5	0	0	111	K973 M986 L987 H992 I993 L994 F1088 G1089	K973-E990 IonicContact NZ-OE1 3.82Å; K973-E990 PolarHBondContact NZ-OE1 3.49Å; K973-E990 IonicContact NZ-OE2 2.81Å; K973-E990 PolarHBondContact NZ-OE2 3.13Å; M986-E990 PolarHBondContact O-N 2.93Å; L987-E990 PolarHBondContact O-N 2.9Å; E990-H992 PolarHBondContact O-N 3.18Å; E990-I993 PolarHBondContact O-N 2.87Å; E990-L994 HydrophobicContact CG-CD1 3.79Å; E990-L994 HydrophobicContact CG-CG 4.37Å; E990-L994 WeakPolarHBondContact O-CB 3.31Å; E990-L994 WeakPolarHBondContact O-CG 3.06Å; E990-L994 PolarHBondContact O-N 2.97Å; E990-F1088 HydrophobicContact CG-CB 4.08Å; E990-G1089 WeakPolarHBondContact OE2-CA 3.08Å
991	I	87.8	Confident	85.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-45.3	178.4	-66.8	167.4	0	0	0	110.8	V929 V931 L987 I993 L994 H995 E1008 L1017	V929-I991 HydrophobicContact CB-CG2 4.32Å; V929-I991 HydrophobicContact CG2-CB 4.21Å; V929-I991 HydrophobicContact CG2-CD1 4.47Å; V929-I991 HydrophobicContact CG2-CG2 3.75Å; V931-I991 HydrophobicContact CG2-CD1 3.9Å; V931-I991 HydrophobicContact CG2-CG2 4.44Å; L987-I991 HydrophobicContact CD1-CD1 3.91Å; L987-I991 HydrophobicContact CD1-CG1 4Å; L987-I991 HydrophobicContact CG-CD1 3.84Å; L987-I991 HydrophobicContact CG-CG1 4.38Å; L987-I991 WeakPolarHBondContact O-CG1 3.29Å; L987-I991 PolarHBondContact O-N 2.96Å; I991-I993 PolarHBondContact O-N 3.22Å; I991-L994 PolarHBondContact O-N 3.33Å; I991-H995 PolarHBondContact O-N 3.48Å; I991-E1008 HydrophobicContact CG2-CG 4.29Å; I991-L1017 HydrophobicContact CD1-CD2 3.94Å; I991-L1017 HydrophobicContact CG1-CD1 4.46Å; I991-L1017 HydrophobicContact CG1-CD2 3.83Å
992	H	87	Confident	86.3	Confident	77 Å²	77	47.4 Å²	47.4	36%	0.356	25%	0.246	S	C	.	.	H	α-helix	trans	-60.4	-43.3	177.2	178.5	79.2	0	0	0	112.4	L988 N989 E990 H996	L988-H992 VanDerWaalsContact O-CB 3.24Å; L988-H992 WeakPolarHBondContact O-CB 3.28Å; L988-H992 PolarHBondContact O-N 3.49Å; N989-H992 PolarHBondContact O-N 3.42Å; E990-H992 PolarHBondContact O-N 3.18Å; H992-H996 AromaticContact CE1-CE1 3.58Å; H992-H996 AromaticContact CE1-ND1 3.9Å; H992-H996 AromaticContact ND1-CE1 3.75Å; H992-H996 PolarHBondContact O-ND1 3.39Å
993	I	87.7	Confident	87.3	Confident	3 Å²	3	46 Å²	46	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-47.2	177.1	-73.4	169.9	0	0	0	110.6	N989 E990 I991 H995 H996 C997 I1061 F1088 A1091	N989-I993 WeakPolarHBondContact O-CB 3.49Å; N989-I993 VanDerWaalsContact O-CG1 3.32Å; N989-I993 WeakPolarHBondContact O-CG1 3.38Å; N989-I993 PolarHBondContact O-N 2.87Å; E990-I993 PolarHBondContact O-N 2.87Å; I991-I993 PolarHBondContact O-N 3.22Å; I993-H995 PolarHBondContact O-N 2.88Å; I993-H996 PolarHBondContact O-N 3.49Å; I993-C997 PolarHBondContact O-N 2.7Å; I993-C997 VanDerWaalsContact O-N 3.13Å; I993-C997 PolarHBondContact O-SG 2.81Å; I993-I1061 HydrophobicContact CD1-CG2 4.26Å; I993-I1061 HydrophobicContact CG2-CD1 4.26Å; I993-I1061 HydrophobicContact CG2-CG2 4.26Å; I993-F1088 HydrophobicContact CG2-CD1 3.68Å; I993-F1088 HydrophobicContact CG2-CE1 4.28Å; I993-F1088 HydrophobicContact CG2-CG 4.48Å; I993-A1091 HydrophobicContact CD1-CB 3.8Å; I993-A1091 HydrophobicContact CG2-CB 4.47Å
994	L	89.2	Confident	88.2	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-40.2	-178.8	-74.9	173	0	0	0	112.8	E990 I991 H996 C997 L1005 M1019 F1088	E990-L994 HydrophobicContact CG-CD1 3.79Å; E990-L994 HydrophobicContact CG-CG 4.37Å; E990-L994 WeakPolarHBondContact O-CB 3.31Å; E990-L994 WeakPolarHBondContact O-CG 3.06Å; E990-L994 PolarHBondContact O-N 2.97Å; I991-L994 PolarHBondContact O-N 3.33Å; L994-H996 PolarHBondContact O-N 2.81Å; L994-C997 PolarHBondContact O-N 2.98Å; L994-C997 VanDerWaalsContact O-N 3.11Å; L994-L1005 HydrophobicContact CB-CB 3.9Å; L994-L1005 HydrophobicContact CB-CD2 3.86Å; L994-L1005 HydrophobicContact CD1-CB 4.49Å; L994-L1005 HydrophobicContact CD1-CD2 4.48Å; L994-M1019 HydrophobicContact CD1-CE 3.93Å; L994-M1019 HydrophobicContact CD2-CE 4.34Å; L994-F1088 HydrophobicContact CD2-CB 4.17Å; L994-F1088 HydrophobicContact CD2-CD2 3.69Å; L994-F1088 HydrophobicContact CD2-CE2 4.31Å; L994-F1088 HydrophobicContact CD2-CG 3.95Å; L994-F1088 HydrophobicContact CG-CB 4.25Å; L994-F1088 HydrophobicContact CG-CG 4.5Å
995	H	87.2	Confident	88.7	Confident	61 Å²	61	45.5 Å²	45.5	28%	0.282	22%	0.224	S	C	.	.	H	α-helix	trans	-56.8	-36.4	175.5	-98.2	-52.3	0	0	0	113.7	I991 I993 E1008	I991-H995 PolarHBondContact O-N 3.48Å; I993-H995 PolarHBondContact O-N 2.88Å; H995-E1008 IonicContact CD2-OE1 3.74Å; H995-E1008 IonicContact CE1-OE1 2.76Å; H995-E1008 PolarHBondContact CE1-OE1 3.06Å; H995-E1008 IonicContact CE1-OE2 2.65Å; H995-E1008 PolarHBondContact CE1-OE2 3.18Å; H995-E1008 VanDerWaalsContact CE1-OE2 3.27Å; H995-E1008 IonicContact NE2-OE1 3.66Å; H995-E1008 PolarHBondContact NE2-OE1 3.02Å; H995-E1008 IonicContact NE2-OE2 3.1Å; H995-E1008 PolarHBondContact NE2-OE2 3.38Å
996	H	84.4	Confident	89.6	Confident	112 Å²	112	46.6 Å²	46.6	52%	0.519	21%	0.213	S	C	.	.	H	α-helix	trans	-92.5	-3.2	-178.9	-60.6	91.6	0	0	0	113.1	H992 I993 L994 Y1055	H992-H996 AromaticContact CE1-CE1 3.58Å; H992-H996 AromaticContact CE1-ND1 3.9Å; H992-H996 AromaticContact ND1-CE1 3.75Å; H992-H996 PolarHBondContact O-ND1 3.39Å; I993-H996 PolarHBondContact O-N 3.49Å; L994-H996 PolarHBondContact O-N 2.81Å; H996-Y1055 PolarHBondContact O-OH 2.85Å; H996-Y1055 VanDerWaalsContact O-OH 3.14Å
997	C	88.7	Confident	90.3	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.041	20%	0.204	C	C	.	.			trans	-91.9	108.4	177.7	-74.3	0	0	0	0	112.1	I993 L994 I1002 Y1055	I993-C997 PolarHBondContact O-N 2.7Å; I993-C997 VanDerWaalsContact O-N 3.13Å; I993-C997 PolarHBondContact O-SG 2.81Å; L994-C997 PolarHBondContact O-N 2.98Å; L994-C997 VanDerWaalsContact O-N 3.11Å; C997-I1002 HydrophobicContact CB-CG2 4.28Å; C997-Y1055 HydrophobicContact CB-CE1 4.46Å
998	R	90.5	Very high	90.7	Very high	189 Å²	189	45.3 Å²	45.3	71%	0.713	21%	0.206	S	C	*	.			trans	-128.5	94.1	172.4	-62.9	-176.2	-174.9	-176.6	1.8	109.1	Y1055	R998-Y1055 PolarHBondContact N-OH 2.87Å; R998-Y1055 VanDerWaalsContact O-CE2 3.24Å; R998-Y1055 WeakPolarHBondContact O-CE2 3.3Å; R998-Y1055 PolarHBondContact O-OH 2.84Å
999	H	94.8	Very high	91.1	Very high	33 Å²	33	44 Å²	44	15%	0.153	20%	0.199	C	C	.	.			trans	-147.4	138.8	-177.2	-169.8	-103	0	0	0	110.3	N1001 I1002 S1051 A1052 Y1055	H999-N1001 PolarHBondContact CE1-OD1 2.87Å; H999-N1001 PolarHBondContact ND1-N 2.76Å; H999-N1001 PolarHBondContact O-N 2.8Å; H999-I1002 HydrophobicContact CB-CB 4.13Å; H999-I1002 HydrophobicContact CB-CD1 3.81Å; H999-I1002 HydrophobicContact CB-CG1 3.93Å; H999-I1002 PolarHBondContact O-N 3.47Å; H999-I1002 VanDerWaalsContact O-N 3.13Å; H999-S1051 VanDerWaalsContact CE1-C 3.46Å; H999-S1051 PolarHBondContact CE1-OG 3Å; H999-S1051 VanDerWaalsContact CE1-OG 3.27Å; H999-S1051 PolarHBondContact NE2-OG 2.73Å; H999-A1052 PolarHBondContact CE1-N 2.81Å; H999-Y1055 HydrophobicContact CB-CD1 4.05Å; H999-Y1055 HydrophobicContact CB-CD2 3.98Å; H999-Y1055 HydrophobicContact CB-CE1 4.25Å; H999-Y1055 HydrophobicContact CB-CE2 4.15Å; H999-Y1055 HydrophobicContact CB-CG 3.92Å; H999-Y1055 AromaticContact CD2-CD2 3.49Å; H999-Y1055 VanDerWaalsContact CD2-CD2 3.49Å; H999-Y1055 WeakPolarHBondContact CD2-CD2 3.45Å; H999-Y1055 AromaticContact CD2-CG 3.67Å; H999-Y1055 AromaticContact CG-CD2 3.97Å; H999-Y1055 AromaticContact CG-CG 3.85Å
1000	P	95.4	Very high	91.7	Very high	89 Å²	89	42.6 Å²	42.6	58%	0.578	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-33.6	-179.2	21.4	-34.5	0	0	0	113.5	K1084	P1000-K1084 WeakPolarHBondContact O-CE 3.31Å; P1000-K1084 VanDerWaalsContact O-CG 3.32Å; P1000-K1084 WeakPolarHBondContact O-CG 3.15Å; P1000-K1084 PolarHBondContact O-NZ 3.32Å
1001	N	97.2	Very high	91.9	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	22.6	-179.9	-53.1	102.3	0	0	0	113.9	H999 D1048 A1052 V1083 K1084 L1085	H999-N1001 PolarHBondContact CE1-OD1 2.87Å; H999-N1001 PolarHBondContact ND1-N 2.76Å; H999-N1001 PolarHBondContact O-N 2.8Å; N1001-D1048 HydrophobicContact CB-CB 4.49Å; N1001-D1048 VanDerWaalsContact CB-O 3.32Å; N1001-D1048 WeakPolarHBondContact CB-O 3.4Å; N1001-D1048 VanDerWaalsContact ND2-CB 3.34Å; N1001-D1048 WeakPolarHBondContact ND2-CB 3.49Å; N1001-D1048 PolarHBondContact ND2-OD1 2.89Å; N1001-D1048 PolarHBondContact ND2-OD2 2.8Å; N1001-A1052 HydrophobicContact CB-CB 4.01Å; N1001-V1083 PolarHBondContact ND2-O 2.76Å; N1001-K1084 WeakPolarHBondContact O-CA 3.46Å; N1001-L1085 PolarHBondContact O-N 2.84Å
1002	I	96.4	Very high	92	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-123.2	144.7	170	-63.7	177.6	0	0	0	108.3	C997 H999 R1004 A1052 Y1055 L1056 K1084 F1088	C997-I1002 HydrophobicContact CB-CG2 4.28Å; H999-I1002 HydrophobicContact CB-CB 4.13Å; H999-I1002 HydrophobicContact CB-CD1 3.81Å; H999-I1002 HydrophobicContact CB-CG1 3.93Å; H999-I1002 PolarHBondContact O-N 3.47Å; H999-I1002 VanDerWaalsContact O-N 3.13Å; I1002-R1004 PolarHBondContact O-N 2.87Å; I1002-A1052 HydrophobicContact CG1-CB 4.04Å; I1002-Y1055 HydrophobicContact CD1-CD1 3.86Å; I1002-Y1055 HydrophobicContact CD1-CE1 4.31Å; I1002-L1056 HydrophobicContact CD1-CD1 4.17Å; I1002-L1056 HydrophobicContact CD1-CD2 3.94Å; I1002-L1056 HydrophobicContact CD1-CG 3.95Å; I1002-K1084 PolarHBondContact O-NZ 2.92Å; I1002-F1088 HydrophobicContact CD1-CZ 4.18Å; I1002-F1088 HydrophobicContact CG1-CZ 4.32Å; I1002-F1088 HydrophobicContact CG2-CE2 3.7Å; I1002-F1088 HydrophobicContact CG2-CZ 3.65Å
1003	V	95.7	Very high	92.1	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.03	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-69.7	122.3	171.8	171.4	0	0	0	0	109.6	M1019 E1020 I1022 L1072 K1084 L1085 A1086	V1003-M1019 HydrophobicContact CG1-CB 4.14Å; V1003-M1019 HydrophobicContact CG1-CE 3.95Å; V1003-E1020 HydrophobicContact CG1-CB 4.03Å; V1003-I1022 HydrophobicContact CG2-CG1 4.27Å; V1003-L1072 HydrophobicContact CG2-CD1 3.87Å; V1003-K1084 HydrophobicContact CG2-CB 3.96Å; V1003-L1085 PolarHBondContact N-O 3.35Å; V1003-A1086 HydrophobicContact CB-CB 4.37Å; V1003-A1086 HydrophobicContact CG2-CB 3.72Å
1004	R	94.5	Very high	92.3	Very high	117 Å²	117	49 Å²	49	44%	0.442	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-76.2	135.4	-179.7	178.8	167.3	-179	170	-3	112.5	I1002 Y1006 M1019 E1020	I1002-R1004 PolarHBondContact O-N 2.87Å; R1004-Y1006 HydrophobicContact CB-CD2 4.46Å; R1004-Y1006 HydrophobicContact CB-CE2 3.95Å; R1004-Y1006 HydrophobicContact CG-CD2 4.09Å; R1004-Y1006 HydrophobicContact CG-CE2 3.89Å; R1004-M1019 CarbonylContact O-C 3.58Å; R1004-M1019 VanDerWaalsContact O-CA 3.32Å; R1004-M1019 WeakPolarHBondContact O-CA 3.35Å; R1004-E1020 HydrophobicContact CB-CB 4.31Å; R1004-E1020 PolarHBondContact N-OE2 3.43Å; R1004-E1020 PolarHBondContact O-N 2.76Å
1005	L	94.1	Very high	92.5	Very high	14 Å²	14	48.8 Å²	48.8	7%	0.073	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.3	157.3	-179	66.6	0	0	0	108.9	L994 L1017 M1019	L994-L1005 HydrophobicContact CB-CB 3.9Å; L994-L1005 HydrophobicContact CB-CD2 3.86Å; L994-L1005 HydrophobicContact CD1-CB 4.49Å; L994-L1005 HydrophobicContact CD1-CD2 4.48Å; L1005-L1017 HydrophobicContact CD1-CB 3.91Å; L1005-M1019 HydrophobicContact CD1-CG 4.08Å
1006	Y	93.1	Very high	92.8	Very high	95 Å²	95	46.6 Å²	46.6	37%	0.373	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-51.4	178	-72.8	-97.6	0	0	0	111.8	Y970 R1004 V1018 E1020	Y970-Y1006 HydrophobicContact CD1-CD2 4.11Å; Y970-Y1006 HydrophobicContact CD1-CE2 4.47Å; Y970-Y1006 HydrophobicContact CD1-CG 4.39Å; Y970-Y1006 HydrophobicContact CE1-CD1 4.11Å; Y970-Y1006 AromaticContact CE1-CD2 3.96Å; Y970-Y1006 HydrophobicContact CE1-CD2 3.96Å; Y970-Y1006 HydrophobicContact CE1-CE1 4.36Å; Y970-Y1006 HydrophobicContact CE1-CE2 4.24Å; Y970-Y1006 AromaticContact CE1-CG 3.89Å; Y970-Y1006 HydrophobicContact CE1-CG 3.89Å; R1004-Y1006 HydrophobicContact CB-CD2 4.46Å; R1004-Y1006 HydrophobicContact CB-CE2 3.95Å; R1004-Y1006 HydrophobicContact CG-CD2 4.09Å; R1004-Y1006 HydrophobicContact CG-CE2 3.89Å; Y1006-V1018 PolarHBondContact N-O 3.06Å; Y1006-E1020 HydrophobicContact CE2-CB 3.86Å; Y1006-E1020 HydrophobicContact CE2-CG 4.27Å
1007	E	92.7	Very high	93.3	Very high	43 Å²	43	41.3 Å²	41.3	20%	0.201	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	152.7	-173.3	-46	-166.7	75.3	0	0	109.8	R943 Y944 R963 F1009 V1018	R943-E1007 IonicContact CZ-OE1 2.98Å; R943-E1007 IonicContact CZ-OE2 3.47Å; R943-E1007 IonicContact NE-OE2 2.86Å; R943-E1007 IonicContact NH1-OE1 3.91Å; R943-E1007 IonicContact NH2-OE1 3.8Å; R943-E1007 PolarHBondContact NH2-OE1 3.11Å; R943-E1007 IonicContact NH2-OE2 3.83Å; R943-E1007 PolarHBondContact NH2-OE2 2.85Å; Y944-E1007 PolarHBondContact OH-OE2 2.78Å; R963-E1007 IonicContact NH1-OE2 2.59Å; R963-E1007 PolarHBondContact NH1-OE2 3.03Å; R963-E1007 VanDerWaalsContact NH1-OE2 3.16Å; E1007-F1009 HydrophobicContact CB-CE2 3.79Å; E1007-F1009 HydrophobicContact CB-CZ 3.98Å; E1007-V1018 HydrophobicContact CB-CB 4.14Å; E1007-V1018 HydrophobicContact CB-CG2 4.28Å; E1007-V1018 PolarHBondContact N-O 2.63Å; E1007-V1018 VanDerWaalsContact O-CB 3.31Å; E1007-V1018 WeakPolarHBondContact O-CB 3.34Å; E1007-V1018 PolarHBondContact O-N 2.9Å
1008	E	93.5	Very high	93.6	Very high	14 Å²	14	41 Å²	41	7%	0.065	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	131.8	178.1	70.6	-67.7	163.9	0	0	112.8	V931 T932 I991 H995 W1016 L1017	V931-E1008 HydrophobicContact CB-CG 4.18Å; V931-E1008 HydrophobicContact CG1-CG 4.23Å; V931-E1008 HydrophobicContact CG2-CG 3.71Å; T932-E1008 PolarHBondContact N-O 2.83Å; T932-E1008 VanDerWaalsContact N-O 3.12Å; I991-E1008 HydrophobicContact CG2-CG 4.29Å; H995-E1008 IonicContact CD2-OE1 3.74Å; H995-E1008 IonicContact CE1-OE1 2.76Å; H995-E1008 PolarHBondContact CE1-OE1 3.06Å; H995-E1008 IonicContact CE1-OE2 2.65Å; H995-E1008 PolarHBondContact CE1-OE2 3.18Å; H995-E1008 VanDerWaalsContact CE1-OE2 3.27Å; H995-E1008 IonicContact NE2-OE1 3.66Å; H995-E1008 PolarHBondContact NE2-OE1 3.02Å; H995-E1008 IonicContact NE2-OE2 3.1Å; H995-E1008 PolarHBondContact NE2-OE2 3.38Å; E1008-W1016 VanDerWaalsContact CA-O 3.29Å; E1008-W1016 WeakPolarHBondContact CA-O 3.39Å; E1008-L1017 HydrophobicContact CB-CD2 3.71Å
1009	F	94	Very high	93.9	Very high	5 Å²	5	32.6 Å²	32.6	2%	0.022	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	154.8	-172	-55.1	-80.2	0	0	0	111.6	T932 V934 Y939 L940 Y944 E1007 I1015 W1016 V1018	T932-F1009 HydrophobicContact CG2-CD1 4.2Å; T932-F1009 HydrophobicContact CG2-CE1 4.45Å; T932-F1009 CarbonylContact O-C 3.53Å; T932-F1009 VanDerWaalsContact O-CA 3.31Å; T932-F1009 WeakPolarHBondContact O-CA 3.36Å; V934-F1009 HydrophobicContact CG2-CB 4.1Å; V934-F1009 HydrophobicContact CG2-CD1 3.76Å; V934-F1009 HydrophobicContact CG2-CG 4.31Å; Y939-F1009 HydrophobicContact CE1-CD1 4.38Å; Y939-F1009 HydrophobicContact CE1-CE1 4.04Å; L940-F1009 HydrophobicContact CD2-CB 4.02Å; L940-F1009 HydrophobicContact CD2-CD1 4.33Å; L940-F1009 HydrophobicContact CD2-CD2 3.77Å; L940-F1009 HydrophobicContact CD2-CE2 4.34Å; L940-F1009 HydrophobicContact CD2-CG 3.78Å; Y944-F1009 AromaticContact CE2-CE2 3.99Å; Y944-F1009 HydrophobicContact CE2-CE2 3.99Å; E1007-F1009 HydrophobicContact CB-CE2 3.79Å; E1007-F1009 HydrophobicContact CB-CZ 3.98Å; F1009-I1015 CarbonylContact O-C 3.55Å; F1009-I1015 WeakPolarHBondContact O-CA 3.24Å; F1009-W1016 HydrophobicContact CB-CB 4.35Å; F1009-W1016 PolarHBondContact N-O 2.81Å; F1009-W1016 PolarHBondContact O-N 3.43Å; F1009-V1018 HydrophobicContact CD2-CG2 4.12Å; F1009-V1018 HydrophobicContact CE2-CG2 3.92Å
1010	E	93.6	Very high	93.9	Very high	8 Å²	8	32.9 Å²	32.9	4%	0.037	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.8	176	178.6	-176.4	-174.3	0	0	109.9	S924 Y926 V931 T932 Y933 V934 K977 I1015	S924-E1010 WeakPolarHBondContact CB-OE2 3.35Å; S924-E1010 PolarHBondContact OG-OE1 3.47Å; S924-E1010 VanDerWaalsContact OG-OE1 3.06Å; S924-E1010 PolarHBondContact OG-OE2 3.46Å; Y926-E1010 WeakPolarHBondContact CD2-OE1 3.44Å; V931-E1010 HydrophobicContact CG1-CB 3.74Å; T932-E1010 PolarHBondContact O-N 2.97Å; Y933-E1010 CarbonylContact C-O 3.58Å; Y933-E1010 WeakPolarHBondContact CA-O 3.31Å; Y933-E1010 HydrophobicContact CD2-CB 4.16Å; Y933-E1010 HydrophobicContact CD2-CG 3.83Å; Y933-E1010 HydrophobicContact CE2-CG 4.2Å; V934-E1010 PolarHBondContact N-O 3.18Å; K977-E1010 VanDerWaalsContact CE-CG 3.43Å; K977-E1010 VanDerWaalsContact CE-OE1 3.24Å; K977-E1010 WeakPolarHBondContact CE-OE1 3.16Å; K977-E1010 IonicContact NZ-OE1 3.98Å; K977-E1010 PolarHBondContact NZ-OE1 2.86Å; E1010-I1015 HydrophobicContact CB-CG1 4.47Å; E1010-I1015 HydrophobicContact CG-CG1 4.18Å
1011	T	91.7	Very high	93.9	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.086	16%	0.156	C	C	.	.			trans	-97	-176.8	170.1	70.6	0	0	0	0	109.8	L940 K977 S1013 E1014	L940-T1011 HydrophobicContact CD1-CG2 3.5Å; K977-T1011 WeakPolarHBondContact CE-O 3.5Å; K977-T1011 PolarHBondContact NZ-O 3.14Å; T1011-S1013 VanDerWaalsContact C-N 3.26Å; T1011-S1013 PolarHBondContact O-N 2.84Å; T1011-S1013 PolarHBondContact OG1-N 3.37Å; T1011-E1014 PolarHBondContact N-O 2.85Å; T1011-E1014 PolarHBondContact OG1-N 2.9Å; T1011-E1014 PolarHBondContact OG1-O 2.89Å
1012	A	90	Very high	93.8	Very high	79 Å²	79	30.7 Å²	30.7	65%	0.653	16%	0.158	S	C	*	.	S	Bend	trans	-56.3	-39.4	173.5	0	0	0	0	0	113	K977	K977-A1012 PolarHBondContact NZ-O 3.45Å
1013	S	89.2	Confident	93.5	Very high	74 Å²	74	37.1 Å²	37.1	52%	0.517	19%	0.186	S	C	.	.	S	Bend	trans	-109.2	-21.1	-169.9	49.6	0	0	0	0	115.3	K977 T1011	K977-S1013 WeakPolarHBondContact CB-O 3.37Å; K977-S1013 WeakPolarHBondContact CG-O 3.2Å; K977-S1013 PolarHBondContact N-O 3.25Å; T1011-S1013 VanDerWaalsContact C-N 3.26Å; T1011-S1013 PolarHBondContact O-N 2.84Å; T1011-S1013 PolarHBondContact OG1-N 3.37Å
1014	E	92.6	Very high	93.2	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.262	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	164.1	-168.6	-62.2	179.1	149.6	0	0	112.7	I974 I975 K977 T1011 W1016	I974-E1014 HydrophobicContact CG2-CB 4.31Å; I974-E1014 HydrophobicContact CG2-CG 4.25Å; I975-E1014 CarbonylContact O-C 3.53Å; I975-E1014 VanDerWaalsContact O-CA 3.27Å; I975-E1014 WeakPolarHBondContact O-CA 3.34Å; K977-E1014 WeakPolarHBondContact CE-O 3.32Å; T1011-E1014 PolarHBondContact N-O 2.85Å; T1011-E1014 PolarHBondContact OG1-N 2.9Å; T1011-E1014 PolarHBondContact OG1-O 2.89Å; E1014-W1016 PolarHBondContact OE2-NE1 2.87Å
1015	I	92.5	Very high	93	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.8	167.2	-62.4	166.7	0	0	0	107.5	Y926 I975 K977 L980 L987 F1009 E1010 L1017	Y926-I1015 HydrophobicContact CD1-CD1 3.72Å; Y926-I1015 HydrophobicContact CD2-CD1 3.75Å; Y926-I1015 HydrophobicContact CE1-CD1 3.48Å; Y926-I1015 VanDerWaalsContact CE1-CD1 3.48Å; Y926-I1015 HydrophobicContact CE2-CD1 3.51Å; Y926-I1015 HydrophobicContact CG-CD1 3.86Å; I975-I1015 PolarHBondContact N-O 3.33Å; I975-I1015 PolarHBondContact O-N 3.41Å; K977-I1015 HydrophobicContact CG-CD1 4.33Å; K977-I1015 HydrophobicContact CG-CG1 4.24Å; L980-I1015 HydrophobicContact CD1-CD1 3.79Å; L987-I1015 HydrophobicContact CD2-CB 4.35Å; L987-I1015 HydrophobicContact CD2-CD1 3.59Å; L987-I1015 HydrophobicContact CD2-CG2 4.17Å; F1009-I1015 CarbonylContact O-C 3.55Å; F1009-I1015 WeakPolarHBondContact O-CA 3.24Å; E1010-I1015 HydrophobicContact CB-CG1 4.47Å; E1010-I1015 HydrophobicContact CG-CG1 4.18Å; I1015-L1017 HydrophobicContact CG2-CD2 4.26Å
1016	W	94.5	Very high	93	Very high	16 Å²	16	36.8 Å²	36.8	6%	0.061	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.7	-173.1	-74.8	50.5	0	0	0	109.1	L940 I946 L972 I974 E1008 F1009 E1014	L940-W1016 HydrophobicContact CB-CH2 4.21Å; L940-W1016 HydrophobicContact CB-CZ3 4.17Å; L940-W1016 HydrophobicContact CD1-CD2 3.71Å; L940-W1016 HydrophobicContact CD1-CE3 4.08Å; L940-W1016 HydrophobicContact CD1-CG 3.97Å; L940-W1016 HydrophobicContact CD1-CZ2 4.2Å; L940-W1016 HydrophobicContact CD1-CZ3 4.46Å; I946-W1016 HydrophobicContact CD1-CH2 3.74Å; I946-W1016 HydrophobicContact CD1-CZ3 4.49Å; I946-W1016 HydrophobicContact CG1-CH2 4.31Å; L972-W1016 HydrophobicContact CD1-CE3 4.44Å; L972-W1016 HydrophobicContact CD1-CZ3 3.99Å; I974-W1016 HydrophobicContact CD1-CD2 4.2Å; I974-W1016 HydrophobicContact CD1-CE3 4.29Å; I974-W1016 HydrophobicContact CD1-CH2 3.89Å; I974-W1016 HydrophobicContact CD1-CZ2 3.76Å; I974-W1016 HydrophobicContact CD1-CZ3 4.16Å; I974-W1016 HydrophobicContact CG1-CD2 3.83Å; I974-W1016 HydrophobicContact CG1-CE3 4.15Å; I974-W1016 HydrophobicContact CG1-CG 4.23Å; I974-W1016 HydrophobicContact CG1-CZ2 4.25Å; E1008-W1016 VanDerWaalsContact CA-O 3.29Å; E1008-W1016 WeakPolarHBondContact CA-O 3.39Å; F1009-W1016 HydrophobicContact CB-CB 4.35Å; F1009-W1016 PolarHBondContact N-O 2.81Å; F1009-W1016 PolarHBondContact O-N 3.43Å; E1014-W1016 PolarHBondContact OE2-NE1 2.87Å
1017	L	94.5	Very high	93	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.9	170.9	-49.6	-176.3	0	0	0	108.9	K973 I975 L987 I991 L1005 E1008 I1015 M1019	K973-L1017 HydrophobicContact CB-CB 4.26Å; K973-L1017 HydrophobicContact CD-CD1 4.31Å; K973-L1017 PolarHBondContact N-O 2.81Å; K973-L1017 PolarHBondContact O-N 3.12Å; I975-L1017 HydrophobicContact CD1-CD1 4.15Å; I975-L1017 HydrophobicContact CD1-CG 4.32Å; L987-L1017 HydrophobicContact CD1-CD1 4.21Å; I991-L1017 HydrophobicContact CD1-CD2 3.94Å; I991-L1017 HydrophobicContact CG1-CD1 4.46Å; I991-L1017 HydrophobicContact CG1-CD2 3.83Å; L1005-L1017 HydrophobicContact CD1-CB 3.91Å; E1008-L1017 HydrophobicContact CB-CD2 3.71Å; I1015-L1017 HydrophobicContact CG2-CD2 4.26Å; L1017-M1019 HydrophobicContact CB-CG 4.12Å; L1017-M1019 HydrophobicContact CB-SD 4.24Å
1018	V	95.5	Very high	92.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	103.6	178.9	-174.8	0	0	0	0	108.3	Y944 Y970 L972 Y1006 E1007 F1009	Y944-V1018 HydrophobicContact CE1-CG1 3.99Å; Y944-V1018 HydrophobicContact CE1-CG2 4.48Å; Y944-V1018 HydrophobicContact CE2-CG2 4.25Å; Y970-V1018 HydrophobicContact CD1-CG1 3.63Å; Y970-V1018 HydrophobicContact CE1-CG1 4.36Å; Y970-V1018 HydrophobicContact CG-CG1 3.73Å; L972-V1018 HydrophobicContact CD2-CB 4.37Å; L972-V1018 HydrophobicContact CD2-CG1 4.09Å; L972-V1018 HydrophobicContact CD2-CG2 3.95Å; Y1006-V1018 PolarHBondContact N-O 3.06Å; E1007-V1018 HydrophobicContact CB-CB 4.14Å; E1007-V1018 HydrophobicContact CB-CG2 4.28Å; E1007-V1018 PolarHBondContact N-O 2.63Å; E1007-V1018 VanDerWaalsContact O-CB 3.31Å; E1007-V1018 WeakPolarHBondContact O-CB 3.34Å; E1007-V1018 PolarHBondContact O-N 2.9Å; F1009-V1018 HydrophobicContact CD2-CG2 4.12Å; F1009-V1018 HydrophobicContact CE2-CG2 3.92Å
1019	M	96	Very high	92.4	Very high	13 Å²	13	33.3 Å²	33.3	6%	0.064	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	163.5	-169.6	-54.2	-179.5	76.2	0	0	111.6	Y970 A971 K973 L994 V1003 R1004 L1005 L1017 F1021	Y970-M1019 CarbonylContact C-O 3.56Å; Y970-M1019 WeakPolarHBondContact CA-O 3.46Å; A971-M1019 HydrophobicContact CB-CB 4.34Å; A971-M1019 PolarHBondContact N-O 2.64Å; A971-M1019 WeakPolarHBondContact O-CB 3.49Å; A971-M1019 PolarHBondContact O-N 3.26Å; K973-M1019 HydrophobicContact CB-SD 4.08Å; K973-M1019 HydrophobicContact CD-SD 4.14Å; L994-M1019 HydrophobicContact CD1-CE 3.93Å; L994-M1019 HydrophobicContact CD2-CE 4.34Å; V1003-M1019 HydrophobicContact CG1-CB 4.14Å; V1003-M1019 HydrophobicContact CG1-CE 3.95Å; R1004-M1019 CarbonylContact O-C 3.58Å; R1004-M1019 VanDerWaalsContact O-CA 3.32Å; R1004-M1019 WeakPolarHBondContact O-CA 3.35Å; L1005-M1019 HydrophobicContact CD1-CG 4.08Å; L1017-M1019 HydrophobicContact CB-CG 4.12Å; L1017-M1019 HydrophobicContact CB-SD 4.24Å; M1019-F1021 PolarHBondContact O-N 3Å
1020	E	95.6	Very high	91.9	Very high	38 Å²	38	33.4 Å²	33.4	18%	0.178	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	124.5	175.4	-161.7	179.2	171.9	0	0	111.8	V1003 R1004 Y1006 I1022 K1084	V1003-E1020 HydrophobicContact CG1-CB 4.03Å; R1004-E1020 HydrophobicContact CB-CB 4.31Å; R1004-E1020 PolarHBondContact N-OE2 3.43Å; R1004-E1020 PolarHBondContact O-N 2.76Å; Y1006-E1020 HydrophobicContact CE2-CB 3.86Å; Y1006-E1020 HydrophobicContact CE2-CG 4.27Å; E1020-I1022 HydrophobicContact CG-CD1 3.91Å; E1020-I1022 PolarHBondContact O-N 3.47Å; E1020-K1084 WeakPolarHBondContact OE1-CE 3.2Å; E1020-K1084 IonicContact OE1-NZ 3.2Å; E1020-K1084 PolarHBondContact OE1-NZ 2.85Å; E1020-K1084 IonicContact OE2-NZ 3.95Å; E1020-K1084 PolarHBondContact OE2-NZ 2.87Å
1021	F	95.4	Very high	91.5	Very high	37 Å²	37	33.5 Å²	33.5	16%	0.162	19%	0.192	C	C	.	.			trans	-82.2	118.5	175.6	177	-125.1	0	0	0	111.4	L950 L960 Q969 M1019 K1023	L950-F1021 HydrophobicContact CD1-CD2 3.71Å; L950-F1021 HydrophobicContact CD1-CE2 3.59Å; L950-F1021 HydrophobicContact CD2-CE2 3.94Å; L950-F1021 HydrophobicContact CG-CE2 4.44Å; L960-F1021 HydrophobicContact CD1-CD1 3.72Å; L960-F1021 HydrophobicContact CD1-CD2 3.94Å; L960-F1021 HydrophobicContact CD1-CE1 3.8Å; L960-F1021 HydrophobicContact CD1-CE2 4.04Å; L960-F1021 HydrophobicContact CD1-CG 3.8Å; L960-F1021 HydrophobicContact CD1-CZ 3.97Å; Q969-F1021 HydrophobicContact CB-CB 4.37Å; Q969-F1021 HydrophobicContact CB-CD1 3.85Å; Q969-F1021 HydrophobicContact CB-CG 4.47Å; M1019-F1021 PolarHBondContact O-N 3Å; F1021-K1023 HydrophobicContact CE1-CB 3.88Å; F1021-K1023 HydrophobicContact CZ-CB 4.08Å
1022	I	94.2	Very high	91	Very high	14 Å²	14	33.4 Å²	33.4	7%	0.072	19%	0.191	C	C	.	.			trans	-105.1	118.8	174.8	-49.1	-54.7	0	0	0	109	V1003 E1020 L1072 L1073 L1074 K1084	V1003-I1022 HydrophobicContact CG2-CG1 4.27Å; E1020-I1022 HydrophobicContact CG-CD1 3.91Å; E1020-I1022 PolarHBondContact O-N 3.47Å; I1022-L1072 HydrophobicContact CB-CB 3.79Å; I1022-L1072 HydrophobicContact CB-CD1 3.83Å; I1022-L1072 HydrophobicContact CB-CG 4.45Å; I1022-L1072 HydrophobicContact CG1-CB 4.03Å; I1022-L1072 HydrophobicContact CG1-CD1 3.76Å; I1022-L1072 HydrophobicContact CG2-CB 3.64Å; I1022-L1073 WeakPolarHBondContact CG2-O 3.4Å; I1022-L1074 HydrophobicContact CD1-CD2 4.2Å; I1022-L1074 HydrophobicContact CG2-CD2 3.93Å; I1022-L1074 HydrophobicContact CG2-CG 4.01Å; I1022-K1084 HydrophobicContact CD1-CD 3.53Å; I1022-K1084 HydrophobicContact CG1-CD 4.24Å
1023	K	90.8	Very high	90.3	Very high	138 Å²	138	35.9 Å²	35.9	60%	0.6	19%	0.189	S	C	*	.			trans	-85.9	-29	-164.2	75.2	-175.5	-175.1	178.2	0	115.2	F1021 G1025	F1021-K1023 HydrophobicContact CE1-CB 3.88Å; F1021-K1023 HydrophobicContact CZ-CB 4.08Å; K1023-G1025 VanDerWaalsContact C-N 3.25Å; K1023-G1025 PolarHBondContact O-N 3.36Å
1024	D	89.5	Confident	89.7	Confident	53 Å²	53	34.2 Å²	34.2	28%	0.283	18%	0.18	S	C	.	.	S	Bend	trans	-89.3	16.3	-165.9	-54.4	-70.2	0	0	0	113.4	L1073 R1075	D1024-L1073 HydrophobicContact CB-CB 4.29Å; D1024-L1073 WeakPolarHBondContact CB-O 3.34Å; D1024-R1075 HydrophobicContact CB-CB 4.43Å; D1024-R1075 PolarHBondContact OD2-N 2.96Å
1025	G	90.1	Very high	88.5	Confident	33 Å²	33	35.5 Å²	35.5	34%	0.34	19%	0.192	S	C	.	.			trans	83.3	-163	177.6	0	0	0	0	0	114.1	K1023 L1072 L1073	K1023-G1025 VanDerWaalsContact C-N 3.25Å; K1023-G1025 PolarHBondContact O-N 3.36Å; G1025-L1072 WeakPolarHBondContact O-CA 3.28Å; G1025-L1073 PolarHBondContact O-N 2.99Å
1026	D	93	Very high	87.6	Confident	42 Å²	42	40 Å²	40	23%	0.225	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-107.4	168.9	177.8	65.1	53	0	0	0	112.3	F1028 D1029 G1030 I1071 L1072 L1073	D1026-F1028 VanDerWaalsContact C-N 3.25Å; D1026-F1028 PolarHBondContact O-N 3.34Å; D1026-F1028 VanDerWaalsContact OD1-CA 3.31Å; D1026-F1028 WeakPolarHBondContact OD1-CA 3.39Å; D1026-F1028 WeakPolarHBondContact OD1-CB 3.46Å; D1026-F1028 PolarHBondContact OD1-N 2.81Å; D1026-D1029 PolarHBondContact OD1-N 3.45Å; D1026-G1030 PolarHBondContact O-N 2.93Å; D1026-I1071 CarbonylContact C-O 3.58Å; D1026-I1071 WeakPolarHBondContact CA-O 3.24Å; D1026-L1072 HydrophobicContact CB-CD2 3.99Å; D1026-L1073 WeakPolarHBondContact O-CD1 3.39Å
1027	L	93.1	Very high	87.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.9	-20.9	-179.7	-177.7	64.5	0	0	0	112.1	G1030 I1031 F1037 I1045 P1068 I1071 L1073 I1130 M1134	L1027-G1030 PolarHBondContact O-N 3Å; L1027-I1031 HydrophobicContact CD1-CD1 4.34Å; L1027-I1031 HydrophobicContact CD1-CG1 4.21Å; L1027-I1031 HydrophobicContact CD2-CD1 4.5Å; L1027-I1031 HydrophobicContact CG-CD1 3.9Å; L1027-I1031 HydrophobicContact CG-CG1 4.27Å; L1027-I1031 WeakPolarHBondContact O-CB 3.39Å; L1027-I1031 WeakPolarHBondContact O-CD1 3.45Å; L1027-I1031 WeakPolarHBondContact O-CG1 3.48Å; L1027-I1031 PolarHBondContact O-N 3.43Å; L1027-F1037 HydrophobicContact CD1-CE2 3.66Å; L1027-F1037 HydrophobicContact CD1-CZ 4.22Å; L1027-I1045 HydrophobicContact CD1-CD1 4.09Å; L1027-I1045 HydrophobicContact CD2-CG2 4.28Å; L1027-P1068 HydrophobicContact CB-CB 4.04Å; L1027-P1068 WeakPolarHBondContact CB-O 3.45Å; L1027-P1068 HydrophobicContact CD2-CB 4.36Å; L1027-P1068 HydrophobicContact CG-CB 4.14Å; L1027-P1068 PolarHBondContact N-O 3.26Å; L1027-I1071 HydrophobicContact CB-CB 3.95Å; L1027-I1071 HydrophobicContact CB-CG2 4Å; L1027-I1071 HydrophobicContact CD2-CB 4.22Å; L1027-I1071 HydrophobicContact CD2-CD1 3.95Å; L1027-I1071 HydrophobicContact CD2-CG2 3.99Å; L1027-I1071 PolarHBondContact N-O 3.35Å; L1027-L1073 HydrophobicContact CB-CD2 4.08Å; L1027-L1073 HydrophobicContact CD1-CD2 3.97Å; L1027-I1130 HydrophobicContact CD2-CG2 3.8Å; L1027-M1134 HydrophobicContact CD1-SD 3.97Å; L1027-M1134 HydrophobicContact CD2-SD 4.04Å
1028	F	88.2	Confident	87.1	Confident	35 Å²	35	44.1 Å²	44.1	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-51.3	174.4	-177.2	-87.8	0	0	0	111.2	H143 D1026 G1030 I1031 T1032 P1068 E1069	H143-F1028 AromaticContact ND1-CE2 3.63Å; H143-F1028 AromaticContact ND1-CZ 3.96Å; D1026-F1028 VanDerWaalsContact C-N 3.25Å; D1026-F1028 PolarHBondContact O-N 3.34Å; D1026-F1028 VanDerWaalsContact OD1-CA 3.31Å; D1026-F1028 WeakPolarHBondContact OD1-CA 3.39Å; D1026-F1028 WeakPolarHBondContact OD1-CB 3.46Å; D1026-F1028 PolarHBondContact OD1-N 2.81Å; F1028-G1030 PolarHBondContact O-N 3.25Å; F1028-I1031 PolarHBondContact O-N 3.39Å; F1028-T1032 VanDerWaalsContact O-CB 3.32Å; F1028-T1032 WeakPolarHBondContact O-CB 3.25Å; F1028-T1032 PolarHBondContact O-N 2.98Å; F1028-T1032 PolarHBondContact O-OG1 3.31Å; F1028-P1068 HydrophobicContact CB-CB 3.97Å; F1028-P1068 PolarHBondContact N-O 3.2Å; F1028-E1069 HydrophobicContact CB-CG 4.04Å; F1028-E1069 HydrophobicContact CG-CG 4.34Å
1029	D	85.4	Confident	87	Confident	44 Å²	44	45.4 Å²	45.4	24%	0.235	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-32.8	172.9	-109.3	0.4	0	0	0	110.2	R139 D1026 T1032 Q1033	R139-D1029 IonicContact CZ-OD1 3.76Å; R139-D1029 VanDerWaalsContact NH2-CG 3.34Å; R139-D1029 IonicContact NH2-OD1 2.66Å; R139-D1029 PolarHBondContact NH2-OD1 2.92Å; R139-D1029 IonicContact NH2-OD2 3.27Å; R139-D1029 PolarHBondContact NH2-OD2 2.93Å; R139-D1029 VanDerWaalsContact NH2-OD2 3.08Å; D1026-D1029 PolarHBondContact OD1-N 3.45Å; D1029-T1032 PolarHBondContact O-N 3.48Å; D1029-Q1033 WeakPolarHBondContact O-CB 3.34Å; D1029-Q1033 WeakPolarHBondContact O-CG 3.47Å; D1029-Q1033 PolarHBondContact O-N 3.02Å; D1029-Q1033 PolarHBondContact O-NE2 2.92Å
1030	G	85.3	Confident	86.9	Confident	8 Å²	8	47.6 Å²	47.6	8%	0.082	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-52.2	172.8	0	0	0	0	0	114.3	D1026 L1027 F1028 T1032 Q1033 A1034	D1026-G1030 PolarHBondContact O-N 2.93Å; L1027-G1030 PolarHBondContact O-N 3Å; F1028-G1030 PolarHBondContact O-N 3.25Å; G1030-T1032 VanDerWaalsContact C-N 3.31Å; G1030-T1032 PolarHBondContact O-N 2.99Å; G1030-Q1033 PolarHBondContact O-N 2.7Å; G1030-A1034 WeakPolarHBondContact O-CB 3.32Å; G1030-A1034 PolarHBondContact O-N 3.19Å
1031	I	85.1	Confident	86.8	Confident	10 Å²	10	49 Å²	49	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-42.3	175	-68	160.8	0	0	0	110	L1027 F1028 Q1033 A1034 T1035 F1037 P1068 I1133 M1134	L1027-I1031 HydrophobicContact CD1-CD1 4.34Å; L1027-I1031 HydrophobicContact CD1-CG1 4.21Å; L1027-I1031 HydrophobicContact CD2-CD1 4.5Å; L1027-I1031 HydrophobicContact CG-CD1 3.9Å; L1027-I1031 HydrophobicContact CG-CG1 4.27Å; L1027-I1031 WeakPolarHBondContact O-CB 3.39Å; L1027-I1031 WeakPolarHBondContact O-CD1 3.45Å; L1027-I1031 WeakPolarHBondContact O-CG1 3.48Å; L1027-I1031 PolarHBondContact O-N 3.43Å; F1028-I1031 PolarHBondContact O-N 3.39Å; I1031-Q1033 VanDerWaalsContact C-N 3.29Å; I1031-Q1033 PolarHBondContact O-N 3.06Å; I1031-A1034 PolarHBondContact O-N 3.29Å; I1031-T1035 VanDerWaalsContact O-CA 3.3Å; I1031-T1035 WeakPolarHBondContact O-CA 3.26Å; I1031-T1035 PolarHBondContact O-N 2.95Å; I1031-F1037 HydrophobicContact CG1-CD2 4.36Å; I1031-F1037 HydrophobicContact CG1-CE2 3.81Å; I1031-P1068 HydrophobicContact CD1-CB 4.22Å; I1031-P1068 HydrophobicContact CD1-CG 4.19Å; I1031-I1133 HydrophobicContact CD1-CG2 4Å; I1031-I1133 HydrophobicContact CG2-CG2 4.25Å; I1031-M1134 HydrophobicContact CD1-CG 4.07Å; I1031-M1134 HydrophobicContact CG1-CG 4.26Å
1032	T	79.6	Confident	86.9	Confident	12 Å²	12	47.2 Å²	47.2	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-34.4	179.4	-58.5	0	0	0	0	112.6	V179 F1028 D1029 G1030	V179-T1032 HydrophobicContact CB-CG2 4.23Å; F1028-T1032 VanDerWaalsContact O-CB 3.32Å; F1028-T1032 WeakPolarHBondContact O-CB 3.25Å; F1028-T1032 PolarHBondContact O-N 2.98Å; F1028-T1032 PolarHBondContact O-OG1 3.31Å; D1029-T1032 PolarHBondContact O-N 3.48Å; G1030-T1032 VanDerWaalsContact C-N 3.31Å; G1030-T1032 PolarHBondContact O-N 2.99Å
1033	Q	76.3	Confident	87	Confident	130 Å²	130	46.5 Å²	46.5	61%	0.607	26%	0.255	S	S	*	.	H	α-helix	trans	-78.5	-44	175.9	-75.2	168.8	77.6	0	0	112.9	D1029 G1030 I1031	D1029-Q1033 WeakPolarHBondContact O-CB 3.34Å; D1029-Q1033 WeakPolarHBondContact O-CG 3.47Å; D1029-Q1033 PolarHBondContact O-N 3.02Å; D1029-Q1033 PolarHBondContact O-NE2 2.92Å; G1030-Q1033 PolarHBondContact O-N 2.7Å; I1031-Q1033 VanDerWaalsContact C-N 3.29Å; I1031-Q1033 PolarHBondContact O-N 3.06Å
1034	A	75.7	Confident	87.2	Confident	40 Å²	40	40.9 Å²	40.9	33%	0.331	24%	0.236	S	C	.	.	H	α-helix	trans	-78.5	-20.7	-177.5	0	0	0	0	0	113.6	G1030 I1031 K1036 F1037	G1030-A1034 WeakPolarHBondContact O-CB 3.32Å; G1030-A1034 PolarHBondContact O-N 3.19Å; I1031-A1034 PolarHBondContact O-N 3.29Å; A1034-K1036 PolarHBondContact O-N 3.17Å; A1034-F1037 HydrophobicContact CB-CD1 4.17Å; A1034-F1037 HydrophobicContact CB-CE1 3.94Å; A1034-F1037 HydrophobicContact CB-CZ 4.28Å
1035	T	68.1	Low	87.6	Confident	82 Å²	82	38.4 Å²	38.4	50%	0.503	22%	0.222	S	C	.	.	S	Bend	trans	63.9	-41.8	-164.2	73	0	0	0	0	114.6	I1031 G1137	I1031-T1035 VanDerWaalsContact O-CA 3.3Å; I1031-T1035 WeakPolarHBondContact O-CA 3.26Å; I1031-T1035 PolarHBondContact O-N 2.95Å; T1035-G1137 VanDerWaalsContact O-CA 3.3Å; T1035-G1137 WeakPolarHBondContact O-CA 3.36Å
1036	K	74.2	Confident	87.9	Confident	94 Å²	94	36.8 Å²	36.8	41%	0.409	21%	0.206	S	C	.	.	S	Bend	trans	-156.2	156.1	162.9	56.9	167.9	176.8	174.1	0	110	A1034 M1134 L1135	A1034-K1036 PolarHBondContact O-N 3.17Å; K1036-M1134 WeakPolarHBondContact CA-O 3.38Å; K1036-M1134 WeakPolarHBondContact CB-O 3.49Å; K1036-L1135 WeakPolarHBondContact CD-O 3.35Å
1037	F	86.1	Confident	88.2	Confident	17 Å²	17	36.7 Å²	36.7	8%	0.075	21%	0.209	C	C	.	.			trans	-88.7	155.5	172.7	-70	-68.9	0	0	0	111.5	L1027 I1031 A1034 I1041 A1042 I1045 I1081 M1134	L1027-F1037 HydrophobicContact CD1-CE2 3.66Å; L1027-F1037 HydrophobicContact CD1-CZ 4.22Å; I1031-F1037 HydrophobicContact CG1-CD2 4.36Å; I1031-F1037 HydrophobicContact CG1-CE2 3.81Å; A1034-F1037 HydrophobicContact CB-CD1 4.17Å; A1034-F1037 HydrophobicContact CB-CE1 3.94Å; A1034-F1037 HydrophobicContact CB-CZ 4.28Å; F1037-I1041 HydrophobicContact CB-CB 4.31Å; F1037-I1041 HydrophobicContact CB-CG2 4.27Å; F1037-I1041 HydrophobicContact CD1-CB 4.26Å; F1037-I1041 HydrophobicContact CD1-CG2 3.5Å; F1037-I1041 HydrophobicContact CE1-CG2 4.07Å; F1037-I1041 HydrophobicContact CG-CG2 4.04Å; F1037-A1042 HydrophobicContact CB-CB 4.24Å; F1037-I1045 HydrophobicContact CD2-CD1 4.33Å; F1037-I1045 HydrophobicContact CE2-CD1 4.23Å; F1037-I1045 HydrophobicContact CZ-CD1 4.41Å; F1037-I1081 HydrophobicContact CE1-CD1 4.08Å; F1037-M1134 HydrophobicContact CD2-CB 4.13Å; F1037-M1134 HydrophobicContact CD2-CG 3.97Å; F1037-M1134 HydrophobicContact CD2-SD 4.09Å; F1037-M1134 HydrophobicContact CE2-CG 4.45Å; F1037-M1134 HydrophobicContact CE2-SD 4.45Å; F1037-M1134 PolarHBondContact N-O 3.33Å
1038	T	91.4	Very high	88.4	Confident	86 Å²	86	37 Å²	37	53%	0.528	21%	0.21	S	C	.	.			trans	-73.6	154.7	165.7	56.2	0	0	0	0	110	I1041 A1042	T1038-I1041 PolarHBondContact O-N 3.45Å; T1038-I1041 VanDerWaalsContact O-N 3.08Å; T1038-I1041 WeakPolarHBondContact OG1-CD1 3.48Å; T1038-I1041 WeakPolarHBondContact OG1-CG1 3.43Å; T1038-A1042 PolarHBondContact O-N 3.4Å
1039	E	94.6	Very high	88.9	Confident	28 Å²	28	35.4 Å²	35.4	13%	0.131	20%	0.203	C	C	.	.	H	α-helix	trans	-54	-41.8	-177.2	-70.4	-173.4	-125.6	0	0	113.9	I1041 A1042 A1043 L1135 I1170 S1171 W1200	E1039-I1041 PolarHBondContact O-N 3.42Å; E1039-A1042 PolarHBondContact O-N 2.81Å; E1039-A1043 WeakPolarHBondContact O-CB 3.44Å; E1039-A1043 PolarHBondContact O-N 3.18Å; E1039-L1135 HydrophobicContact CG-CD2 3.92Å; E1039-I1170 HydrophobicContact CG-CD1 4.34Å; E1039-I1170 WeakPolarHBondContact OE1-CA 3.35Å; E1039-S1171 PolarHBondContact OE1-N 3.4Å; E1039-S1171 VanDerWaalsContact OE2-CB 3.22Å; E1039-S1171 WeakPolarHBondContact OE2-CB 3.5Å; E1039-S1171 PolarHBondContact OE2-OG 3.08Å; E1039-W1200 HydrophobicContact CB-CZ2 3.93Å; E1039-W1200 HydrophobicContact CG-CZ2 4.08Å; E1039-W1200 PolarHBondContact OE2-NE1 3.15Å
1040	P	93.8	Very high	89.5	Confident	59 Å²	59	33.3 Å²	33.3	38%	0.383	19%	0.192	S	C	.	.	H	α-helix	trans	-65	-33.9	177.1	-25.8	37	0	0	0	114.8	G1044 S1204 L1206	P1040-G1044 PolarHBondContact O-N 3.46Å; P1040-G1044 VanDerWaalsContact O-N 3.08Å; P1040-S1204 VanDerWaalsContact CA-O 3.23Å; P1040-S1204 WeakPolarHBondContact CA-O 3.37Å; P1040-S1204 VanDerWaalsContact CB-O 3.32Å; P1040-S1204 WeakPolarHBondContact CB-O 3.4Å; P1040-L1206 HydrophobicContact CG-CD2 4.19Å
1041	I	93.6	Very high	90.1	Very high	66 Å²	66	34.4 Å²	34.4	34%	0.338	20%	0.198	S	C	.	.	H	α-helix	trans	-72.6	-45	176.2	-61	174.1	0	0	0	109.7	F1037 T1038 E1039 A1043 G1044 I1045 I1081	F1037-I1041 HydrophobicContact CB-CB 4.31Å; F1037-I1041 HydrophobicContact CB-CG2 4.27Å; F1037-I1041 HydrophobicContact CD1-CB 4.26Å; F1037-I1041 HydrophobicContact CD1-CG2 3.5Å; F1037-I1041 HydrophobicContact CE1-CG2 4.07Å; F1037-I1041 HydrophobicContact CG-CG2 4.04Å; T1038-I1041 PolarHBondContact O-N 3.45Å; T1038-I1041 VanDerWaalsContact O-N 3.08Å; T1038-I1041 WeakPolarHBondContact OG1-CD1 3.48Å; T1038-I1041 WeakPolarHBondContact OG1-CG1 3.43Å; E1039-I1041 PolarHBondContact O-N 3.42Å; I1041-A1043 PolarHBondContact O-N 3.06Å; I1041-G1044 PolarHBondContact O-N 3.28Å; I1041-I1045 HydrophobicContact CG2-CD1 3.97Å; I1041-I1045 WeakPolarHBondContact O-CG1 3.43Å; I1041-I1045 PolarHBondContact O-N 3.27Å; I1041-I1081 HydrophobicContact CG2-CD1 4.05Å
1042	A	95.7	Very high	90.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-42.2	177	0	0	0	0	0	111.9	F1037 T1038 E1039 I1045 V1046 M1134 L1135 W1200	F1037-A1042 HydrophobicContact CB-CB 4.24Å; T1038-A1042 PolarHBondContact O-N 3.4Å; E1039-A1042 PolarHBondContact O-N 2.81Å; A1042-I1045 PolarHBondContact O-N 3.38Å; A1042-V1046 WeakPolarHBondContact O-CB 3.35Å; A1042-V1046 VanDerWaalsContact O-CG2 3.31Å; A1042-V1046 WeakPolarHBondContact O-CG2 3.23Å; A1042-V1046 PolarHBondContact O-N 3.49Å; A1042-M1134 HydrophobicContact CB-CB 4.34Å; A1042-M1134 HydrophobicContact CB-CE 4.36Å; A1042-L1135 HydrophobicContact CB-CD2 3.6Å; A1042-L1135 HydrophobicContact CB-CG 4.34Å; A1042-W1200 HydrophobicContact CB-CH2 3.8Å; A1042-W1200 HydrophobicContact CB-CZ2 4.33Å
1043	A	96.8	Very high	91.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-39.3	176.2	0	0	0	0	0	112.4	E1039 I1041 V1046 S1047 W1200 G1205	E1039-A1043 WeakPolarHBondContact O-CB 3.44Å; E1039-A1043 PolarHBondContact O-N 3.18Å; I1041-A1043 PolarHBondContact O-N 3.06Å; A1043-V1046 PolarHBondContact O-N 2.89Å; A1043-S1047 WeakPolarHBondContact O-CB 3.22Å; A1043-S1047 PolarHBondContact O-N 3.24Å; A1043-W1200 HydrophobicContact CB-CD2 4.13Å; A1043-W1200 HydrophobicContact CB-CE3 3.86Å; A1043-W1200 HydrophobicContact CB-CH2 3.92Å; A1043-W1200 HydrophobicContact CB-CZ2 4.11Å; A1043-W1200 HydrophobicContact CB-CZ3 3.77Å; A1043-G1205 VanDerWaalsContact CB-N 3.29Å
1044	G	95.8	Very high	92.6	Very high	20 Å²	20	28.4 Å²	28.4	21%	0.206	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-44.7	172.4	0	0	0	0	0	112.8	P1040 I1041 S1047 D1048	P1040-G1044 PolarHBondContact O-N 3.46Å; P1040-G1044 VanDerWaalsContact O-N 3.08Å; I1041-G1044 PolarHBondContact O-N 3.28Å; G1044-S1047 PolarHBondContact O-N 2.96Å; G1044-D1048 PolarHBondContact O-N 3.47Å; G1044-D1048 VanDerWaalsContact O-N 3.07Å
1045	I	96.7	Very high	93.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-44	175.7	-65.4	165.3	0	0	0	110.8	L1027 F1037 I1041 A1042 S1047 D1048 L1049 I1081 V1083 M1134	L1027-I1045 HydrophobicContact CD1-CD1 4.09Å; L1027-I1045 HydrophobicContact CD2-CG2 4.28Å; F1037-I1045 HydrophobicContact CD2-CD1 4.33Å; F1037-I1045 HydrophobicContact CE2-CD1 4.23Å; F1037-I1045 HydrophobicContact CZ-CD1 4.41Å; I1041-I1045 HydrophobicContact CG2-CD1 3.97Å; I1041-I1045 WeakPolarHBondContact O-CG1 3.43Å; I1041-I1045 PolarHBondContact O-N 3.27Å; A1042-I1045 PolarHBondContact O-N 3.38Å; I1045-S1047 PolarHBondContact O-N 3.38Å; I1045-D1048 PolarHBondContact O-N 3.37Å; I1045-L1049 HydrophobicContact CG2-CD1 3.91Å; I1045-L1049 HydrophobicContact CG2-CG 4.48Å; I1045-L1049 VanDerWaalsContact O-CG 3.28Å; I1045-L1049 WeakPolarHBondContact O-CG 3.25Å; I1045-L1049 PolarHBondContact O-N 3.38Å; I1045-I1081 HydrophobicContact CD1-CG2 4.39Å; I1045-I1081 HydrophobicContact CG1-CG2 4.41Å; I1045-V1083 HydrophobicContact CG1-CG1 4.07Å; I1045-V1083 HydrophobicContact CG2-CG1 4.01Å; I1045-V1083 HydrophobicContact CG2-CG2 4.15Å; I1045-M1134 HydrophobicContact CB-CE 4.22Å; I1045-M1134 HydrophobicContact CB-SD 4.09Å; I1045-M1134 HydrophobicContact CD1-SD 3.9Å; I1045-M1134 HydrophobicContact CG2-CE 3.91Å; I1045-M1134 HydrophobicContact CG2-SD 3.72Å
1046	V	98.1	Very high	94.8	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-38.2	176.8	170.6	0	0	0	0	111.8	A1042 A1043 L1049 A1050 L1127 T1131 M1134 L1177 T1195 W1200 V1201	A1042-V1046 WeakPolarHBondContact O-CB 3.35Å; A1042-V1046 VanDerWaalsContact O-CG2 3.31Å; A1042-V1046 WeakPolarHBondContact O-CG2 3.23Å; A1042-V1046 PolarHBondContact O-N 3.49Å; A1043-V1046 PolarHBondContact O-N 2.89Å; V1046-L1049 PolarHBondContact O-N 3.44Å; V1046-A1050 WeakPolarHBondContact O-CB 3.25Å; V1046-A1050 PolarHBondContact O-N 2.92Å; V1046-L1127 HydrophobicContact CG1-CD1 4.48Å; V1046-L1127 HydrophobicContact CG1-CD2 4.44Å; V1046-L1127 HydrophobicContact CG2-CD1 4.44Å; V1046-T1131 HydrophobicContact CG2-CG2 3.89Å; V1046-T1131 VanDerWaalsContact CG2-OG1 3.24Å; V1046-T1131 WeakPolarHBondContact CG2-OG1 3.35Å; V1046-M1134 HydrophobicContact CG2-CE 3.72Å; V1046-L1177 HydrophobicContact CG1-CD2 4.32Å; V1046-T1195 HydrophobicContact CG1-CG2 3.96Å; V1046-W1200 HydrophobicContact CB-CZ3 4.29Å; V1046-W1200 HydrophobicContact CG2-CZ3 4.17Å; V1046-V1201 HydrophobicContact CG1-CG2 3.89Å
1047	S	97.8	Very high	95.8	Very high	39 Å²	39	20.6 Å²	20.6	27%	0.273	12%	0.121	S	C	.	.	H	α-helix	trans	-62.2	-46.3	175.6	-169.3	0	0	0	0	111.7	A1043 G1044 I1045 L1049 A1050 S1051	A1043-S1047 WeakPolarHBondContact O-CB 3.22Å; A1043-S1047 PolarHBondContact O-N 3.24Å; G1044-S1047 PolarHBondContact O-N 2.96Å; I1045-S1047 PolarHBondContact O-N 3.38Å; S1047-L1049 PolarHBondContact O-N 3.48Å; S1047-A1050 PolarHBondContact O-N 3.01Å; S1047-S1051 VanDerWaalsContact O-CB 3.25Å; S1047-S1051 WeakPolarHBondContact O-CB 3.34Å; S1047-S1051 PolarHBondContact O-N 3.35Å
1048	D	97.8	Very high	96.1	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.032	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-42.8	175.5	-86.7	-14.1	0	0	0	112.7	N1001 G1044 I1045 S1051 A1052 R1082 V1083	N1001-D1048 HydrophobicContact CB-CB 4.49Å; N1001-D1048 VanDerWaalsContact CB-O 3.32Å; N1001-D1048 WeakPolarHBondContact CB-O 3.4Å; N1001-D1048 VanDerWaalsContact ND2-CB 3.34Å; N1001-D1048 WeakPolarHBondContact ND2-CB 3.49Å; N1001-D1048 PolarHBondContact ND2-OD1 2.89Å; N1001-D1048 PolarHBondContact ND2-OD2 2.8Å; G1044-D1048 PolarHBondContact O-N 3.47Å; G1044-D1048 VanDerWaalsContact O-N 3.07Å; I1045-D1048 PolarHBondContact O-N 3.37Å; D1048-S1051 WeakPolarHBondContact O-CB 3.44Å; D1048-S1051 PolarHBondContact O-N 2.87Å; D1048-A1052 PolarHBondContact O-N 2.96Å; D1048-R1082 VanDerWaalsContact CG-NE 3.31Å; D1048-R1082 IonicContact OD1-CZ 2.71Å; D1048-R1082 VanDerWaalsContact OD1-CZ 3.24Å; D1048-R1082 IonicContact OD1-NE 2.91Å; D1048-R1082 PolarHBondContact OD1-NE 2.92Å; D1048-R1082 IonicContact OD1-NH2 3.63Å; D1048-R1082 PolarHBondContact OD1-NH2 2.7Å; D1048-R1082 WeakPolarHBondContact OD2-CA 3.45Å; D1048-R1082 WeakPolarHBondContact OD2-CB 3.29Å; D1048-R1082 IonicContact OD2-CZ 3.56Å; D1048-R1082 IonicContact OD2-NE 2.65Å; D1048-R1082 PolarHBondContact OD2-NE 2.81Å; D1048-R1082 IonicContact OD2-NH2 3.76Å; D1048-V1083 HydrophobicContact CB-CG2 3.52Å; D1048-V1083 PolarHBondContact OD2-N 2.87Å
1049	L	98.1	Very high	96.1	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-69.9	-44.2	177.9	-68.1	170.9	0	0	0	112.1	I1045 V1046 S1047 S1051 A1052 L1053 I1071 V1083 L1127	I1045-L1049 HydrophobicContact CG2-CD1 3.91Å; I1045-L1049 HydrophobicContact CG2-CG 4.48Å; I1045-L1049 VanDerWaalsContact O-CG 3.28Å; I1045-L1049 WeakPolarHBondContact O-CG 3.25Å; I1045-L1049 PolarHBondContact O-N 3.38Å; V1046-L1049 PolarHBondContact O-N 3.44Å; S1047-L1049 PolarHBondContact O-N 3.48Å; L1049-S1051 PolarHBondContact O-N 3.21Å; L1049-A1052 PolarHBondContact O-N 3.04Å; L1049-L1053 WeakPolarHBondContact O-CG 3.39Å; L1049-L1053 PolarHBondContact O-N 2.68Å; L1049-I1071 HydrophobicContact CD1-CD1 3.82Å; L1049-I1071 HydrophobicContact CD2-CD1 3.86Å; L1049-I1071 HydrophobicContact CD2-CG1 3.84Å; L1049-I1071 HydrophobicContact CD2-CG2 3.92Å; L1049-V1083 HydrophobicContact CD2-CG2 3.96Å; L1049-V1083 HydrophobicContact CG-CG2 3.91Å; L1049-L1127 HydrophobicContact CB-CD1 3.79Å; L1049-L1127 HydrophobicContact CD1-CD1 3.8Å; L1049-L1127 HydrophobicContact CG-CD1 4.46Å
1050	A	98.4	Very high	95.9	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.6	-31.7	176.2	0	0	0	0	0	111.6	V1046 S1047 F1054 L1127 T1195 L1196	V1046-A1050 WeakPolarHBondContact O-CB 3.25Å; V1046-A1050 PolarHBondContact O-N 2.92Å; S1047-A1050 PolarHBondContact O-N 3.01Å; A1050-F1054 WeakPolarHBondContact O-CB 3.25Å; A1050-F1054 PolarHBondContact O-N 2.98Å; A1050-L1127 HydrophobicContact CB-CD2 4.31Å; A1050-T1195 HydrophobicContact CB-CG2 3.7Å; A1050-L1196 HydrophobicContact CB-CD2 3.92Å; A1050-L1196 HydrophobicContact CB-CG 3.85Å
1051	S	98.1	Very high	95.8	Very high	31 Å²	31	17.6 Å²	17.6	22%	0.217	10%	0.099	C	C	.	.	H	α-helix	trans	-64.2	-47.6	170.6	-170.8	0	0	0	0	111.8	H999 S1047 D1048 L1049 F1054 Y1055	H999-S1051 VanDerWaalsContact CE1-C 3.46Å; H999-S1051 PolarHBondContact CE1-OG 3Å; H999-S1051 VanDerWaalsContact CE1-OG 3.27Å; H999-S1051 PolarHBondContact NE2-OG 2.73Å; S1047-S1051 VanDerWaalsContact O-CB 3.25Å; S1047-S1051 WeakPolarHBondContact O-CB 3.34Å; S1047-S1051 PolarHBondContact O-N 3.35Å; D1048-S1051 WeakPolarHBondContact O-CB 3.44Å; D1048-S1051 PolarHBondContact O-N 2.87Å; L1049-S1051 PolarHBondContact O-N 3.21Å; S1051-F1054 PolarHBondContact O-N 3.5Å; S1051-Y1055 PolarHBondContact O-N 3.24Å
1052	A	97.8	Very high	95.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.5	-44.7	174.5	0	0	0	0	0	112.7	H999 N1001 I1002 D1048 L1049 Y1055 L1056 L1085	H999-A1052 PolarHBondContact CE1-N 2.81Å; N1001-A1052 HydrophobicContact CB-CB 4.01Å; I1002-A1052 HydrophobicContact CG1-CB 4.04Å; D1048-A1052 PolarHBondContact O-N 2.96Å; L1049-A1052 PolarHBondContact O-N 3.04Å; A1052-Y1055 WeakPolarHBondContact O-CB 3.48Å; A1052-Y1055 PolarHBondContact O-N 3.33Å; A1052-L1056 WeakPolarHBondContact O-CG 3.45Å; A1052-L1056 PolarHBondContact O-N 2.93Å; A1052-L1056 VanDerWaalsContact O-N 3.11Å; A1052-L1085 HydrophobicContact CB-CB 4.47Å
1053	L	98	Very high	95.7	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-66	-40.4	176.9	-67.5	-179	0	0	0	111.5	L1049 Y1055 L1056 H1057 L1066 D1123 M1124 L1127 A1192	L1049-L1053 WeakPolarHBondContact O-CG 3.39Å; L1049-L1053 PolarHBondContact O-N 2.68Å; L1053-Y1055 VanDerWaalsContact C-N 3.32Å; L1053-Y1055 PolarHBondContact O-N 3.43Å; L1053-L1056 PolarHBondContact O-N 3.39Å; L1053-H1057 WeakPolarHBondContact O-CB 3.49Å; L1053-H1057 PolarHBondContact O-CD2 3.3Å; L1053-H1057 PolarHBondContact O-N 2.85Å; L1053-L1066 HydrophobicContact CD1-CD2 4.05Å; L1053-D1123 HydrophobicContact CD1-CB 4.01Å; L1053-D1123 HydrophobicContact CD2-CB 3.71Å; L1053-D1123 HydrophobicContact CG-CB 4.49Å; L1053-M1124 HydrophobicContact CB-SD 4.46Å; L1053-M1124 HydrophobicContact CD1-SD 3.81Å; L1053-L1127 HydrophobicContact CD1-CB 4.4Å; L1053-L1127 HydrophobicContact CD1-CD2 4.22Å; L1053-A1192 HydrophobicContact CB-CB 3.93Å
1054	F	97.5	Very high	95.4	Very high	26 Å²	26	16.2 Å²	16.2	11%	0.114	9%	0.09	C	C	.	.	H	α-helix	trans	-59.4	-43.3	174.8	176.9	-108.7	0	0	0	111.7	A1050 S1051 L1056 C1058 A1192 R1193 L1196 L1224 K1227 H1228	A1050-F1054 WeakPolarHBondContact O-CB 3.25Å; A1050-F1054 PolarHBondContact O-N 2.98Å; S1051-F1054 PolarHBondContact O-N 3.5Å; F1054-L1056 PolarHBondContact O-N 2.87Å; F1054-C1058 WeakPolarHBondContact O-CB 3.44Å; F1054-C1058 PolarHBondContact O-N 2.81Å; F1054-C1058 PolarHBondContact O-SG 3.12Å; F1054-A1192 HydrophobicContact CB-CB 3.92Å; F1054-R1193 HydrophobicContact CD2-CB 3.88Å; F1054-R1193 HydrophobicContact CE2-CB 3.89Å; F1054-R1193 HydrophobicContact CE2-CG 4.36Å; F1054-L1196 HydrophobicContact CB-CD1 3.97Å; F1054-L1196 HydrophobicContact CG-CD1 4.22Å; F1054-L1224 HydrophobicContact CD1-CD2 4.43Å; F1054-L1224 HydrophobicContact CE1-CD2 4.04Å; F1054-L1224 HydrophobicContact CZ-CB 4.45Å; F1054-L1224 HydrophobicContact CZ-CD2 4.31Å; F1054-L1224 WeakPolarHBondContact CZ-O 3.23Å; F1054-K1227 HydrophobicContact CE1-CB 4.46Å; F1054-K1227 HydrophobicContact CZ-CB 4.34Å; F1054-H1228 HydrophobicContact CE2-CB 4.03Å; F1054-H1228 HydrophobicContact CZ-CB 4.09Å
1055	Y	95.7	Very high	95.3	Very high	30 Å²	30	16.1 Å²	16.1	12%	0.118	9%	0.085	C	C	.	.	H	α-helix	trans	-59.1	-43.1	175.1	177.8	-85.6	0	0	0	112.9	H996 C997 R998 H999 I1002 S1051 A1052 L1053 R1059	H996-Y1055 PolarHBondContact O-OH 2.85Å; H996-Y1055 VanDerWaalsContact O-OH 3.14Å; C997-Y1055 HydrophobicContact CB-CE1 4.46Å; R998-Y1055 PolarHBondContact N-OH 2.87Å; R998-Y1055 VanDerWaalsContact O-CE2 3.24Å; R998-Y1055 WeakPolarHBondContact O-CE2 3.3Å; R998-Y1055 PolarHBondContact O-OH 2.84Å; H999-Y1055 HydrophobicContact CB-CD1 4.05Å; H999-Y1055 HydrophobicContact CB-CD2 3.98Å; H999-Y1055 HydrophobicContact CB-CE1 4.25Å; H999-Y1055 HydrophobicContact CB-CE2 4.15Å; H999-Y1055 HydrophobicContact CB-CG 3.92Å; H999-Y1055 AromaticContact CD2-CD2 3.49Å; H999-Y1055 VanDerWaalsContact CD2-CD2 3.49Å; H999-Y1055 WeakPolarHBondContact CD2-CD2 3.45Å; H999-Y1055 AromaticContact CD2-CG 3.67Å; H999-Y1055 AromaticContact CG-CD2 3.97Å; H999-Y1055 AromaticContact CG-CG 3.85Å; I1002-Y1055 HydrophobicContact CD1-CD1 3.86Å; I1002-Y1055 HydrophobicContact CD1-CE1 4.31Å; S1051-Y1055 PolarHBondContact O-N 3.24Å; A1052-Y1055 WeakPolarHBondContact O-CB 3.48Å; A1052-Y1055 PolarHBondContact O-N 3.33Å; L1053-Y1055 VanDerWaalsContact C-N 3.32Å; L1053-Y1055 PolarHBondContact O-N 3.43Å; Y1055-R1059 VanDerWaalsContact CZ-NE 3.35Å; Y1055-R1059 WeakPolarHBondContact O-CD 3.26Å; Y1055-R1059 PolarHBondContact O-NH1 3.15Å; Y1055-R1059 PolarHBondContact OH-NE 2.82Å
1056	L	94.8	Very high	95.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-74.9	-45.7	-180	-67.6	171.9	0	0	0	112.3	I1002 A1052 L1053 F1054 C1058 R1059 S1060 I1061 L1085 F1088	I1002-L1056 HydrophobicContact CD1-CD1 4.17Å; I1002-L1056 HydrophobicContact CD1-CD2 3.94Å; I1002-L1056 HydrophobicContact CD1-CG 3.95Å; A1052-L1056 WeakPolarHBondContact O-CG 3.45Å; A1052-L1056 PolarHBondContact O-N 2.93Å; A1052-L1056 VanDerWaalsContact O-N 3.11Å; L1053-L1056 PolarHBondContact O-N 3.39Å; F1054-L1056 PolarHBondContact O-N 2.87Å; L1056-C1058 VanDerWaalsContact C-N 3.32Å; L1056-C1058 PolarHBondContact O-N 2.98Å; L1056-R1059 CarbonylContact O-C 3.54Å; L1056-R1059 VanDerWaalsContact O-CA 3.3Å; L1056-R1059 WeakPolarHBondContact O-CA 3.49Å; L1056-R1059 VanDerWaalsContact O-CB 3.31Å; L1056-R1059 WeakPolarHBondContact O-CB 3.4Å; L1056-R1059 PolarHBondContact O-N 3.04Å; L1056-S1060 PolarHBondContact O-N 3.38Å; L1056-I1061 CarbonylContact C-O 3.59Å; L1056-I1061 HydrophobicContact CB-CB 4.17Å; L1056-I1061 HydrophobicContact CB-CG2 4.49Å; L1056-I1061 HydrophobicContact CD2-CB 4.16Å; L1056-I1061 HydrophobicContact CD2-CD1 4.16Å; L1056-I1061 HydrophobicContact CD2-CG2 4Å; L1056-I1061 PolarHBondContact O-N 3.29Å; L1056-L1085 HydrophobicContact CD1-CD2 3.98Å; L1056-F1088 HydrophobicContact CD1-CE1 3.77Å; L1056-F1088 HydrophobicContact CD1-CZ 4.07Å; L1056-F1088 HydrophobicContact CD2-CE1 3.83Å; L1056-F1088 HydrophobicContact CD2-CZ 4.49Å; L1056-F1088 HydrophobicContact CG-CE1 4.47Å
1057	H	95.3	Very high	95	Very high	22 Å²	22	17.6 Å²	17.6	10%	0.102	9%	0.091	C	C	.	.	H	α-helix	trans	-66.1	-33.3	-178.7	-69.2	-171.9	0	0	0	111.8	L1053 R1059 S1060 I1061 L1120 D1123	L1053-H1057 WeakPolarHBondContact O-CB 3.49Å; L1053-H1057 PolarHBondContact O-CD2 3.3Å; L1053-H1057 PolarHBondContact O-N 2.85Å; H1057-R1059 VanDerWaalsContact C-N 3.28Å; H1057-R1059 PolarHBondContact O-N 2.76Å; H1057-S1060 WeakPolarHBondContact O-CA 3.21Å; H1057-S1060 PolarHBondContact O-N 2.94Å; H1057-I1061 PolarHBondContact CD2-O 3.46Å; H1057-L1120 HydrophobicContact CB-CD1 4.06Å; H1057-L1120 PolarHBondContact CE1-O 2.86Å; H1057-L1120 PolarHBondContact NE2-O 3.3Å; H1057-D1123 IonicContact CD2-OD2 3.29Å; H1057-D1123 IonicContact CE1-OD2 3.41Å; H1057-D1123 IonicContact NE2-OD2 3.24Å; H1057-D1123 PolarHBondContact NE2-OD2 3.17Å
1058	C	92.7	Very high	94.7	Very high	12 Å²	12	15.8 Å²	15.8	8%	0.081	8%	0.079	C	C	.	.	H	α-helix	trans	-58.3	-41	167.7	-71.9	0	0	0	0	111.9	F1054 L1056 S1060 H1228 F1231	F1054-C1058 WeakPolarHBondContact O-CB 3.44Å; F1054-C1058 PolarHBondContact O-N 2.81Å; F1054-C1058 PolarHBondContact O-SG 3.12Å; L1056-C1058 VanDerWaalsContact C-N 3.32Å; L1056-C1058 PolarHBondContact O-N 2.98Å; C1058-S1060 PolarHBondContact O-N 2.86Å; C1058-H1228 PolarHBondContact SG-ND1 3.23Å; C1058-F1231 VanDerWaalsContact C-CD1 3.44Å; C1058-F1231 VanDerWaalsContact C-CE1 3.42Å; C1058-F1231 HydrophobicContact CB-CB 4.25Å; C1058-F1231 HydrophobicContact CB-CD1 3.64Å; C1058-F1231 HydrophobicContact CB-CE1 4.28Å; C1058-F1231 HydrophobicContact CB-CG 3.89Å; C1058-F1231 WeakPolarHBondContact O-CD1 3.41Å; C1058-F1231 WeakPolarHBondContact O-CE1 3.46Å
1059	R	90.6	Very high	94.4	Very high	59 Å²	59	19 Å²	19	22%	0.223	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	4.3	174.3	-72.2	158.3	-178.9	65.2	12.8	113.8	Y1055 L1056 H1057 I1061 F1231	Y1055-R1059 VanDerWaalsContact CZ-NE 3.35Å; Y1055-R1059 WeakPolarHBondContact O-CD 3.26Å; Y1055-R1059 PolarHBondContact O-NH1 3.15Å; Y1055-R1059 PolarHBondContact OH-NE 2.82Å; L1056-R1059 CarbonylContact O-C 3.54Å; L1056-R1059 VanDerWaalsContact O-CA 3.3Å; L1056-R1059 WeakPolarHBondContact O-CA 3.49Å; L1056-R1059 VanDerWaalsContact O-CB 3.31Å; L1056-R1059 WeakPolarHBondContact O-CB 3.4Å; L1056-R1059 PolarHBondContact O-N 3.04Å; H1057-R1059 VanDerWaalsContact C-N 3.28Å; H1057-R1059 PolarHBondContact O-N 2.76Å; R1059-I1061 HydrophobicContact CB-CD1 3.64Å; R1059-I1061 HydrophobicContact CB-CG1 3.88Å; R1059-I1061 HydrophobicContact CG-CD1 4.48Å; R1059-I1061 PolarHBondContact O-N 2.7Å; R1059-F1231 HydrophobicContact CB-CE1 4.35Å; R1059-F1231 HydrophobicContact CB-CZ 4.36Å; R1059-F1231 HydrophobicContact CG-CE1 3.76Å; R1059-F1231 HydrophobicContact CG-CE2 4.13Å; R1059-F1231 HydrophobicContact CG-CZ 3.35Å
1060	S	91.7	Very high	94.3	Very high	46 Å²	46	19.5 Å²	19.5	32%	0.322	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	28.2	-169.5	-52.9	0	0	0	0	113.1	L1056 H1057 C1058 V1093 V1094	L1056-S1060 PolarHBondContact O-N 3.38Å; H1057-S1060 WeakPolarHBondContact O-CA 3.21Å; H1057-S1060 PolarHBondContact O-N 2.94Å; C1058-S1060 PolarHBondContact O-N 2.86Å; S1060-V1093 CarbonylContact O-C 3.58Å; S1060-V1093 WeakPolarHBondContact O-CA 3.38Å; S1060-V1094 PolarHBondContact O-N 3.4Å
1061	I	91.2	Very high	94.2	Very high	9 Å²	9	19.5 Å²	19.5	5%	0.046	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.2	175.7	-61.3	164.4	0	0	0	108.9	I993 L1056 H1057 R1059 A1091 L1092 V1093	I993-I1061 HydrophobicContact CD1-CG2 4.26Å; I993-I1061 HydrophobicContact CG2-CD1 4.26Å; I993-I1061 HydrophobicContact CG2-CG2 4.26Å; L1056-I1061 CarbonylContact C-O 3.59Å; L1056-I1061 HydrophobicContact CB-CB 4.17Å; L1056-I1061 HydrophobicContact CB-CG2 4.49Å; L1056-I1061 HydrophobicContact CD2-CB 4.16Å; L1056-I1061 HydrophobicContact CD2-CD1 4.16Å; L1056-I1061 HydrophobicContact CD2-CG2 4Å; L1056-I1061 PolarHBondContact O-N 3.29Å; H1057-I1061 PolarHBondContact CD2-O 3.46Å; R1059-I1061 HydrophobicContact CB-CD1 3.64Å; R1059-I1061 HydrophobicContact CB-CG1 3.88Å; R1059-I1061 HydrophobicContact CG-CD1 4.48Å; R1059-I1061 PolarHBondContact O-N 2.7Å; I1061-A1091 HydrophobicContact CG2-CB 4.33Å; I1061-L1092 WeakPolarHBondContact CA-O 3.39Å; I1061-V1093 HydrophobicContact CG1-CG2 4.06Å
1062	V	93.6	Very high	94.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	147	166.6	65	0	0	0	0	109.8	R1064 A1091 L1092 V1094 M1098 G1119 L1120 V1122 D1123	V1062-R1064 HydrophobicContact CB-CG 4.2Å; V1062-R1064 HydrophobicContact CG1-CG 3.64Å; V1062-R1064 HydrophobicContact CG2-CG 3.56Å; V1062-A1091 CarbonylContact O-C 3.51Å; V1062-A1091 WeakPolarHBondContact O-CA 3.4Å; V1062-A1091 WeakPolarHBondContact O-CB 3.48Å; V1062-L1092 HydrophobicContact CG1-CB 4.13Å; V1062-L1092 WeakPolarHBondContact CG1-O 3.32Å; V1062-L1092 PolarHBondContact N-O 2.97Å; V1062-L1092 PolarHBondContact O-N 3.25Å; V1062-V1094 HydrophobicContact CB-CG2 3.81Å; V1062-V1094 HydrophobicContact CG1-CG2 3.66Å; V1062-M1098 HydrophobicContact CB-CE 4.42Å; V1062-M1098 HydrophobicContact CG1-CE 3.83Å; V1062-M1098 HydrophobicContact CG1-SD 3.86Å; V1062-G1119 WeakPolarHBondContact CG2-O 3.15Å; V1062-L1120 HydrophobicContact CB-CD2 4.12Å; V1062-V1122 HydrophobicContact CG2-CG2 3.52Å; V1062-D1123 WeakPolarHBondContact CA-OD2 3.47Å; V1062-D1123 WeakPolarHBondContact CG2-OD2 3.43Å
1063	H	93.8	Very high	93.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.			trans	-89	-43.3	175.6	-164.7	-98.7	0	0	0	113	D1065 L1066 A1086 F1088 L1090 A1091 D1123	H1063-D1065 PolarHBondContact CE1-O 2.95Å; H1063-D1065 PolarHBondContact ND1-O 2.92Å; H1063-D1065 PolarHBondContact O-N 3.12Å; H1063-L1066 PolarHBondContact ND1-N 3.49Å; H1063-A1086 PolarHBondContact CE1-O 2.89Å; H1063-A1086 PolarHBondContact NE2-O 3.23Å; H1063-F1088 AromaticContact CD2-CD1 3.9Å; H1063-F1088 AromaticContact CD2-CE1 3.75Å; H1063-F1088 AromaticContact CD2-CZ 3.95Å; H1063-L1090 CarbonylContact O-C 3.43Å; H1063-A1091 PolarHBondContact O-N 3.43Å; H1063-D1123 WeakPolarHBondContact CB-OD1 3.35Å; H1063-D1123 PolarHBondContact N-OD1 3.38Å; H1063-D1123 PolarHBondContact N-OD2 3.34Å
1064	R	90.8	Very high	93.6	Very high	37 Å²	37	22.8 Å²	22.8	14%	0.14	11%	0.111	C	C	.	.	S	Bend	trans	62.8	-17.5	-179.9	-54.9	-170.1	-65.5	170.5	-9.4	117.5	V1062 L1090 Y1118 D1123	V1062-R1064 HydrophobicContact CB-CG 4.2Å; V1062-R1064 HydrophobicContact CG1-CG 3.64Å; V1062-R1064 HydrophobicContact CG2-CG 3.56Å; R1064-L1090 HydrophobicContact CB-CB 4.37Å; R1064-L1090 PolarHBondContact NE-O 3.34Å; R1064-L1090 PolarHBondContact NH2-O 3.25Å; R1064-Y1118 VanDerWaalsContact CD-OH 3.22Å; R1064-Y1118 WeakPolarHBondContact CD-OH 3.26Å; R1064-Y1118 HydrophobicContact CG-CE2 4.26Å; R1064-Y1118 PolarHBondContact NH1-OH 3.47Å; R1064-D1123 PolarHBondContact N-OD1 3.06Å
1065	D	92.2	Very high	93.2	Very high	18 Å²	18	27.7 Å²	27.7	10%	0.096	13%	0.128	C	C	.	.			trans	-120.8	44.2	176.3	-160	20.5	0	0	0	112	H1063 K1067 N1070 L1090	H1063-D1065 PolarHBondContact CE1-O 2.95Å; H1063-D1065 PolarHBondContact ND1-O 2.92Å; H1063-D1065 PolarHBondContact O-N 3.12Å; D1065-K1067 PolarHBondContact O-N 2.97Å; D1065-K1067 IonicContact OD1-NZ 2.69Å; D1065-K1067 PolarHBondContact OD1-NZ 3.29Å; D1065-K1067 IonicContact OD2-NZ 2.73Å; D1065-K1067 PolarHBondContact OD2-NZ 3.28Å; D1065-N1070 VanDerWaalsContact CG-ND2 3.34Å; D1065-N1070 PolarHBondContact O-ND2 3Å; D1065-N1070 PolarHBondContact OD2-ND2 3.33Å; D1065-L1090 HydrophobicContact CB-CB 4.21Å; D1065-L1090 HydrophobicContact CB-CD1 4.08Å; D1065-L1090 HydrophobicContact CB-CG 4.45Å
1066	L	95.2	Very high	92.9	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.021	14%	0.14	C	C	.	.			trans	-78	109.8	176.5	-172.9	69	0	0	0	109.9	L1053 H1063 I1071 L1085 D1123 A1126 L1127 I1130	L1053-L1066 HydrophobicContact CD1-CD2 4.05Å; H1063-L1066 PolarHBondContact ND1-N 3.49Å; L1066-I1071 HydrophobicContact CD1-CD1 4.03Å; L1066-I1071 HydrophobicContact CD1-CG1 4.28Å; L1066-L1085 HydrophobicContact CD1-CD1 3.48Å; L1066-L1085 VanDerWaalsContact CD1-CD1 3.48Å; L1066-L1085 HydrophobicContact CD1-CD2 4.47Å; L1066-D1123 WeakPolarHBondContact CD2-O 3.46Å; L1066-A1126 HydrophobicContact CB-CB 3.91Å; L1066-A1126 HydrophobicContact CD2-CB 4.07Å; L1066-A1126 HydrophobicContact CG-CB 4.31Å; L1066-L1127 HydrophobicContact CD2-CB 4.15Å; L1066-I1130 HydrophobicContact CD2-CD1 4.29Å; L1066-I1130 HydrophobicContact CG-CD1 3.82Å
1067	K	93.2	Very high	92.5	Very high	27 Å²	27	40.7 Å²	40.7	12%	0.117	19%	0.187	C	C	.	.			trans	-152.2	158.8	-179.4	63.7	-177.9	-179.7	-121.1	0	110.4	D1065 E1069 N1070 I1071 Y1107	D1065-K1067 PolarHBondContact O-N 2.97Å; D1065-K1067 IonicContact OD1-NZ 2.69Å; D1065-K1067 PolarHBondContact OD1-NZ 3.29Å; D1065-K1067 IonicContact OD2-NZ 2.73Å; D1065-K1067 PolarHBondContact OD2-NZ 3.28Å; K1067-E1069 WeakPolarHBondContact CB-OE2 3.2Å; K1067-E1069 HydrophobicContact CD-CB 4.38Å; K1067-E1069 WeakPolarHBondContact CD-OE2 3.25Å; K1067-E1069 HydrophobicContact CG-CB 4.32Å; K1067-E1069 WeakPolarHBondContact CG-OE2 3.46Å; K1067-E1069 PolarHBondContact O-N 2.77Å; K1067-N1070 VanDerWaalsContact CE-OD1 3.29Å; K1067-N1070 WeakPolarHBondContact CE-OD1 3.32Å; K1067-N1070 HydrophobicContact CG-CB 4.07Å; K1067-N1070 PolarHBondContact O-N 3.08Å; K1067-I1071 WeakPolarHBondContact O-CG1 3.38Å; K1067-Y1107 HydrophobicContact CB-CD2 4Å; K1067-Y1107 HydrophobicContact CB-CE2 3.95Å; K1067-Y1107 HydrophobicContact CB-CG 4.41Å
1068	P	93	Very high	92.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-56.2	-32.5	-177.4	-27.4	37.2	0	0	0	114.8	L1027 F1028 I1031 N1070 I1071 Y1107 I1130	L1027-P1068 HydrophobicContact CB-CB 4.04Å; L1027-P1068 WeakPolarHBondContact CB-O 3.45Å; L1027-P1068 HydrophobicContact CD2-CB 4.36Å; L1027-P1068 HydrophobicContact CG-CB 4.14Å; L1027-P1068 PolarHBondContact N-O 3.26Å; F1028-P1068 HydrophobicContact CB-CB 3.97Å; F1028-P1068 PolarHBondContact N-O 3.2Å; I1031-P1068 HydrophobicContact CD1-CB 4.22Å; I1031-P1068 HydrophobicContact CD1-CG 4.19Å; P1068-N1070 PolarHBondContact O-N 3Å; P1068-I1071 PolarHBondContact O-N 2.7Å; P1068-Y1107 VanDerWaalsContact CD-CZ 3.44Å; P1068-Y1107 VanDerWaalsContact CD-OH 3.26Å; P1068-Y1107 WeakPolarHBondContact CD-OH 3.01Å; P1068-Y1107 HydrophobicContact CG-CE1 4.3Å; P1068-I1130 HydrophobicContact CG-CG1 4.3Å
1069	E	91.3	Very high	91.7	Very high	74 Å²	74	46.4 Å²	46.4	35%	0.346	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-65.8	-24	176.6	-53.5	95.5	126.8	0	0	113.1	F1028 K1067	F1028-E1069 HydrophobicContact CB-CG 4.04Å; F1028-E1069 HydrophobicContact CG-CG 4.34Å; K1067-E1069 WeakPolarHBondContact CB-OE2 3.2Å; K1067-E1069 HydrophobicContact CD-CB 4.38Å; K1067-E1069 WeakPolarHBondContact CD-OE2 3.25Å; K1067-E1069 HydrophobicContact CG-CB 4.32Å; K1067-E1069 WeakPolarHBondContact CG-OE2 3.46Å; K1067-E1069 PolarHBondContact O-N 2.77Å
1070	N	94.5	Very high	91.6	Very high	13 Å²	13	48 Å²	48	7%	0.07	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-97.9	9.5	179.2	-72.1	3.5	0	0	0	112.4	D1065 K1067 P1068 A1086	D1065-N1070 VanDerWaalsContact CG-ND2 3.34Å; D1065-N1070 PolarHBondContact O-ND2 3Å; D1065-N1070 PolarHBondContact OD2-ND2 3.33Å; K1067-N1070 VanDerWaalsContact CE-OD1 3.29Å; K1067-N1070 WeakPolarHBondContact CE-OD1 3.32Å; K1067-N1070 HydrophobicContact CG-CB 4.07Å; K1067-N1070 PolarHBondContact O-N 3.08Å; P1068-N1070 PolarHBondContact O-N 3Å; N1070-A1086 PolarHBondContact O-N 2.88Å
1071	I	96.5	Very high	91.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	105.6	-178.2	-63.3	163.9	0	0	0	108.2	D1026 L1027 L1049 L1066 K1067 P1068 V1083 L1085 I1130	D1026-I1071 CarbonylContact C-O 3.58Å; D1026-I1071 WeakPolarHBondContact CA-O 3.24Å; L1027-I1071 HydrophobicContact CB-CB 3.95Å; L1027-I1071 HydrophobicContact CB-CG2 4Å; L1027-I1071 HydrophobicContact CD2-CB 4.22Å; L1027-I1071 HydrophobicContact CD2-CD1 3.95Å; L1027-I1071 HydrophobicContact CD2-CG2 3.99Å; L1027-I1071 PolarHBondContact N-O 3.35Å; L1049-I1071 HydrophobicContact CD1-CD1 3.82Å; L1049-I1071 HydrophobicContact CD2-CD1 3.86Å; L1049-I1071 HydrophobicContact CD2-CG1 3.84Å; L1049-I1071 HydrophobicContact CD2-CG2 3.92Å; L1066-I1071 HydrophobicContact CD1-CD1 4.03Å; L1066-I1071 HydrophobicContact CD1-CG1 4.28Å; K1067-I1071 WeakPolarHBondContact O-CG1 3.38Å; P1068-I1071 PolarHBondContact O-N 2.7Å; I1071-V1083 HydrophobicContact CG2-CB 3.75Å; I1071-V1083 HydrophobicContact CG2-CG1 3.95Å; I1071-V1083 HydrophobicContact CG2-CG2 4.01Å; I1071-L1085 HydrophobicContact CG1-CD1 4.38Å; I1071-I1130 HydrophobicContact CD1-CD1 3.85Å; I1071-I1130 HydrophobicContact CD1-CG2 4.48Å
1072	L	95.8	Very high	91.6	Very high	38 Å²	38	50 Å²	50	20%	0.199	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.4	-174.7	-52.8	-176.6	0	0	0	111.2	V1003 I1022 G1025 D1026 V1083 K1084 A1086	V1003-L1072 HydrophobicContact CG2-CD1 3.87Å; I1022-L1072 HydrophobicContact CB-CB 3.79Å; I1022-L1072 HydrophobicContact CB-CD1 3.83Å; I1022-L1072 HydrophobicContact CB-CG 4.45Å; I1022-L1072 HydrophobicContact CG1-CB 4.03Å; I1022-L1072 HydrophobicContact CG1-CD1 3.76Å; I1022-L1072 HydrophobicContact CG2-CB 3.64Å; G1025-L1072 WeakPolarHBondContact O-CA 3.28Å; D1026-L1072 HydrophobicContact CB-CD2 3.99Å; L1072-V1083 CarbonylContact O-C 3.44Å; L1072-V1083 VanDerWaalsContact O-CA 3.26Å; L1072-V1083 WeakPolarHBondContact O-CA 3.03Å; L1072-V1083 WeakPolarHBondContact O-CB 3.42Å; L1072-K1084 PolarHBondContact N-O 3.23Å; L1072-K1084 PolarHBondContact O-N 2.89Å; L1072-A1086 HydrophobicContact CD1-CB 3.94Å; L1072-A1086 HydrophobicContact CG-CB 3.99Å
1073	L	94.1	Very high	91.8	Very high	9 Å²	9	50 Å²	50	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.5	-176.2	-55.6	-175	0	0	0	111.8	I1022 D1024 G1025 D1026 L1027 I1081 V1083	I1022-L1073 WeakPolarHBondContact CG2-O 3.4Å; D1024-L1073 HydrophobicContact CB-CB 4.29Å; D1024-L1073 WeakPolarHBondContact CB-O 3.34Å; G1025-L1073 PolarHBondContact O-N 2.99Å; D1026-L1073 WeakPolarHBondContact O-CD1 3.39Å; L1027-L1073 HydrophobicContact CB-CD2 4.08Å; L1027-L1073 HydrophobicContact CD1-CD2 3.97Å; L1073-I1081 HydrophobicContact CD2-CG2 4.19Å; L1073-V1083 HydrophobicContact CD2-CG1 3.62Å
1074	L	91.7	Very high	91.9	Very high	53 Å²	53	50.8 Å²	50.8	28%	0.277	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	108.2	172.8	-79.8	169.4	0	0	0	109.2	I1022 R1082 K1084	I1022-L1074 HydrophobicContact CD1-CD2 4.2Å; I1022-L1074 HydrophobicContact CG2-CD2 3.93Å; I1022-L1074 HydrophobicContact CG2-CG 4.01Å; L1074-R1082 HydrophobicContact CB-CB 4.14Å; L1074-R1082 PolarHBondContact N-O 3.03Å; L1074-R1082 PolarHBondContact O-N 2.79Å; L1074-K1084 HydrophobicContact CD1-CD 3.81Å; L1074-K1084 HydrophobicContact CD1-CG 4.12Å
1075	R	89.8	Confident	92.2	Very high	129 Å²	129	49.1 Å²	49.1	49%	0.487	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	108.3	174.3	-168.6	173.1	-61	-76.4	0.8	110	D1024 G1079	D1024-R1075 HydrophobicContact CB-CB 4.43Å; D1024-R1075 PolarHBondContact OD2-N 2.96Å; R1075-G1079 PolarHBondContact NH1-O 2.91Å
1076	Q	88.6	Confident	92.3	Very high	77 Å²	77	48.8 Å²	48.8	36%	0.36	24%	0.235	S	C	.	.			trans	-70.8	160.4	175.6	-69.5	-168.5	-8.9	0	0	111.8	N1078 G1079 Q1080 R1082	Q1076-N1078 WeakPolarHBondContact CB-OD1 3.41Å; Q1076-N1078 PolarHBondContact O-N 3.17Å; Q1076-N1078 PolarHBondContact OE1-ND2 2.88Å; Q1076-N1078 PolarHBondContact OE1-OD1 3.26Å; Q1076-G1079 PolarHBondContact O-N 3.09Å; Q1076-Q1080 HydrophobicContact CB-CB 4.41Å; Q1076-Q1080 PolarHBondContact N-O 2.75Å; Q1076-R1082 HydrophobicContact CG-CG 4.25Å
1077	K	87.7	Confident	91.9	Very high	227 Å²	227	51.4 Å²	51.4	99%	0.987	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.2	179.9	-68	-173.7	177.7	-176.7	0	113.7	G1079	K1077-G1079 PolarHBondContact O-N 3.2Å
1078	N	87.9	Confident	91.7	Very high	112 Å²	112	50.1 Å²	50.1	60%	0.599	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	3.3	174.1	62.4	5.5	0	0	0	113.6	Q1076 Q1080	Q1076-N1078 WeakPolarHBondContact CB-OD1 3.41Å; Q1076-N1078 PolarHBondContact O-N 3.17Å; Q1076-N1078 PolarHBondContact OE1-ND2 2.88Å; Q1076-N1078 PolarHBondContact OE1-OD1 3.26Å; N1078-Q1080 VanDerWaalsContact C-N 3.3Å; N1078-Q1080 PolarHBondContact O-N 2.73Å; N1078-Q1080 WeakPolarHBondContact OD1-CB 3.32Å; N1078-Q1080 PolarHBondContact OD1-N 3.31Å
1079	G	82.6	Confident	91	Very high	41 Å²	41	51 Å²	51	42%	0.423	25%	0.252	S	S	.	.	S	Bend	trans	84.7	-12.1	-176.2	0	0	0	0	0	115.4	R1075 Q1076 K1077	R1075-G1079 PolarHBondContact NH1-O 2.91Å; Q1076-G1079 PolarHBondContact O-N 3.09Å; K1077-G1079 PolarHBondContact O-N 3.2Å
1080	Q	87.5	Confident	90.4	Very high	94 Å²	94	49.3 Å²	49.3	44%	0.439	25%	0.246	S	C	.	.			trans	-61.7	136.2	-179.9	-168.5	179.5	34.3	0	0	110.9	Q1076 N1078	Q1076-Q1080 HydrophobicContact CB-CB 4.41Å; Q1076-Q1080 PolarHBondContact N-O 2.75Å; N1078-Q1080 VanDerWaalsContact C-N 3.3Å; N1078-Q1080 PolarHBondContact O-N 2.73Å; N1078-Q1080 WeakPolarHBondContact OD1-CB 3.32Å; N1078-Q1080 PolarHBondContact OD1-N 3.31Å
1081	I	90.4	Very high	89.9	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.082	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.6	171.5	-55.8	179.1	0	0	0	108	F1037 I1041 I1045 L1073	F1037-I1081 HydrophobicContact CE1-CD1 4.08Å; I1041-I1081 HydrophobicContact CG2-CD1 4.05Å; I1045-I1081 HydrophobicContact CD1-CG2 4.39Å; I1045-I1081 HydrophobicContact CG1-CG2 4.41Å; L1073-I1081 HydrophobicContact CD2-CG2 4.19Å
1082	R	94	Very high	89.3	Confident	79 Å²	79	51.3 Å²	51.3	30%	0.298	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	166.1	167.1	-59.3	-61.1	-63.2	-85.4	0.9	108.8	D1048 L1074 Q1076	D1048-R1082 VanDerWaalsContact CG-NE 3.31Å; D1048-R1082 IonicContact OD1-CZ 2.71Å; D1048-R1082 VanDerWaalsContact OD1-CZ 3.24Å; D1048-R1082 IonicContact OD1-NE 2.91Å; D1048-R1082 PolarHBondContact OD1-NE 2.92Å; D1048-R1082 IonicContact OD1-NH2 3.63Å; D1048-R1082 PolarHBondContact OD1-NH2 2.7Å; D1048-R1082 WeakPolarHBondContact OD2-CA 3.45Å; D1048-R1082 WeakPolarHBondContact OD2-CB 3.29Å; D1048-R1082 IonicContact OD2-CZ 3.56Å; D1048-R1082 IonicContact OD2-NE 2.65Å; D1048-R1082 PolarHBondContact OD2-NE 2.81Å; D1048-R1082 IonicContact OD2-NH2 3.76Å; L1074-R1082 HydrophobicContact CB-CB 4.14Å; L1074-R1082 PolarHBondContact N-O 3.03Å; L1074-R1082 PolarHBondContact O-N 2.79Å; Q1076-R1082 HydrophobicContact CG-CG 4.25Å
1083	V	96.7	Very high	88.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	157.8	177.8	-57.7	0	0	0	0	115.1	N1001 I1045 D1048 L1049 I1071 L1072 L1073	N1001-V1083 PolarHBondContact ND2-O 2.76Å; I1045-V1083 HydrophobicContact CG1-CG1 4.07Å; I1045-V1083 HydrophobicContact CG2-CG1 4.01Å; I1045-V1083 HydrophobicContact CG2-CG2 4.15Å; D1048-V1083 HydrophobicContact CB-CG2 3.52Å; D1048-V1083 PolarHBondContact OD2-N 2.87Å; L1049-V1083 HydrophobicContact CD2-CG2 3.96Å; L1049-V1083 HydrophobicContact CG-CG2 3.91Å; I1071-V1083 HydrophobicContact CG2-CB 3.75Å; I1071-V1083 HydrophobicContact CG2-CG1 3.95Å; I1071-V1083 HydrophobicContact CG2-CG2 4.01Å; L1072-V1083 CarbonylContact O-C 3.44Å; L1072-V1083 VanDerWaalsContact O-CA 3.26Å; L1072-V1083 WeakPolarHBondContact O-CA 3.03Å; L1072-V1083 WeakPolarHBondContact O-CB 3.42Å; L1073-V1083 HydrophobicContact CD2-CG1 3.62Å
1084	K	97.4	Very high	88	Confident	18 Å²	18	52.8 Å²	52.8	8%	0.078	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134	170.5	-82	169.4	173.9	-91.4	0	111.5	P1000 N1001 I1002 V1003 E1020 I1022 L1072 L1074	P1000-K1084 WeakPolarHBondContact O-CE 3.31Å; P1000-K1084 VanDerWaalsContact O-CG 3.32Å; P1000-K1084 WeakPolarHBondContact O-CG 3.15Å; P1000-K1084 PolarHBondContact O-NZ 3.32Å; N1001-K1084 WeakPolarHBondContact O-CA 3.46Å; I1002-K1084 PolarHBondContact O-NZ 2.92Å; V1003-K1084 HydrophobicContact CG2-CB 3.96Å; E1020-K1084 WeakPolarHBondContact OE1-CE 3.2Å; E1020-K1084 IonicContact OE1-NZ 3.2Å; E1020-K1084 PolarHBondContact OE1-NZ 2.85Å; E1020-K1084 IonicContact OE2-NZ 3.95Å; E1020-K1084 PolarHBondContact OE2-NZ 2.87Å; I1022-K1084 HydrophobicContact CD1-CD 3.53Å; I1022-K1084 HydrophobicContact CG1-CD 4.24Å; L1072-K1084 PolarHBondContact N-O 3.23Å; L1072-K1084 PolarHBondContact O-N 2.89Å; L1074-K1084 HydrophobicContact CD1-CD 3.81Å; L1074-K1084 HydrophobicContact CD1-CG 4.12Å
1085	L	97.2	Very high	87.4	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.4	172.2	-176.3	58	0	0	0	111	N1001 V1003 A1052 L1056 L1066 I1071 F1088	N1001-L1085 PolarHBondContact O-N 2.84Å; V1003-L1085 PolarHBondContact N-O 3.35Å; A1052-L1085 HydrophobicContact CB-CB 4.47Å; L1056-L1085 HydrophobicContact CD1-CD2 3.98Å; L1066-L1085 HydrophobicContact CD1-CD1 3.48Å; L1066-L1085 VanDerWaalsContact CD1-CD1 3.48Å; L1066-L1085 HydrophobicContact CD1-CD2 4.47Å; I1071-L1085 HydrophobicContact CG1-CD1 4.38Å; L1085-F1088 HydrophobicContact CD2-CZ 4.21Å; L1085-F1088 HydrophobicContact CG-CE2 4.32Å; L1085-F1088 HydrophobicContact CG-CZ 4.24Å
1086	A	93.2	Very high	86.5	Confident	11 Å²	11	60.5 Å²	60.5	9%	0.091	30%	0.302	C	S	.	.			trans	-132.7	170.1	-175.4	0	0	0	0	0	112.6	V1003 H1063 N1070 L1072	V1003-A1086 HydrophobicContact CB-CB 4.37Å; V1003-A1086 HydrophobicContact CG2-CB 3.72Å; H1063-A1086 PolarHBondContact CE1-O 2.89Å; H1063-A1086 PolarHBondContact NE2-O 3.23Å; N1070-A1086 PolarHBondContact O-N 2.88Å; L1072-A1086 HydrophobicContact CD1-CB 3.94Å; L1072-A1086 HydrophobicContact CG-CB 3.99Å
1087	D	88	Confident	85.6	Confident	59 Å²	59	60.1 Å²	60.1	32%	0.316	31%	0.308	S	S	.	.			trans	57.2	77.4	177.8	-157.1	28.6	0	0	0	115.8	K973 G1089	K973-D1087 IonicContact NZ-OD1 2.77Å; K973-D1087 PolarHBondContact NZ-OD1 3.49Å; D1087-G1089 PolarHBondContact O-N 3.41Å; D1087-G1089 VanDerWaalsContact O-N 3.16Å
1088	F	87.6	Confident	84.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-81.5	15.9	-178.3	-77.1	-107	0	0	0	113.4	E990 I993 L994 I1002 L1056 H1063 L1085 L1090 A1091	E990-F1088 HydrophobicContact CG-CB 4.08Å; I993-F1088 HydrophobicContact CG2-CD1 3.68Å; I993-F1088 HydrophobicContact CG2-CE1 4.28Å; I993-F1088 HydrophobicContact CG2-CG 4.48Å; L994-F1088 HydrophobicContact CD2-CB 4.17Å; L994-F1088 HydrophobicContact CD2-CD2 3.69Å; L994-F1088 HydrophobicContact CD2-CE2 4.31Å; L994-F1088 HydrophobicContact CD2-CG 3.95Å; L994-F1088 HydrophobicContact CG-CB 4.25Å; L994-F1088 HydrophobicContact CG-CG 4.5Å; I1002-F1088 HydrophobicContact CD1-CZ 4.18Å; I1002-F1088 HydrophobicContact CG1-CZ 4.32Å; I1002-F1088 HydrophobicContact CG2-CE2 3.7Å; I1002-F1088 HydrophobicContact CG2-CZ 3.65Å; L1056-F1088 HydrophobicContact CD1-CE1 3.77Å; L1056-F1088 HydrophobicContact CD1-CZ 4.07Å; L1056-F1088 HydrophobicContact CD2-CE1 3.83Å; L1056-F1088 HydrophobicContact CD2-CZ 4.49Å; L1056-F1088 HydrophobicContact CG-CE1 4.47Å; H1063-F1088 AromaticContact CD2-CD1 3.9Å; H1063-F1088 AromaticContact CD2-CE1 3.75Å; H1063-F1088 AromaticContact CD2-CZ 3.95Å; L1085-F1088 HydrophobicContact CD2-CZ 4.21Å; L1085-F1088 HydrophobicContact CG-CE2 4.32Å; L1085-F1088 HydrophobicContact CG-CZ 4.24Å; F1088-L1090 PolarHBondContact O-N 2.76Å; F1088-L1090 VanDerWaalsContact O-N 3.07Å; F1088-A1091 HydrophobicContact CB-CB 4.02Å; F1088-A1091 HydrophobicContact CD1-CB 3.68Å; F1088-A1091 HydrophobicContact CG-CB 4.29Å; F1088-A1091 WeakPolarHBondContact O-CB 3.26Å; F1088-A1091 PolarHBondContact O-N 3.39Å
1089	G	79.7	Confident	84.2	Confident	19 Å²	19	51.6 Å²	51.6	20%	0.196	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-62.7	-14.4	-176.1	0	0	0	0	0	115.8	E990 D1087	E990-G1089 WeakPolarHBondContact OE2-CA 3.08Å; D1087-G1089 PolarHBondContact O-N 3.41Å; D1087-G1089 VanDerWaalsContact O-N 3.16Å
1090	L	78.1	Confident	83.7	Confident	39 Å²	39	53.7 Å²	53.7	20%	0.204	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-113.5	0.4	169.3	-66.7	-172.4	0	0	0	114	M986 H1063 R1064 D1065 F1088 C1102	M986-L1090 HydrophobicContact CE-CD2 3.57Å; H1063-L1090 CarbonylContact O-C 3.43Å; R1064-L1090 HydrophobicContact CB-CB 4.37Å; R1064-L1090 PolarHBondContact NE-O 3.34Å; R1064-L1090 PolarHBondContact NH2-O 3.25Å; D1065-L1090 HydrophobicContact CB-CB 4.21Å; D1065-L1090 HydrophobicContact CB-CD1 4.08Å; D1065-L1090 HydrophobicContact CB-CG 4.45Å; F1088-L1090 PolarHBondContact O-N 2.76Å; F1088-L1090 VanDerWaalsContact O-N 3.07Å; L1090-C1102 HydrophobicContact CD1-CB 4.19Å
1091	A	82.6	Confident	82.9	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.			trans	-64.8	153.3	-179.3	0	0	0	0	0	112	N989 I993 I1061 V1062 H1063 F1088	N989-A1091 PolarHBondContact ND2-O 2.69Å; I993-A1091 HydrophobicContact CD1-CB 3.8Å; I993-A1091 HydrophobicContact CG2-CB 4.47Å; I1061-A1091 HydrophobicContact CG2-CB 4.33Å; V1062-A1091 CarbonylContact O-C 3.51Å; V1062-A1091 WeakPolarHBondContact O-CA 3.4Å; V1062-A1091 WeakPolarHBondContact O-CB 3.48Å; H1063-A1091 PolarHBondContact O-N 3.43Å; F1088-A1091 HydrophobicContact CB-CB 4.02Å; F1088-A1091 HydrophobicContact CD1-CB 3.68Å; F1088-A1091 HydrophobicContact CG-CB 4.29Å; F1088-A1091 WeakPolarHBondContact O-CB 3.26Å; F1088-A1091 PolarHBondContact O-N 3.39Å
1092	L	84.1	Confident	82.2	Confident	55 Å²	55	53.1 Å²	53.1	29%	0.288	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	145.8	-179.6	-170.5	63.9	0	0	0	112.5	I1061 V1062 V1094 M1098	I1061-L1092 WeakPolarHBondContact CA-O 3.39Å; V1062-L1092 HydrophobicContact CG1-CB 4.13Å; V1062-L1092 WeakPolarHBondContact CG1-O 3.32Å; V1062-L1092 PolarHBondContact N-O 2.97Å; V1062-L1092 PolarHBondContact O-N 3.25Å; L1092-V1094 PolarHBondContact O-N 3.24Å; L1092-M1098 HydrophobicContact CD2-CG 4.44Å; L1092-M1098 HydrophobicContact CD2-SD 3.95Å
1093	V	83.5	Confident	81.1	Confident	49 Å²	49	50.6 Å²	50.6	30%	0.297	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	112.1	167.6	-176.2	0	0	0	0	110	S1060 I1061 K1095	S1060-V1093 CarbonylContact O-C 3.58Å; S1060-V1093 WeakPolarHBondContact O-CA 3.38Å; I1061-V1093 HydrophobicContact CG1-CG2 4.06Å; V1093-K1095 HydrophobicContact CG1-CG 4.38Å; V1093-K1095 PolarHBondContact O-N 3.41Å; V1093-K1095 VanDerWaalsContact O-N 3.15Å
1094	V	80.8	Confident	80.3	Confident	29 Å²	29	52.7 Å²	52.7	18%	0.176	28%	0.283	C	S	.	.			trans	-74.5	98.3	179.7	-173.2	0	0	0	0	110.3	S1060 V1062 L1092 M1098 L1120	S1060-V1094 PolarHBondContact O-N 3.4Å; V1062-V1094 HydrophobicContact CB-CG2 3.81Å; V1062-V1094 HydrophobicContact CG1-CG2 3.66Å; L1092-V1094 PolarHBondContact O-N 3.24Å; V1094-M1098 HydrophobicContact CB-CE 4.28Å; V1094-M1098 HydrophobicContact CG1-CE 3.93Å; V1094-M1098 HydrophobicContact CG2-CE 3.42Å; V1094-M1098 VanDerWaalsContact CG2-CE 3.42Å; V1094-M1098 HydrophobicContact CG2-SD 4.11Å; V1094-L1120 HydrophobicContact CB-CD2 4.33Å; V1094-L1120 HydrophobicContact CG2-CD2 3.71Å; V1094-L1120 HydrophobicContact CG2-CG 4.42Å
1095	K	78.7	Confident	79.7	Confident	166 Å²	166	53.8 Å²	53.8	72%	0.722	29%	0.292	S	S	*	.	S	Bend	trans	-94.4	-22.3	172	-63.5	-172.6	178.7	-174.9	0	113.6	V1093	V1093-K1095 HydrophobicContact CG1-CG 4.38Å; V1093-K1095 PolarHBondContact O-N 3.41Å; V1093-K1095 VanDerWaalsContact O-N 3.15Å
1096	K	71.2	Confident	79.2	Confident	179 Å²	179	55.6 Å²	55.6	78%	0.778	30%	0.303	S	S	*	.	S	Bend	trans	-154.1	163.6	178.8	-64.2	-172.1	179.1	-179.6	0	108.2	M1098	K1096-M1098 PolarHBondContact O-N 3.15Å
1097	S	68.9	Low	79.2	Confident	69 Å²	69	56.3 Å²	56.3	48%	0.483	30%	0.303	S	S	.	.			trans	-52.6	137.4	172.8	-46.4	0	0	0	0	111.5	Y1099	S1097-Y1099 VanDerWaalsContact O-CE2 3.3Å; S1097-Y1099 WeakPolarHBondContact O-CE2 2.96Å
1098	M	73.1	Confident	79.4	Confident	16 Å²	16	54 Å²	54	8%	0.079	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-102	150.1	-176.9	-64	163.5	-76.7	0	0	111.3	V1062 L1092 V1094 K1096 G1117 Y1118 G1119	V1062-M1098 HydrophobicContact CB-CE 4.42Å; V1062-M1098 HydrophobicContact CG1-CE 3.83Å; V1062-M1098 HydrophobicContact CG1-SD 3.86Å; L1092-M1098 HydrophobicContact CD2-CG 4.44Å; L1092-M1098 HydrophobicContact CD2-SD 3.95Å; V1094-M1098 HydrophobicContact CB-CE 4.28Å; V1094-M1098 HydrophobicContact CG1-CE 3.93Å; V1094-M1098 HydrophobicContact CG2-CE 3.42Å; V1094-M1098 VanDerWaalsContact CG2-CE 3.42Å; V1094-M1098 HydrophobicContact CG2-SD 4.11Å; K1096-M1098 PolarHBondContact O-N 3.15Å; M1098-G1117 CarbonylContact O-C 3.53Å; M1098-G1117 WeakPolarHBondContact O-CA 2.98Å; M1098-Y1118 HydrophobicContact CB-CD1 4.13Å; M1098-Y1118 HydrophobicContact CB-CD2 4.17Å; M1098-Y1118 HydrophobicContact CB-CE1 3.64Å; M1098-Y1118 HydrophobicContact CB-CE2 3.67Å; M1098-Y1118 HydrophobicContact CB-CG 4.35Å; M1098-Y1118 WeakPolarHBondContact CB-OH 3.48Å; M1098-Y1118 HydrophobicContact CE-CD2 3.62Å; M1098-Y1118 HydrophobicContact CE-CE2 3.37Å; M1098-Y1118 WeakPolarHBondContact CE-O 3.32Å; M1098-Y1118 HydrophobicContact CG-CE2 4.31Å; M1098-Y1118 PolarHBondContact N-O 3.07Å; M1098-Y1118 WeakPolarHBondContact O-CD1 3.5Å; M1098-Y1118 WeakPolarHBondContact O-CE1 3.32Å; M1098-Y1118 PolarHBondContact O-N 3.39Å; M1098-Y1118 HydrophobicContact SD-CD2 4.48Å; M1098-Y1118 HydrophobicContact SD-CE2 3.68Å; M1098-G1119 WeakPolarHBondContact CE-O 3.26Å
1099	Y	74.2	Confident	79.7	Confident	143 Å²	143	54 Å²	54	56%	0.561	29%	0.291	S	S	*	.			trans	-128.1	12.4	-175.4	-60.1	-90.1	0	0	0	112.8	S1097 E1115	S1097-Y1099 VanDerWaalsContact O-CE2 3.3Å; S1097-Y1099 WeakPolarHBondContact O-CE2 2.96Å; Y1099-E1115 VanDerWaalsContact CD1-O 3.26Å; Y1099-E1115 WeakPolarHBondContact CD1-O 3.33Å
1100	T	71.2	Confident	80.3	Confident	86 Å²	86	53.1 Å²	53.1	53%	0.528	28%	0.282	S	S	.	.			trans	-87.7	111.7	-179.3	-54.4	0	0	0	0	110.5	C1102 Y1118	T1100-C1102 PolarHBondContact O-N 2.95Å; T1100-C1102 VanDerWaalsContact O-N 3.16Å; T1100-Y1118 WeakPolarHBondContact O-CE1 3.18Å; T1100-Y1118 PolarHBondContact O-OH 3.39Å
1101	V	71.4	Confident	81	Confident	78 Å²	78	51.4 Å²	51.4	47%	0.473	27%	0.273	S	S	.	.			trans	-65.4	112.3	171.1	-176.4	0	0	0	0	109.6	I1112 E1115	V1101-I1112 HydrophobicContact CB-CG2 4.41Å; V1101-I1112 HydrophobicContact CG1-CG2 4.25Å; V1101-E1115 HydrophobicContact CG2-CG 3.96Å
1102	C	75.7	Confident	81.3	Confident	20 Å²	20	51.8 Å²	51.8	14%	0.135	28%	0.275	C	S	.	.			trans	-153.6	165.4	178.9	63.3	0	0	0	0	112.1	L1090 T1100	L1090-C1102 HydrophobicContact CD1-CB 4.19Å; T1100-C1102 PolarHBondContact O-N 2.95Å; T1100-C1102 VanDerWaalsContact O-N 3.16Å
1103	G	70.6	Confident	81.4	Confident	26 Å²	26	50.3 Å²	50.3	27%	0.268	27%	0.267	S	S	.	.	S	Bend	trans	107.7	172.5	-177.8	0	0	0	0	0	113.1
1104	T	78.6	Confident	81.6	Confident	44 Å²	44	52.2 Å²	52.2	27%	0.27	27%	0.273	S	S	.	.			trans	-82.6	124.3	177.1	-69.9	0	0	0	0	110.5	T1106 Y1107 I1108	T1104-T1106 PolarHBondContact O-N 3.24Å; T1104-Y1107 HydrophobicContact CG2-CD2 3.78Å; T1104-Y1107 HydrophobicContact CG2-CE2 3.91Å; T1104-Y1107 PolarHBondContact O-N 2.84Å; T1104-I1108 PolarHBondContact O-N 2.59Å
1105	P	85.2	Confident	81.7	Confident	40 Å²	40	56.7 Å²	56.7	26%	0.26	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-31.6	-169.2	-36.6	37.8	0	0	0	118.7	Y1107 L1151 F1152 I1155	P1105-Y1107 VanDerWaalsContact C-N 3.29Å; P1105-Y1107 PolarHBondContact O-N 2.99Å; P1105-L1151 HydrophobicContact CB-CD2 4.3Å; P1105-F1152 HydrophobicContact CB-CE1 3.98Å; P1105-F1152 HydrophobicContact CB-CZ 4.34Å; P1105-I1155 WeakPolarHBondContact O-CD1 3.45Å
1106	T	87.5	Confident	81.7	Confident	39 Å²	39	52.2 Å²	52.2	24%	0.239	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.3	178.1	-46.5	0	0	0	0	113.5	T1104 A1139	T1104-T1106 PolarHBondContact O-N 3.24Å; T1106-A1139 HydrophobicContact CG2-CB 3.63Å
1107	Y	93.5	Very high	82	Confident	26 Å²	26	44.6 Å²	44.6	10%	0.102	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-3.3	-172.6	-49.7	-87.1	0	0	0	113.1	K1067 P1068 T1104 P1105 I1129 I1130 I1133	K1067-Y1107 HydrophobicContact CB-CD2 4Å; K1067-Y1107 HydrophobicContact CB-CE2 3.95Å; K1067-Y1107 HydrophobicContact CB-CG 4.41Å; P1068-Y1107 VanDerWaalsContact CD-CZ 3.44Å; P1068-Y1107 VanDerWaalsContact CD-OH 3.26Å; P1068-Y1107 WeakPolarHBondContact CD-OH 3.01Å; P1068-Y1107 HydrophobicContact CG-CE1 4.3Å; T1104-Y1107 HydrophobicContact CG2-CD2 3.78Å; T1104-Y1107 HydrophobicContact CG2-CE2 3.91Å; T1104-Y1107 PolarHBondContact O-N 2.84Å; P1105-Y1107 VanDerWaalsContact C-N 3.29Å; P1105-Y1107 PolarHBondContact O-N 2.99Å; Y1107-I1129 HydrophobicContact CD1-CB 4.02Å; Y1107-I1129 HydrophobicContact CD1-CG2 3.48Å; Y1107-I1129 VanDerWaalsContact CD1-CG2 3.48Å; Y1107-I1129 HydrophobicContact CE1-CG2 3.75Å; Y1107-I1129 HydrophobicContact CG-CG2 4.36Å; Y1107-I1130 HydrophobicContact CD1-CD1 4.44Å; Y1107-I1130 HydrophobicContact CD1-CG1 3.9Å; Y1107-I1130 HydrophobicContact CE1-CG1 3.76Å; Y1107-I1133 HydrophobicContact CE1-CD1 3.68Å
1108	I	91.2	Very high	82.8	Confident	10 Å²	10	41.6 Å²	41.6	5%	0.051	23%	0.232	C	C	.	.			trans	-66.9	134.9	179.5	-62.8	-177.7	0	0	0	110	T1104 I1112 L1113 W1125	T1104-I1108 PolarHBondContact O-N 2.59Å; I1108-I1112 HydrophobicContact CG2-CB 3.67Å; I1108-I1112 HydrophobicContact CG2-CD1 3.98Å; I1108-I1112 HydrophobicContact CG2-CG1 4.37Å; I1108-I1112 HydrophobicContact CG2-CG2 3.83Å; I1108-L1113 HydrophobicContact CG2-CD1 4.45Å; I1108-L1113 HydrophobicContact CG2-CD2 3.75Å; I1108-L1113 HydrophobicContact CG2-CG 3.78Å; I1108-W1125 PolarHBondContact O-NE1 2.8Å
1109	A	93.7	Very high	83.6	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	23%	0.234	C	C	.	.			trans	-78.7	149.2	176.4	0	0	0	0	0	112.2	E1111 I1112 V1122 W1125	A1109-E1111 VanDerWaalsContact C-N 3.3Å; A1109-E1111 HydrophobicContact CB-CG 4.47Å; A1109-E1111 WeakPolarHBondContact CB-OE2 3.2Å; A1109-E1111 PolarHBondContact O-N 3.47Å; A1109-I1112 HydrophobicContact CB-CD1 4.23Å; A1109-I1112 HydrophobicContact CB-CG1 4.4Å; A1109-I1112 WeakPolarHBondContact O-CB 3.45Å; A1109-I1112 PolarHBondContact O-N 2.96Å; A1109-I1112 VanDerWaalsContact O-N 3.08Å; A1109-V1122 HydrophobicContact CB-CB 4Å; A1109-V1122 HydrophobicContact CB-CG1 3.89Å; A1109-W1125 VanDerWaalsContact CA-CD1 3.47Å; A1109-W1125 HydrophobicContact CB-CB 3.87Å; A1109-W1125 HydrophobicContact CB-CD2 4.36Å; A1109-W1125 HydrophobicContact CB-CG 3.76Å
1110	P	93.8	Very high	84.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-39.5	-175.4	25	-36.3	0	0	0	112.8	I1112 L1113 E1114 W1125 I1155 I1184	P1110-I1112 PolarHBondContact O-N 2.93Å; P1110-L1113 CarbonylContact O-C 3.6Å; P1110-L1113 WeakPolarHBondContact O-CA 3.31Å; P1110-L1113 WeakPolarHBondContact O-CB 3.47Å; P1110-L1113 PolarHBondContact O-N 3.16Å; P1110-E1114 WeakPolarHBondContact O-CG 3.47Å; P1110-E1114 PolarHBondContact O-N 3.41Å; P1110-W1125 HydrophobicContact CG-CE3 4.37Å; P1110-W1125 HydrophobicContact CG-CH2 4.2Å; P1110-W1125 HydrophobicContact CG-CZ3 4.07Å; P1110-I1155 HydrophobicContact CB-CG2 4.27Å; P1110-I1184 HydrophobicContact CB-CD1 3.8Å; P1110-I1184 HydrophobicContact CG-CD1 3.61Å; P1110-I1184 HydrophobicContact CG-CG2 4.48Å
1111	E	92.9	Very high	85.7	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.019	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-23.1	179.6	64.8	-91	-150.3	0	0	114	A1109 E1115 S1116 V1122 P1186 R1189	A1109-E1111 VanDerWaalsContact C-N 3.3Å; A1109-E1111 HydrophobicContact CB-CG 4.47Å; A1109-E1111 WeakPolarHBondContact CB-OE2 3.2Å; A1109-E1111 PolarHBondContact O-N 3.47Å; E1111-E1115 PolarHBondContact O-N 3.28Å; E1111-S1116 PolarHBondContact O-N 3.38Å; E1111-S1116 PolarHBondContact O-OG 2.84Å; E1111-V1122 HydrophobicContact CG-CG1 4.11Å; E1111-V1122 WeakPolarHBondContact OE1-CG1 3.41Å; E1111-P1186 HydrophobicContact CB-CG 4.13Å; E1111-P1186 HydrophobicContact CG-CG 4.04Å; E1111-R1189 IonicContact OE1-CZ 3.84Å; E1111-R1189 IonicContact OE1-NH1 2.63Å; E1111-R1189 PolarHBondContact OE1-NH1 3.36Å; E1111-R1189 IonicContact OE1-NH2 2.81Å; E1111-R1189 PolarHBondContact OE1-NH2 3.42Å; E1111-R1189 IonicContact OE2-CZ 2.7Å; E1111-R1189 IonicContact OE2-NH1 3.74Å; E1111-R1189 IonicContact OE2-NH2 2.98Å; E1111-R1189 PolarHBondContact OE2-NH2 3.11Å
1112	I	88.2	Confident	86.9	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-73.6	-43	171.9	-58.5	172.5	0	0	0	109.6	V1101 I1108 A1109 P1110 E1114 E1115 Y1118 V1122	V1101-I1112 HydrophobicContact CB-CG2 4.41Å; V1101-I1112 HydrophobicContact CG1-CG2 4.25Å; I1108-I1112 HydrophobicContact CG2-CB 3.67Å; I1108-I1112 HydrophobicContact CG2-CD1 3.98Å; I1108-I1112 HydrophobicContact CG2-CG1 4.37Å; I1108-I1112 HydrophobicContact CG2-CG2 3.83Å; A1109-I1112 HydrophobicContact CB-CD1 4.23Å; A1109-I1112 HydrophobicContact CB-CG1 4.4Å; A1109-I1112 WeakPolarHBondContact O-CB 3.45Å; A1109-I1112 PolarHBondContact O-N 2.96Å; A1109-I1112 VanDerWaalsContact O-N 3.08Å; P1110-I1112 PolarHBondContact O-N 2.93Å; I1112-E1114 VanDerWaalsContact C-N 3.27Å; I1112-E1114 PolarHBondContact O-N 2.82Å; I1112-E1115 PolarHBondContact O-N 3.14Å; I1112-Y1118 HydrophobicContact CB-CD1 4.4Å; I1112-Y1118 HydrophobicContact CG1-CD1 3.74Å; I1112-Y1118 HydrophobicContact CG1-CD2 4.26Å; I1112-Y1118 HydrophobicContact CG1-CE1 4.22Å; I1112-Y1118 HydrophobicContact CG1-CG 3.8Å; I1112-V1122 HydrophobicContact CD1-CB 3.99Å; I1112-V1122 HydrophobicContact CD1-CG1 3.78Å; I1112-V1122 HydrophobicContact CG1-CG1 3.85Å
1113	L	86.3	Confident	87.9	Confident	25 Å²	25	30.8 Å²	30.8	13%	0.131	18%	0.178	C	C	.	.	H	α-helix	trans	-72.9	-20.3	-179.9	-58.8	175.1	0	0	0	112.8	I1108 P1110 F1152 I1155 K1156	I1108-L1113 HydrophobicContact CG2-CD1 4.45Å; I1108-L1113 HydrophobicContact CG2-CD2 3.75Å; I1108-L1113 HydrophobicContact CG2-CG 3.78Å; P1110-L1113 CarbonylContact O-C 3.6Å; P1110-L1113 WeakPolarHBondContact O-CA 3.31Å; P1110-L1113 WeakPolarHBondContact O-CB 3.47Å; P1110-L1113 PolarHBondContact O-N 3.16Å; L1113-F1152 HydrophobicContact CD1-CB 3.97Å; L1113-F1152 HydrophobicContact CD1-CD1 3.64Å; L1113-F1152 HydrophobicContact CD1-CE1 4.47Å; L1113-F1152 HydrophobicContact CD1-CG 4.07Å; L1113-F1152 HydrophobicContact CD2-CD1 3.66Å; L1113-F1152 HydrophobicContact CD2-CE1 3.81Å; L1113-F1152 HydrophobicContact CD2-CG 4.08Å; L1113-F1152 HydrophobicContact CD2-CZ 4.35Å; L1113-F1152 HydrophobicContact CG-CD1 4.32Å; L1113-I1155 HydrophobicContact CD1-CB 3.96Å; L1113-I1155 HydrophobicContact CD1-CD1 4.3Å; L1113-I1155 HydrophobicContact CD1-CG2 3.6Å; L1113-K1156 VanDerWaalsContact CB-CE 3.48Å; L1113-K1156 HydrophobicContact CB-CG 4.35Å; L1113-K1156 WeakPolarHBondContact O-CE 3.2Å; L1113-K1156 PolarHBondContact O-NZ 3.36Å
1114	E	86.2	Confident	89.3	Confident	88 Å²	88	29.7 Å²	29.7	41%	0.411	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-9.9	175.8	-70.6	169.3	-175.3	0	0	113.3	P1110 I1112 S1116 K1156	P1110-E1114 WeakPolarHBondContact O-CG 3.47Å; P1110-E1114 PolarHBondContact O-N 3.41Å; I1112-E1114 VanDerWaalsContact C-N 3.27Å; I1112-E1114 PolarHBondContact O-N 2.82Å; E1114-S1116 PolarHBondContact O-N 3.14Å; E1114-S1116 VanDerWaalsContact O-N 3.09Å; E1114-K1156 HydrophobicContact CG-CD 3.86Å; E1114-K1156 HydrophobicContact CG-CG 4.18Å
1115	E	83.2	Confident	90.2	Very high	124 Å²	124	27.6 Å²	27.6	58%	0.579	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	26.8	-175	-59.3	-175.9	-160.4	0	0	112.9	Y1099 V1101 E1111 I1112 G1117	Y1099-E1115 VanDerWaalsContact CD1-O 3.26Å; Y1099-E1115 WeakPolarHBondContact CD1-O 3.33Å; V1101-E1115 HydrophobicContact CG2-CG 3.96Å; E1111-E1115 PolarHBondContact O-N 3.28Å; I1112-E1115 PolarHBondContact O-N 3.14Å; E1115-G1117 PolarHBondContact O-N 3.49Å
1116	S	79.2	Confident	90.8	Very high	72 Å²	72	25.9 Å²	25.9	50%	0.503	14%	0.142	S	C	.	.	S	Bend	trans	-78.2	-6.4	-174	52.9	0	0	0	0	113.9	E1111 E1114	E1111-S1116 PolarHBondContact O-N 3.38Å; E1111-S1116 PolarHBondContact O-OG 2.84Å; E1114-S1116 PolarHBondContact O-N 3.14Å; E1114-S1116 VanDerWaalsContact O-N 3.09Å
1117	G	78.3	Confident	91.3	Very high	19 Å²	19	24 Å²	24	20%	0.196	13%	0.131	C	C	.	.			trans	96.4	107.2	-175.3	0	0	0	0	0	111	M1098 E1115	M1098-G1117 CarbonylContact O-C 3.53Å; M1098-G1117 WeakPolarHBondContact O-CA 2.98Å; E1115-G1117 PolarHBondContact O-N 3.49Å
1118	Y	85.3	Confident	91.5	Very high	5 Å²	5	22.8 Å²	22.8	2%	0.02	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-108.6	160.3	-176	73	-95.4	0	0	0	112.9	R1064 M1098 T1100 I1112 V1122	R1064-Y1118 VanDerWaalsContact CD-OH 3.22Å; R1064-Y1118 WeakPolarHBondContact CD-OH 3.26Å; R1064-Y1118 HydrophobicContact CG-CE2 4.26Å; R1064-Y1118 PolarHBondContact NH1-OH 3.47Å; M1098-Y1118 HydrophobicContact CB-CD1 4.13Å; M1098-Y1118 HydrophobicContact CB-CD2 4.17Å; M1098-Y1118 HydrophobicContact CB-CE1 3.64Å; M1098-Y1118 HydrophobicContact CB-CE2 3.67Å; M1098-Y1118 HydrophobicContact CB-CG 4.35Å; M1098-Y1118 WeakPolarHBondContact CB-OH 3.48Å; M1098-Y1118 HydrophobicContact CE-CD2 3.62Å; M1098-Y1118 HydrophobicContact CE-CE2 3.37Å; M1098-Y1118 WeakPolarHBondContact CE-O 3.32Å; M1098-Y1118 HydrophobicContact CG-CE2 4.31Å; M1098-Y1118 PolarHBondContact N-O 3.07Å; M1098-Y1118 WeakPolarHBondContact O-CD1 3.5Å; M1098-Y1118 WeakPolarHBondContact O-CE1 3.32Å; M1098-Y1118 PolarHBondContact O-N 3.39Å; M1098-Y1118 HydrophobicContact SD-CD2 4.48Å; M1098-Y1118 HydrophobicContact SD-CE2 3.68Å; T1100-Y1118 WeakPolarHBondContact O-CE1 3.18Å; T1100-Y1118 PolarHBondContact O-OH 3.39Å; I1112-Y1118 HydrophobicContact CB-CD1 4.4Å; I1112-Y1118 HydrophobicContact CG1-CD1 3.74Å; I1112-Y1118 HydrophobicContact CG1-CD2 4.26Å; I1112-Y1118 HydrophobicContact CG1-CE1 4.22Å; I1112-Y1118 HydrophobicContact CG1-CG 3.8Å; Y1118-V1122 HydrophobicContact CD2-CG1 3.59Å; Y1118-V1122 HydrophobicContact CD2-CG2 4.12Å; Y1118-V1122 HydrophobicContact CE2-CG2 4.47Å; Y1118-V1122 HydrophobicContact CG-CG1 3.92Å
1119	G	89.9	Confident	91.8	Very high	12 Å²	12	22.3 Å²	22.3	12%	0.124	12%	0.124	C	C	.	.			trans	-125.9	-133.5	-175.6	0	0	0	0	0	113.9	V1062 M1098 E1121	V1062-G1119 WeakPolarHBondContact CG2-O 3.15Å; M1098-G1119 WeakPolarHBondContact CE-O 3.26Å; G1119-E1121 VanDerWaalsContact C-OE2 3.27Å; G1119-E1121 WeakPolarHBondContact CA-OE2 3.43Å
1120	L	94.2	Very high	92	Very high	33 Å²	33	22.3 Å²	22.3	17%	0.173	12%	0.123	C	C	.	.	S	Bend	trans	-82.1	-23.6	178.5	-59.3	171.1	0	0	0	112	H1057 V1062 V1094 V1122 D1123	H1057-L1120 HydrophobicContact CB-CD1 4.06Å; H1057-L1120 PolarHBondContact CE1-O 2.86Å; H1057-L1120 PolarHBondContact NE2-O 3.3Å; V1062-L1120 HydrophobicContact CB-CD2 4.12Å; V1094-L1120 HydrophobicContact CB-CD2 4.33Å; V1094-L1120 HydrophobicContact CG2-CD2 3.71Å; V1094-L1120 HydrophobicContact CG2-CG 4.42Å; L1120-V1122 PolarHBondContact O-N 2.86Å; L1120-V1122 VanDerWaalsContact O-N 3.11Å; L1120-D1123 PolarHBondContact O-N 2.86Å
1121	E	96	Very high	92.1	Very high	65 Å²	65	22.3 Å²	22.3	30%	0.304	12%	0.123	S	C	.	.	H	α-helix	trans	-64.3	-18.9	-170.9	-58.8	75.4	-166.3	0	0	112.9	G1119 D1123 M1124 W1125 P1186 R1189	G1119-E1121 VanDerWaalsContact C-OE2 3.27Å; G1119-E1121 WeakPolarHBondContact CA-OE2 3.43Å; E1121-D1123 VanDerWaalsContact C-N 3.32Å; E1121-D1123 PolarHBondContact O-N 2.67Å; E1121-M1124 WeakPolarHBondContact O-CB 3.39Å; E1121-M1124 PolarHBondContact O-N 3.22Å; E1121-W1125 PolarHBondContact O-N 3.04Å; E1121-W1125 VanDerWaalsContact O-N 3.17Å; E1121-P1186 HydrophobicContact CB-CB 3.85Å; E1121-P1186 HydrophobicContact CG-CB 3.94Å; E1121-R1189 VanDerWaalsContact C-NH1 3.33Å; E1121-R1189 PolarHBondContact O-NH1 2.95Å
1122	V	95.9	Very high	92.3	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.03	12%	0.123	C	C	.	.	H	α-helix	trans	-65.6	-33.2	177.6	-57.3	0	0	0	0	112.4	V1062 A1109 E1111 I1112 Y1118 L1120 M1124 W1125 A1126	V1062-V1122 HydrophobicContact CG2-CG2 3.52Å; A1109-V1122 HydrophobicContact CB-CB 4Å; A1109-V1122 HydrophobicContact CB-CG1 3.89Å; E1111-V1122 HydrophobicContact CG-CG1 4.11Å; E1111-V1122 WeakPolarHBondContact OE1-CG1 3.41Å; I1112-V1122 HydrophobicContact CD1-CB 3.99Å; I1112-V1122 HydrophobicContact CD1-CG1 3.78Å; I1112-V1122 HydrophobicContact CG1-CG1 3.85Å; Y1118-V1122 HydrophobicContact CD2-CG1 3.59Å; Y1118-V1122 HydrophobicContact CD2-CG2 4.12Å; Y1118-V1122 HydrophobicContact CE2-CG2 4.47Å; Y1118-V1122 HydrophobicContact CG-CG1 3.92Å; L1120-V1122 PolarHBondContact O-N 2.86Å; L1120-V1122 VanDerWaalsContact O-N 3.11Å; V1122-M1124 VanDerWaalsContact C-N 3.28Å; V1122-M1124 PolarHBondContact O-N 3.07Å; V1122-W1125 PolarHBondContact O-N 3.29Å; V1122-A1126 PolarHBondContact O-N 2.98Å; V1122-A1126 VanDerWaalsContact O-N 3.12Å
1123	D	97.4	Very high	92.6	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-69.5	-31.7	175.7	-59.4	-33.6	0	0	0	110.7	L1053 H1057 V1062 H1063 R1064 L1066 L1120 E1121 A1126 L1127	L1053-D1123 HydrophobicContact CD1-CB 4.01Å; L1053-D1123 HydrophobicContact CD2-CB 3.71Å; L1053-D1123 HydrophobicContact CG-CB 4.49Å; H1057-D1123 IonicContact CD2-OD2 3.29Å; H1057-D1123 IonicContact CE1-OD2 3.41Å; H1057-D1123 IonicContact NE2-OD2 3.24Å; H1057-D1123 PolarHBondContact NE2-OD2 3.17Å; V1062-D1123 WeakPolarHBondContact CA-OD2 3.47Å; V1062-D1123 WeakPolarHBondContact CG2-OD2 3.43Å; H1063-D1123 WeakPolarHBondContact CB-OD1 3.35Å; H1063-D1123 PolarHBondContact N-OD1 3.38Å; H1063-D1123 PolarHBondContact N-OD2 3.34Å; R1064-D1123 PolarHBondContact N-OD1 3.06Å; L1066-D1123 WeakPolarHBondContact CD2-O 3.46Å; L1120-D1123 PolarHBondContact O-N 2.86Å; E1121-D1123 VanDerWaalsContact C-N 3.32Å; E1121-D1123 PolarHBondContact O-N 2.67Å; D1123-A1126 PolarHBondContact O-N 2.87Å; D1123-L1127 WeakPolarHBondContact O-CB 3.19Å; D1123-L1127 PolarHBondContact O-N 3.41Å
1124	M	98.4	Very high	93	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-71.3	-38	177.6	-56.8	-51.5	-53.5	0	0	111.7	L1053 E1121 V1122 L1127 G1128 L1181 L1190 A1192 T1195	L1053-M1124 HydrophobicContact CB-SD 4.46Å; L1053-M1124 HydrophobicContact CD1-SD 3.81Å; E1121-M1124 WeakPolarHBondContact O-CB 3.39Å; E1121-M1124 PolarHBondContact O-N 3.22Å; V1122-M1124 VanDerWaalsContact C-N 3.28Å; V1122-M1124 PolarHBondContact O-N 3.07Å; M1124-L1127 HydrophobicContact CE-CD2 3.9Å; M1124-L1127 PolarHBondContact O-N 3.21Å; M1124-G1128 PolarHBondContact O-N 3.3Å; M1124-L1181 HydrophobicContact CB-CD2 4.19Å; M1124-L1181 HydrophobicContact CE-CD2 3.65Å; M1124-L1190 WeakPolarHBondContact CG-O 3.12Å; M1124-A1192 HydrophobicContact CE-CB 4.19Å; M1124-A1192 HydrophobicContact SD-CB 3.77Å; M1124-T1195 WeakPolarHBondContact CE-OG1 3.42Å
1125	W	98	Very high	93.3	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.9	-49.8	170.2	175.4	-87.4	0	0	0	111	I1108 A1109 P1110 E1121 V1122 L1127 G1128 I1129 F1141 I1155 L1182 I1184	I1108-W1125 PolarHBondContact O-NE1 2.8Å; A1109-W1125 VanDerWaalsContact CA-CD1 3.47Å; A1109-W1125 HydrophobicContact CB-CB 3.87Å; A1109-W1125 HydrophobicContact CB-CD2 4.36Å; A1109-W1125 HydrophobicContact CB-CG 3.76Å; P1110-W1125 HydrophobicContact CG-CE3 4.37Å; P1110-W1125 HydrophobicContact CG-CH2 4.2Å; P1110-W1125 HydrophobicContact CG-CZ3 4.07Å; E1121-W1125 PolarHBondContact O-N 3.04Å; E1121-W1125 VanDerWaalsContact O-N 3.17Å; V1122-W1125 PolarHBondContact O-N 3.29Å; W1125-L1127 VanDerWaalsContact C-N 3.29Å; W1125-L1127 PolarHBondContact O-N 2.85Å; W1125-G1128 WeakPolarHBondContact O-CA 3.32Å; W1125-G1128 PolarHBondContact O-N 3.3Å; W1125-I1129 WeakPolarHBondContact O-CG1 3.37Å; W1125-I1129 PolarHBondContact O-N 2.94Å; W1125-F1141 AromaticContact CH2-CE2 3.72Å; W1125-F1141 HydrophobicContact CH2-CE2 3.72Å; W1125-F1141 AromaticContact CH2-CZ 3.76Å; W1125-F1141 HydrophobicContact CH2-CZ 3.76Å; W1125-F1141 HydrophobicContact CZ2-CD2 4.15Å; W1125-F1141 AromaticContact CZ2-CE2 3.33Å; W1125-F1141 HydrophobicContact CZ2-CE2 3.33Å; W1125-F1141 AromaticContact CZ2-CZ 3.86Å; W1125-F1141 HydrophobicContact CZ2-CZ 3.86Å; W1125-I1155 HydrophobicContact CZ2-CG2 3.91Å; W1125-L1182 HydrophobicContact CD2-CD2 3.89Å; W1125-L1182 HydrophobicContact CE3-CD2 3.99Å; W1125-L1182 HydrophobicContact CG-CD2 4.35Å; W1125-L1182 HydrophobicContact CZ2-CD2 4.47Å; W1125-L1182 HydrophobicContact CZ3-CB 4.28Å; W1125-L1182 HydrophobicContact CZ3-CD2 4.34Å; W1125-L1182 WeakPolarHBondContact CZ3-O 3.36Å; W1125-I1184 HydrophobicContact CH2-CD1 4.1Å; W1125-I1184 HydrophobicContact CZ3-CD1 4.22Å
1126	A	97.8	Very high	93.6	Very high	5 Å²	5	11.7 Å²	11.7	4%	0.041	7%	0.074	C	C	.	.	H	α-helix	trans	-59.6	-38.1	177.4	0	0	0	0	0	112.5	L1066 V1122 D1123 G1128 I1129 I1130	L1066-A1126 HydrophobicContact CB-CB 3.91Å; L1066-A1126 HydrophobicContact CD2-CB 4.07Å; L1066-A1126 HydrophobicContact CG-CB 4.31Å; V1122-A1126 PolarHBondContact O-N 2.98Å; V1122-A1126 VanDerWaalsContact O-N 3.12Å; D1123-A1126 PolarHBondContact O-N 2.87Å; A1126-G1128 VanDerWaalsContact C-N 3.34Å; A1126-G1128 PolarHBondContact O-N 3.15Å; A1126-I1129 PolarHBondContact O-N 3.35Å; A1126-I1130 WeakPolarHBondContact O-CD1 3.49Å; A1126-I1130 VanDerWaalsContact O-CG1 3.25Å; A1126-I1130 WeakPolarHBondContact O-CG1 3.32Å; A1126-I1130 PolarHBondContact O-N 2.76Å
1127	L	98.3	Very high	94	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-61.4	-40.4	171.7	-177.7	62.7	0	0	0	112	V1046 L1049 A1050 L1053 L1066 D1123 M1124 W1125 I1130 T1131 L1181 T1195	V1046-L1127 HydrophobicContact CG1-CD1 4.48Å; V1046-L1127 HydrophobicContact CG1-CD2 4.44Å; V1046-L1127 HydrophobicContact CG2-CD1 4.44Å; L1049-L1127 HydrophobicContact CB-CD1 3.79Å; L1049-L1127 HydrophobicContact CD1-CD1 3.8Å; L1049-L1127 HydrophobicContact CG-CD1 4.46Å; A1050-L1127 HydrophobicContact CB-CD2 4.31Å; L1053-L1127 HydrophobicContact CD1-CB 4.4Å; L1053-L1127 HydrophobicContact CD1-CD2 4.22Å; L1066-L1127 HydrophobicContact CD2-CB 4.15Å; D1123-L1127 WeakPolarHBondContact O-CB 3.19Å; D1123-L1127 PolarHBondContact O-N 3.41Å; M1124-L1127 HydrophobicContact CE-CD2 3.9Å; M1124-L1127 PolarHBondContact O-N 3.21Å; W1125-L1127 VanDerWaalsContact C-N 3.29Å; W1125-L1127 PolarHBondContact O-N 2.85Å; L1127-I1130 PolarHBondContact O-N 2.85Å; L1127-T1131 WeakPolarHBondContact O-CB 3.32Å; L1127-T1131 PolarHBondContact O-N 2.98Å; L1127-T1131 PolarHBondContact O-OG1 3.48Å; L1127-L1181 HydrophobicContact CG-CD1 4.44Å; L1127-T1195 HydrophobicContact CD2-CG2 4.07Å
1128	G	98.1	Very high	94.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-59.8	-46.6	172.4	0	0	0	0	0	112.8	M1124 W1125 A1126 I1130 T1131 Y1132	M1124-G1128 PolarHBondContact O-N 3.3Å; W1125-G1128 WeakPolarHBondContact O-CA 3.32Å; W1125-G1128 PolarHBondContact O-N 3.3Å; A1126-G1128 VanDerWaalsContact C-N 3.34Å; A1126-G1128 PolarHBondContact O-N 3.15Å; G1128-I1130 PolarHBondContact O-N 2.84Å; G1128-T1131 PolarHBondContact O-N 3.4Å; G1128-Y1132 WeakPolarHBondContact O-CB 3.22Å; G1128-Y1132 PolarHBondContact O-N 3.49Å
1129	I	97.1	Very high	94.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.1	-46.9	175.6	-59.7	-63.5	0	0	0	110.9	Y1107 W1125 A1126 Y1132 I1133 P1140 F1141 L1182	Y1107-I1129 HydrophobicContact CD1-CB 4.02Å; Y1107-I1129 HydrophobicContact CD1-CG2 3.48Å; Y1107-I1129 VanDerWaalsContact CD1-CG2 3.48Å; Y1107-I1129 HydrophobicContact CE1-CG2 3.75Å; Y1107-I1129 HydrophobicContact CG-CG2 4.36Å; W1125-I1129 WeakPolarHBondContact O-CG1 3.37Å; W1125-I1129 PolarHBondContact O-N 2.94Å; A1126-I1129 PolarHBondContact O-N 3.35Å; I1129-Y1132 PolarHBondContact O-N 2.91Å; I1129-I1133 HydrophobicContact CG2-CD1 3.81Å; I1129-I1133 VanDerWaalsContact O-CG1 3.26Å; I1129-I1133 WeakPolarHBondContact O-CG1 3.47Å; I1129-I1133 PolarHBondContact O-N 2.73Å; I1129-P1140 HydrophobicContact CD1-CG 3.48Å; I1129-P1140 VanDerWaalsContact CD1-CG 3.48Å; I1129-F1141 HydrophobicContact CD1-CD2 3.77Å; I1129-F1141 HydrophobicContact CD1-CE2 3.75Å; I1129-L1182 HydrophobicContact CD1-CD1 4.4Å; I1129-L1182 HydrophobicContact CD1-CD2 3.72Å; I1129-L1182 HydrophobicContact CG1-CD2 4.03Å
1130	I	96.7	Very high	94.7	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-66	-41.8	-179.3	-67	163.2	0	0	0	111	L1027 L1066 P1068 I1071 Y1107 A1126 L1127 G1128 Y1132 I1133 M1134	L1027-I1130 HydrophobicContact CD2-CG2 3.8Å; L1066-I1130 HydrophobicContact CD2-CD1 4.29Å; L1066-I1130 HydrophobicContact CG-CD1 3.82Å; P1068-I1130 HydrophobicContact CG-CG1 4.3Å; I1071-I1130 HydrophobicContact CD1-CD1 3.85Å; I1071-I1130 HydrophobicContact CD1-CG2 4.48Å; Y1107-I1130 HydrophobicContact CD1-CD1 4.44Å; Y1107-I1130 HydrophobicContact CD1-CG1 3.9Å; Y1107-I1130 HydrophobicContact CE1-CG1 3.76Å; A1126-I1130 WeakPolarHBondContact O-CD1 3.49Å; A1126-I1130 VanDerWaalsContact O-CG1 3.25Å; A1126-I1130 WeakPolarHBondContact O-CG1 3.32Å; A1126-I1130 PolarHBondContact O-N 2.76Å; L1127-I1130 PolarHBondContact O-N 2.85Å; G1128-I1130 PolarHBondContact O-N 2.84Å; I1130-Y1132 PolarHBondContact O-N 3.28Å; I1130-I1133 PolarHBondContact O-N 2.83Å; I1130-M1134 HydrophobicContact CG2-CE 4.29Å; I1130-M1134 HydrophobicContact CG2-CG 4.46Å; I1130-M1134 WeakPolarHBondContact O-CG 3.36Å; I1130-M1134 PolarHBondContact O-N 3.31Å
1131	T	97.6	Very high	94.6	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.3	-44.1	176.2	-53.1	0	0	0	0	111.2	V1046 L1127 G1128 I1133 M1134 L1135 I1178 W1200	V1046-T1131 HydrophobicContact CG2-CG2 3.89Å; V1046-T1131 VanDerWaalsContact CG2-OG1 3.24Å; V1046-T1131 WeakPolarHBondContact CG2-OG1 3.35Å; L1127-T1131 WeakPolarHBondContact O-CB 3.32Å; L1127-T1131 PolarHBondContact O-N 2.98Å; L1127-T1131 PolarHBondContact O-OG1 3.48Å; G1128-T1131 PolarHBondContact O-N 3.4Å; T1131-I1133 PolarHBondContact O-N 2.82Å; T1131-M1134 PolarHBondContact O-N 3.16Å; T1131-L1135 HydrophobicContact CG2-CD1 4.42Å; T1131-L1135 PolarHBondContact O-N 2.84Å; T1131-I1178 HydrophobicContact CG2-CD1 4.07Å; T1131-I1178 HydrophobicContact CG2-CG1 3.91Å; T1131-W1200 HydrophobicContact CG2-CH2 4.23Å; T1131-W1200 HydrophobicContact CG2-CZ3 4.15Å
1132	Y	96.6	Very high	93.9	Very high	3 Å²	3	11.5 Å²	11.5	1%	0.012	6%	0.056	C	C	.	.	H	α-helix	trans	-60.5	-45.1	174.9	-173.6	-78.1	0	0	0	111.7	G1128 I1129 I1130 L1135 C1136 F1138 P1140 F1160 V1161 F1162 W1167 I1178	G1128-Y1132 WeakPolarHBondContact O-CB 3.22Å; G1128-Y1132 PolarHBondContact O-N 3.49Å; I1129-Y1132 PolarHBondContact O-N 2.91Å; I1130-Y1132 PolarHBondContact O-N 3.28Å; Y1132-L1135 PolarHBondContact O-N 3.33Å; Y1132-C1136 WeakPolarHBondContact CE1-SG 3.28Å; Y1132-C1136 PolarHBondContact O-N 2.67Å; Y1132-C1136 PolarHBondContact O-SG 3.45Å; Y1132-F1138 WeakPolarHBondContact CD1-O 3.31Å; Y1132-F1138 AromaticContact CE1-CD2 3.92Å; Y1132-F1138 HydrophobicContact CE1-CD2 3.92Å; Y1132-F1138 AromaticContact CE1-CE2 3.94Å; Y1132-F1138 HydrophobicContact CE1-CE2 3.94Å; Y1132-F1138 WeakPolarHBondContact CE1-O 3.42Å; Y1132-P1140 HydrophobicContact CD1-CB 3.76Å; Y1132-P1140 VanDerWaalsContact CD1-CD 3.47Å; Y1132-P1140 HydrophobicContact CD1-CG 4Å; Y1132-P1140 HydrophobicContact CD2-CB 4Å; Y1132-P1140 VanDerWaalsContact CE1-CA 3.42Å; Y1132-P1140 HydrophobicContact CE1-CB 3.78Å; Y1132-P1140 HydrophobicContact CE1-CG 4.48Å; Y1132-P1140 HydrophobicContact CE2-CB 4.01Å; Y1132-P1140 HydrophobicContact CG-CB 3.89Å; Y1132-P1140 HydrophobicContact CG-CG 4.04Å; Y1132-F1160 HydrophobicContact CD2-CD2 4.43Å; Y1132-F1160 HydrophobicContact CE2-CD2 4.09Å; Y1132-F1160 HydrophobicContact CE2-CE2 4.5Å; Y1132-V1161 PolarHBondContact OH-O 3.04Å; Y1132-F1162 HydrophobicContact CD2-CD1 4.32Å; Y1132-F1162 HydrophobicContact CD2-CE1 4.07Å; Y1132-F1162 AromaticContact CE2-CD1 3.83Å; Y1132-F1162 HydrophobicContact CE2-CD1 3.83Å; Y1132-F1162 HydrophobicContact CE2-CE1 4.02Å; Y1132-W1167 HydrophobicContact CD1-CZ2 4.01Å; Y1132-W1167 AromaticContact CD2-CH2 3.83Å; Y1132-W1167 HydrophobicContact CD2-CH2 3.83Å; Y1132-W1167 AromaticContact CD2-CZ2 3.33Å; Y1132-W1167 HydrophobicContact CD2-CZ2 3.33Å; Y1132-W1167 HydrophobicContact CE1-CZ2 4.05Å; Y1132-W1167 AromaticContact CE2-CE2 3.63Å; Y1132-W1167 HydrophobicContact CE2-CH2 4.21Å; Y1132-W1167 AromaticContact CE2-CZ2 3.38Å; Y1132-W1167 HydrophobicContact CE2-CZ2 3.38Å; Y1132-W1167 AromaticContact CE2-NE1 3.72Å; Y1132-W1167 HydrophobicContact CG-CH2 4.21Å; Y1132-W1167 AromaticContact CG-CZ2 3.66Å; Y1132-W1167 HydrophobicContact CG-CZ2 3.66Å; Y1132-W1167 AromaticContact CZ-CE2 3.8Å; Y1132-W1167 AromaticContact CZ-CZ2 3.74Å; Y1132-W1167 AromaticContact CZ-NE1 3.45Å; Y1132-W1167 PolarHBondContact OH-NE1 2.76Å; Y1132-I1178 HydrophobicContact CD2-CD1 4.4Å; Y1132-I1178 HydrophobicContact CD2-CG2 4.07Å
1133	I	93.7	Very high	92.9	Very high	13 Å²	13	12.1 Å²	12.1	7%	0.067	6%	0.06	C	C	.	.	H	α-helix	trans	-62.4	-42.8	176.1	-64.5	161.6	0	0	0	111.3	I1031 Y1107 I1129 I1130 T1131 L1135 G1137 A1139	I1031-I1133 HydrophobicContact CD1-CG2 4Å; I1031-I1133 HydrophobicContact CG2-CG2 4.25Å; Y1107-I1133 HydrophobicContact CE1-CD1 3.68Å; I1129-I1133 HydrophobicContact CG2-CD1 3.81Å; I1129-I1133 VanDerWaalsContact O-CG1 3.26Å; I1129-I1133 WeakPolarHBondContact O-CG1 3.47Å; I1129-I1133 PolarHBondContact O-N 2.73Å; I1130-I1133 PolarHBondContact O-N 2.83Å; T1131-I1133 PolarHBondContact O-N 2.82Å; I1133-L1135 VanDerWaalsContact C-N 3.28Å; I1133-L1135 PolarHBondContact O-N 2.88Å; I1133-G1137 CarbonylContact O-C 3.56Å; I1133-G1137 WeakPolarHBondContact O-CA 3.32Å; I1133-G1137 PolarHBondContact O-N 2.89Å; I1133-A1139 HydrophobicContact CD1-CB 4.19Å; I1133-A1139 HydrophobicContact CG1-CB 4.12Å
1134	M	94.8	Very high	91.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.7	-33.7	-178.3	-75.9	-166.6	-64.1	0	0	113.4	L1027 I1031 K1036 F1037 A1042 I1045 V1046 I1130 T1131	L1027-M1134 HydrophobicContact CD1-SD 3.97Å; L1027-M1134 HydrophobicContact CD2-SD 4.04Å; I1031-M1134 HydrophobicContact CD1-CG 4.07Å; I1031-M1134 HydrophobicContact CG1-CG 4.26Å; K1036-M1134 WeakPolarHBondContact CA-O 3.38Å; K1036-M1134 WeakPolarHBondContact CB-O 3.49Å; F1037-M1134 HydrophobicContact CD2-CB 4.13Å; F1037-M1134 HydrophobicContact CD2-CG 3.97Å; F1037-M1134 HydrophobicContact CD2-SD 4.09Å; F1037-M1134 HydrophobicContact CE2-CG 4.45Å; F1037-M1134 HydrophobicContact CE2-SD 4.45Å; F1037-M1134 PolarHBondContact N-O 3.33Å; A1042-M1134 HydrophobicContact CB-CB 4.34Å; A1042-M1134 HydrophobicContact CB-CE 4.36Å; I1045-M1134 HydrophobicContact CB-CE 4.22Å; I1045-M1134 HydrophobicContact CB-SD 4.09Å; I1045-M1134 HydrophobicContact CD1-SD 3.9Å; I1045-M1134 HydrophobicContact CG2-CE 3.91Å; I1045-M1134 HydrophobicContact CG2-SD 3.72Å; V1046-M1134 HydrophobicContact CG2-CE 3.72Å; I1130-M1134 HydrophobicContact CG2-CE 4.29Å; I1130-M1134 HydrophobicContact CG2-CG 4.46Å; I1130-M1134 WeakPolarHBondContact O-CG 3.36Å; I1130-M1134 PolarHBondContact O-N 3.31Å; T1131-M1134 PolarHBondContact O-N 3.16Å
1135	L	94	Very high	90.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-88.4	-26.7	-174.3	-65.7	177.7	0	0	0	114.5	K1036 E1039 A1042 T1131 Y1132 I1133 W1167 I1170 A1174 I1178 W1200	K1036-L1135 WeakPolarHBondContact CD-O 3.35Å; E1039-L1135 HydrophobicContact CG-CD2 3.92Å; A1042-L1135 HydrophobicContact CB-CD2 3.6Å; A1042-L1135 HydrophobicContact CB-CG 4.34Å; T1131-L1135 HydrophobicContact CG2-CD1 4.42Å; T1131-L1135 PolarHBondContact O-N 2.84Å; Y1132-L1135 PolarHBondContact O-N 3.33Å; I1133-L1135 VanDerWaalsContact C-N 3.28Å; I1133-L1135 PolarHBondContact O-N 2.88Å; L1135-W1167 HydrophobicContact CB-CH2 3.71Å; L1135-W1167 HydrophobicContact CB-CZ2 4.35Å; L1135-W1167 HydrophobicContact CB-CZ3 4.09Å; L1135-W1167 HydrophobicContact CD1-CH2 4.03Å; L1135-W1167 HydrophobicContact CD1-CZ3 3.98Å; L1135-W1167 HydrophobicContact CG-CH2 4.49Å; L1135-I1170 HydrophobicContact CB-CD1 4.43Å; L1135-I1170 HydrophobicContact CD1-CG2 4.15Å; L1135-A1174 HydrophobicContact CD1-CB 3.9Å; L1135-I1178 HydrophobicContact CD1-CD1 4.17Å; L1135-W1200 HydrophobicContact CD1-CH2 4.21Å; L1135-W1200 HydrophobicContact CD1-CZ2 4.04Å; L1135-W1200 HydrophobicContact CD2-CH2 4.44Å; L1135-W1200 HydrophobicContact CD2-CZ2 4.17Å
1136	C	89.3	Confident	88.6	Confident	10 Å²	10	23.1 Å²	23.1	7%	0.068	12%	0.119	C	C	.	.	H	α-helix	trans	-120.7	-4.7	178.9	71	0	0	0	0	115.1	Y1132 F1138 W1167	Y1132-C1136 WeakPolarHBondContact CE1-SG 3.28Å; Y1132-C1136 PolarHBondContact O-N 2.67Å; Y1132-C1136 PolarHBondContact O-SG 3.45Å; C1136-F1138 VanDerWaalsContact C-N 3.34Å; C1136-F1138 HydrophobicContact CB-CD1 4.37Å; C1136-F1138 HydrophobicContact CB-CE1 4.18Å; C1136-F1138 HydrophobicContact CB-CZ 4.25Å; C1136-F1138 VanDerWaalsContact O-CD1 3.3Å; C1136-F1138 WeakPolarHBondContact O-CD1 3.26Å; C1136-F1138 VanDerWaalsContact SG-CD2 3.5Å; C1136-F1138 PolarHBondContact SG-O 3.19Å; C1136-W1167 HydrophobicContact CB-CZ2 3.85Å
1137	G	86	Confident	87.5	Confident	5 Å²	5	28.5 Å²	28.5	5%	0.052	14%	0.138	C	C	.	.	S	Bend	trans	84.9	-5.3	-177.3	0	0	0	0	0	114.8	T144 T1035 I1133	T144-G1137 WeakPolarHBondContact CG2-O 3.19Å; T1035-G1137 VanDerWaalsContact O-CA 3.3Å; T1035-G1137 WeakPolarHBondContact O-CA 3.36Å; I1133-G1137 CarbonylContact O-C 3.56Å; I1133-G1137 WeakPolarHBondContact O-CA 3.32Å; I1133-G1137 PolarHBondContact O-N 2.89Å
1138	F	87	Confident	86.6	Confident	30 Å²	30	34.5 Å²	34.5	13%	0.132	17%	0.166	C	C	.	.	S	Bend	trans	-145.4	150.6	-165.7	67.2	-120.4	0	0	0	113.7	Y1132 C1136 R1142 L1163 Y1166	Y1132-F1138 WeakPolarHBondContact CD1-O 3.31Å; Y1132-F1138 AromaticContact CE1-CD2 3.92Å; Y1132-F1138 HydrophobicContact CE1-CD2 3.92Å; Y1132-F1138 AromaticContact CE1-CE2 3.94Å; Y1132-F1138 HydrophobicContact CE1-CE2 3.94Å; Y1132-F1138 WeakPolarHBondContact CE1-O 3.42Å; C1136-F1138 VanDerWaalsContact C-N 3.34Å; C1136-F1138 HydrophobicContact CB-CD1 4.37Å; C1136-F1138 HydrophobicContact CB-CE1 4.18Å; C1136-F1138 HydrophobicContact CB-CZ 4.25Å; C1136-F1138 VanDerWaalsContact O-CD1 3.3Å; C1136-F1138 WeakPolarHBondContact O-CD1 3.26Å; C1136-F1138 VanDerWaalsContact SG-CD2 3.5Å; C1136-F1138 PolarHBondContact SG-O 3.19Å; F1138-R1142 VanDerWaalsContact CB-NH2 3.31Å; F1138-L1163 HydrophobicContact CE2-CD1 4.18Å; F1138-L1163 HydrophobicContact CZ-CB 4.39Å; F1138-L1163 HydrophobicContact CZ-CD1 4.1Å; F1138-Y1166 AromaticContact CE1-CD1 3.76Å; F1138-Y1166 HydrophobicContact CE1-CD1 3.76Å; F1138-Y1166 AromaticContact CE1-CD2 3.7Å; F1138-Y1166 HydrophobicContact CE1-CD2 3.7Å; F1138-Y1166 HydrophobicContact CE1-CE1 4.01Å; F1138-Y1166 AromaticContact CE1-CE2 3.96Å; F1138-Y1166 HydrophobicContact CE1-CE2 3.96Å; F1138-Y1166 AromaticContact CE1-CG 3.59Å; F1138-Y1166 HydrophobicContact CE1-CG 3.59Å; F1138-Y1166 AromaticContact CZ-CD2 3.79Å; F1138-Y1166 HydrophobicContact CZ-CD2 3.79Å; F1138-Y1166 HydrophobicContact CZ-CE2 4.25Å; F1138-Y1166 AromaticContact CZ-CG 3.96Å; F1138-Y1166 HydrophobicContact CZ-CG 3.96Å
1139	A	90.6	Very high	85.8	Confident	15 Å²	15	38 Å²	38	12%	0.124	19%	0.19	C	C	.	.			trans	-66.7	153.5	-177.7	0	0	0	0	0	114	T1106 I1133 R1142	T1106-A1139 HydrophobicContact CG2-CB 3.63Å; I1133-A1139 HydrophobicContact CD1-CB 4.19Å; I1133-A1139 HydrophobicContact CG1-CB 4.12Å; A1139-R1142 PolarHBondContact O-NH2 3.19Å
1140	P	92.3	Very high	85.1	Confident	18 Å²	18	41.3 Å²	41.3	12%	0.117	21%	0.205	C	C	.	.	S	Bend	trans	-72.4	-42	178.9	24.6	-28.3	0	0	0	112.5	I1129 Y1132 F1160 L1182	I1129-P1140 HydrophobicContact CD1-CG 3.48Å; I1129-P1140 VanDerWaalsContact CD1-CG 3.48Å; Y1132-P1140 HydrophobicContact CD1-CB 3.76Å; Y1132-P1140 VanDerWaalsContact CD1-CD 3.47Å; Y1132-P1140 HydrophobicContact CD1-CG 4Å; Y1132-P1140 HydrophobicContact CD2-CB 4Å; Y1132-P1140 VanDerWaalsContact CE1-CA 3.42Å; Y1132-P1140 HydrophobicContact CE1-CB 3.78Å; Y1132-P1140 HydrophobicContact CE1-CG 4.48Å; Y1132-P1140 HydrophobicContact CE2-CB 4.01Å; Y1132-P1140 HydrophobicContact CG-CB 3.89Å; Y1132-P1140 HydrophobicContact CG-CG 4.04Å; P1140-F1160 HydrophobicContact CB-CB 3.81Å; P1140-F1160 HydrophobicContact CB-CD2 4.3Å; P1140-F1160 HydrophobicContact CB-CG 4.14Å; P1140-L1182 HydrophobicContact CB-CD1 4.45Å; P1140-L1182 HydrophobicContact CG-CD1 4.02Å
1141	F	91.6	Very high	84.5	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.035	21%	0.209	C	C	.	.			trans	-93.2	136.4	-179.6	-54.3	-68.1	0	0	0	111.6	W1125 I1129 L1151 S1154 I1155 F1160	W1125-F1141 AromaticContact CH2-CE2 3.72Å; W1125-F1141 HydrophobicContact CH2-CE2 3.72Å; W1125-F1141 AromaticContact CH2-CZ 3.76Å; W1125-F1141 HydrophobicContact CH2-CZ 3.76Å; W1125-F1141 HydrophobicContact CZ2-CD2 4.15Å; W1125-F1141 AromaticContact CZ2-CE2 3.33Å; W1125-F1141 HydrophobicContact CZ2-CE2 3.33Å; W1125-F1141 AromaticContact CZ2-CZ 3.86Å; W1125-F1141 HydrophobicContact CZ2-CZ 3.86Å; I1129-F1141 HydrophobicContact CD1-CD2 3.77Å; I1129-F1141 HydrophobicContact CD1-CE2 3.75Å; F1141-L1151 HydrophobicContact CB-CD1 3.89Å; F1141-S1154 WeakPolarHBondContact CD1-O 3.1Å; F1141-I1155 HydrophobicContact CB-CG1 3.95Å; F1141-I1155 HydrophobicContact CD2-CG1 3.88Å; F1141-I1155 HydrophobicContact CG-CG1 3.88Å; F1141-F1160 HydrophobicContact CD1-CB 4.39Å; F1141-F1160 HydrophobicContact CE1-CB 3.84Å; F1141-F1160 HydrophobicContact CE1-CD1 4.37Å; F1141-F1160 HydrophobicContact CZ-CB 4.15Å; F1141-F1160 HydrophobicContact CZ-CD1 4Å; F1141-F1160 HydrophobicContact CZ-CG 4.46Å
1142	R	80.2	Confident	84	Confident	125 Å²	125	44.9 Å²	44.9	47%	0.472	22%	0.221	S	C	.	.			trans	-146.5	140.3	178.3	-74	-170.3	177.3	72.4	59.6	112.2	F1138 A1139	F1138-R1142 VanDerWaalsContact CB-NH2 3.31Å; A1139-R1142 PolarHBondContact O-NH2 3.19Å
1143	S	75	Confident	83.6	Confident	18 Å²	18	48.8 Å²	48.8	13%	0.126	24%	0.239	C	C	.	.			trans	-94.5	117	156.6	56.9	0	0	0	0	110	D1145 R1146 R1147	S1143-D1145 VanDerWaalsContact C-N 3.25Å; S1143-D1145 PolarHBondContact O-N 3.04Å; S1143-R1146 WeakPolarHBondContact O-CA 3.33Å; S1143-R1146 PolarHBondContact O-N 2.89Å; S1143-R1146 VanDerWaalsContact OG-CA 3.22Å; S1143-R1146 WeakPolarHBondContact OG-CA 3.29Å; S1143-R1147 WeakPolarHBondContact CB-O 3.46Å; S1143-R1147 PolarHBondContact OG-N 3.14Å; S1143-R1147 PolarHBondContact OG-O 3.24Å
1144	T	68.3	Low	83.3	Confident	116 Å²	116	49.6 Å²	49.6	71%	0.712	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.6	178	48.2	0	0	0	0	113.2	R1146	T1144-R1146 VanDerWaalsContact C-N 3.31Å; T1144-R1146 PolarHBondContact O-N 2.72Å
1145	D	70.7	Confident	83.1	Confident	52 Å²	52	49.6 Å²	49.6	28%	0.278	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	16.9	176.4	58.7	29.5	0	0	0	113.7	R104 S1143 R1147 K1150	R104-D1145 PolarHBondContact NH1-O 3.2Å; S1143-D1145 VanDerWaalsContact C-N 3.25Å; S1143-D1145 PolarHBondContact O-N 3.04Å; D1145-R1147 VanDerWaalsContact CG-NE 3.3Å; D1145-R1147 PolarHBondContact O-N 3.19Å; D1145-R1147 VanDerWaalsContact OD1-CB 3.3Å; D1145-R1147 WeakPolarHBondContact OD1-CB 3.49Å; D1145-R1147 WeakPolarHBondContact OD1-CG 3.36Å; D1145-R1147 PolarHBondContact OD1-N 2.74Å; D1145-R1147 IonicContact OD1-NE 3.61Å; D1145-R1147 PolarHBondContact OD1-NE 3.48Å; D1145-R1147 IonicContact OD2-CZ 3.77Å; D1145-R1147 IonicContact OD2-NE 2.65Å; D1145-R1147 PolarHBondContact OD2-NE 3.46Å; D1145-R1147 IonicContact OD2-NH2 3.79Å; D1145-R1147 PolarHBondContact OD2-NH2 3.3Å; D1145-K1150 WeakPolarHBondContact OD2-CD 3.31Å; D1145-K1150 WeakPolarHBondContact OD2-CE 3.5Å; D1145-K1150 IonicContact OD2-NZ 2.82Å; D1145-K1150 PolarHBondContact OD2-NZ 3.1Å
1146	R	65.3	Low	82.8	Confident	68 Å²	68	53.6 Å²	53.6	26%	0.257	26%	0.264	S	S	.	.			trans	48.4	27.9	-176.7	-78.9	-173.4	-77.7	-175.4	-12	114.9	R104 E151 S1143 T1144	R104-R1146 VanDerWaalsContact NH1-C 3.28Å; R104-R1146 VanDerWaalsContact NH1-CB 3.28Å; R104-R1146 PolarHBondContact NH1-O 2.58Å; R104-R1146 PolarHBondContact O-NH1 3.08Å; E151-R1146 IonicContact OE1-CZ 3.57Å; E151-R1146 VanDerWaalsContact OE1-CZ 3.27Å; E151-R1146 IonicContact OE1-NE 3.47Å; E151-R1146 IonicContact OE1-NH1 3.54Å; E151-R1146 PolarHBondContact OE1-NH1 3.2Å; E151-R1146 IonicContact OE1-NH2 3.64Å; E151-R1146 IonicContact OE2-CZ 2.64Å; E151-R1146 IonicContact OE2-NH1 2.81Å; E151-R1146 PolarHBondContact OE2-NH1 3.49Å; E151-R1146 IonicContact OE2-NH2 2.92Å; E151-R1146 PolarHBondContact OE2-NH2 2.99Å; S1143-R1146 WeakPolarHBondContact O-CA 3.33Å; S1143-R1146 PolarHBondContact O-N 2.89Å; S1143-R1146 VanDerWaalsContact OG-CA 3.22Å; S1143-R1146 WeakPolarHBondContact OG-CA 3.29Å; T1144-R1146 VanDerWaalsContact C-N 3.31Å; T1144-R1146 PolarHBondContact O-N 2.72Å
1147	R	73.8	Confident	82.8	Confident	118 Å²	118	62 Å²	62	45%	0.445	29%	0.294	S	S	.	.			trans	-83.7	124.9	171.7	-72.7	-171.6	-74.6	171.7	-15.5	111.8	S1143 D1145 S1149 K1150 L1151	S1143-R1147 WeakPolarHBondContact CB-O 3.46Å; S1143-R1147 PolarHBondContact OG-N 3.14Å; S1143-R1147 PolarHBondContact OG-O 3.24Å; D1145-R1147 VanDerWaalsContact CG-NE 3.3Å; D1145-R1147 PolarHBondContact O-N 3.19Å; D1145-R1147 VanDerWaalsContact OD1-CB 3.3Å; D1145-R1147 WeakPolarHBondContact OD1-CB 3.49Å; D1145-R1147 WeakPolarHBondContact OD1-CG 3.36Å; D1145-R1147 PolarHBondContact OD1-N 2.74Å; D1145-R1147 IonicContact OD1-NE 3.61Å; D1145-R1147 PolarHBondContact OD1-NE 3.48Å; D1145-R1147 IonicContact OD2-CZ 3.77Å; D1145-R1147 IonicContact OD2-NE 2.65Å; D1145-R1147 PolarHBondContact OD2-NE 3.46Å; D1145-R1147 IonicContact OD2-NH2 3.79Å; D1145-R1147 PolarHBondContact OD2-NH2 3.3Å; R1147-S1149 VanDerWaalsContact C-N 3.28Å; R1147-S1149 PolarHBondContact O-N 2.78Å; R1147-K1150 HydrophobicContact CB-CB 4.5Å; R1147-K1150 PolarHBondContact O-N 3Å; R1147-K1150 VanDerWaalsContact O-N 3.14Å; R1147-L1151 PolarHBondContact O-N 3.27Å
1148	Q	79.6	Confident	82.9	Confident	125 Å²	125	62.3 Å²	62.3	58%	0.584	30%	0.298	S	S	*	.	H	α-helix	trans	-53.8	-41.3	174.2	-72.9	174.4	-23.4	0	0	112.8	K1150 L1151 F1152	Q1148-K1150 VanDerWaalsContact C-N 3.33Å; Q1148-K1150 PolarHBondContact O-N 2.86Å; Q1148-L1151 WeakPolarHBondContact O-CB 3.16Å; Q1148-L1151 PolarHBondContact O-N 2.66Å; Q1148-F1152 HydrophobicContact CB-CD2 4.41Å; Q1148-F1152 HydrophobicContact CB-CE2 3.91Å; Q1148-F1152 HydrophobicContact CB-CZ 4.21Å; Q1148-F1152 WeakPolarHBondContact O-CD2 3.44Å; Q1148-F1152 VanDerWaalsContact O-CG 3.25Å; Q1148-F1152 WeakPolarHBondContact O-CG 3.37Å; Q1148-F1152 PolarHBondContact O-N 3.1Å
1149	S	81.8	Confident	83	Confident	73 Å²	73	67.5 Å²	67.5	51%	0.51	32%	0.322	S	S	.	.	H	α-helix	trans	-53.9	-46.9	177.1	-38.3	0	0	0	0	112.6	R1147 L1151 F1152 E1153	R1147-S1149 VanDerWaalsContact C-N 3.28Å; R1147-S1149 PolarHBondContact O-N 2.78Å; S1149-L1151 PolarHBondContact O-N 3.32Å; S1149-F1152 PolarHBondContact O-N 2.93Å; S1149-E1153 VanDerWaalsContact O-CG 3.31Å; S1149-E1153 WeakPolarHBondContact O-CG 3.47Å; S1149-E1153 PolarHBondContact O-N 2.88Å
1150	K	82.9	Confident	83.1	Confident	71 Å²	71	68.4 Å²	68.4	31%	0.309	32%	0.323	S	S	.	.	H	α-helix	trans	-68.5	-33.1	176.8	-90.8	-175.2	170.3	-179.8	0	113.3	D1145 R1147 Q1148 S1154	D1145-K1150 WeakPolarHBondContact OD2-CD 3.31Å; D1145-K1150 WeakPolarHBondContact OD2-CE 3.5Å; D1145-K1150 IonicContact OD2-NZ 2.82Å; D1145-K1150 PolarHBondContact OD2-NZ 3.1Å; R1147-K1150 HydrophobicContact CB-CB 4.5Å; R1147-K1150 PolarHBondContact O-N 3Å; R1147-K1150 VanDerWaalsContact O-N 3.14Å; Q1148-K1150 VanDerWaalsContact C-N 3.33Å; Q1148-K1150 PolarHBondContact O-N 2.86Å; K1150-S1154 WeakPolarHBondContact O-CB 3.32Å; K1150-S1154 PolarHBondContact O-N 2.82Å
1151	L	84.5	Confident	83	Confident	19 Å²	19	71 Å²	71	10%	0.099	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-45.5	173.4	177.4	62.7	0	0	0	109.9	P1105 F1141 R1147 Q1148 S1149 S1154 I1155	P1105-L1151 HydrophobicContact CB-CD2 4.3Å; F1141-L1151 HydrophobicContact CB-CD1 3.89Å; R1147-L1151 PolarHBondContact O-N 3.27Å; Q1148-L1151 WeakPolarHBondContact O-CB 3.16Å; Q1148-L1151 PolarHBondContact O-N 2.66Å; S1149-L1151 PolarHBondContact O-N 3.32Å; L1151-S1154 WeakPolarHBondContact O-CB 3.3Å; L1151-S1154 PolarHBondContact O-N 3.42Å; L1151-I1155 HydrophobicContact CD1-CD1 4.12Å; L1151-I1155 HydrophobicContact CD1-CG1 4.47Å; L1151-I1155 HydrophobicContact CG-CD1 3.94Å; L1151-I1155 WeakPolarHBondContact O-CG1 3.3Å; L1151-I1155 PolarHBondContact O-N 3.35Å
1152	F	87.2	Confident	83.2	Confident	55 Å²	55	73.3 Å²	73.3	24%	0.241	35%	0.349	C	S	.	.	H	α-helix	trans	-65.6	-40.9	176.6	-59.7	-30.7	0	0	0	112.6	P1105 L1113 Q1148 S1149 S1154 I1155 K1156	P1105-F1152 HydrophobicContact CB-CE1 3.98Å; P1105-F1152 HydrophobicContact CB-CZ 4.34Å; L1113-F1152 HydrophobicContact CD1-CB 3.97Å; L1113-F1152 HydrophobicContact CD1-CD1 3.64Å; L1113-F1152 HydrophobicContact CD1-CE1 4.47Å; L1113-F1152 HydrophobicContact CD1-CG 4.07Å; L1113-F1152 HydrophobicContact CD2-CD1 3.66Å; L1113-F1152 HydrophobicContact CD2-CE1 3.81Å; L1113-F1152 HydrophobicContact CD2-CG 4.08Å; L1113-F1152 HydrophobicContact CD2-CZ 4.35Å; L1113-F1152 HydrophobicContact CG-CD1 4.32Å; Q1148-F1152 HydrophobicContact CB-CD2 4.41Å; Q1148-F1152 HydrophobicContact CB-CE2 3.91Å; Q1148-F1152 HydrophobicContact CB-CZ 4.21Å; Q1148-F1152 WeakPolarHBondContact O-CD2 3.44Å; Q1148-F1152 VanDerWaalsContact O-CG 3.25Å; Q1148-F1152 WeakPolarHBondContact O-CG 3.37Å; Q1148-F1152 PolarHBondContact O-N 3.1Å; S1149-F1152 PolarHBondContact O-N 2.93Å; F1152-S1154 VanDerWaalsContact C-N 3.32Å; F1152-S1154 PolarHBondContact O-N 3.47Å; F1152-I1155 HydrophobicContact CD1-CD1 4.49Å; F1152-I1155 PolarHBondContact O-N 2.81Å; F1152-K1156 WeakPolarHBondContact O-CG 3.3Å; F1152-K1156 PolarHBondContact O-N 3.46Å
1153	E	87.8	Confident	83.7	Confident	85 Å²	85	71 Å²	71	40%	0.397	35%	0.345	S	S	.	.	H	α-helix	trans	-57.2	-43.9	169.8	-73.5	163.9	-132	0	0	111.6	S1149 R1157	S1149-E1153 VanDerWaalsContact O-CG 3.31Å; S1149-E1153 WeakPolarHBondContact O-CG 3.47Å; S1149-E1153 PolarHBondContact O-N 2.88Å; E1153-R1157 WeakPolarHBondContact O-CB 3.48Å; E1153-R1157 WeakPolarHBondContact O-CG 3.38Å; E1153-R1157 PolarHBondContact O-N 2.75Å; E1153-R1157 IonicContact OE2-NH2 2.69Å
1154	S	87.7	Confident	84.3	Confident	31 Å²	31	74 Å²	74	22%	0.217	37%	0.367	C	S	.	.	H	α-helix	trans	-67.7	-36.7	178.2	-170.4	0	0	0	0	112.7	F1141 K1150 L1151 F1152 G1158	F1141-S1154 WeakPolarHBondContact CD1-O 3.1Å; K1150-S1154 WeakPolarHBondContact O-CB 3.32Å; K1150-S1154 PolarHBondContact O-N 2.82Å; L1151-S1154 WeakPolarHBondContact O-CB 3.3Å; L1151-S1154 PolarHBondContact O-N 3.42Å; F1152-S1154 VanDerWaalsContact C-N 3.32Å; F1152-S1154 PolarHBondContact O-N 3.47Å; S1154-G1158 PolarHBondContact O-N 2.85Å
1155	I	89.4	Confident	85.3	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-67.6	-49.3	176.4	-72.7	165.4	0	0	0	110.1	P1105 P1110 L1113 W1125 F1141 L1151 F1152 R1157 G1158 I1184	P1105-I1155 WeakPolarHBondContact O-CD1 3.45Å; P1110-I1155 HydrophobicContact CB-CG2 4.27Å; L1113-I1155 HydrophobicContact CD1-CB 3.96Å; L1113-I1155 HydrophobicContact CD1-CD1 4.3Å; L1113-I1155 HydrophobicContact CD1-CG2 3.6Å; W1125-I1155 HydrophobicContact CZ2-CG2 3.91Å; F1141-I1155 HydrophobicContact CB-CG1 3.95Å; F1141-I1155 HydrophobicContact CD2-CG1 3.88Å; F1141-I1155 HydrophobicContact CG-CG1 3.88Å; L1151-I1155 HydrophobicContact CD1-CD1 4.12Å; L1151-I1155 HydrophobicContact CD1-CG1 4.47Å; L1151-I1155 HydrophobicContact CG-CD1 3.94Å; L1151-I1155 WeakPolarHBondContact O-CG1 3.3Å; L1151-I1155 PolarHBondContact O-N 3.35Å; F1152-I1155 HydrophobicContact CD1-CD1 4.49Å; F1152-I1155 PolarHBondContact O-N 2.81Å; I1155-R1157 VanDerWaalsContact C-N 3.3Å; I1155-R1157 PolarHBondContact O-N 3.13Å; I1155-G1158 PolarHBondContact O-N 3.26Å; I1155-I1184 WeakPolarHBondContact O-CD1 3.26Å
1156	K	88.4	Confident	86.2	Confident	83 Å²	83	76.2 Å²	76.2	36%	0.361	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-35.5	177.6	-71.4	-169.9	-179.5	-160.9	0	113.2	L1113 E1114 F1152 G1158	L1113-K1156 VanDerWaalsContact CB-CE 3.48Å; L1113-K1156 HydrophobicContact CB-CG 4.35Å; L1113-K1156 WeakPolarHBondContact O-CE 3.2Å; L1113-K1156 PolarHBondContact O-NZ 3.36Å; E1114-K1156 HydrophobicContact CG-CD 3.86Å; E1114-K1156 HydrophobicContact CG-CG 4.18Å; F1152-K1156 WeakPolarHBondContact O-CG 3.3Å; F1152-K1156 PolarHBondContact O-N 3.46Å; K1156-G1158 VanDerWaalsContact C-N 3.26Å; K1156-G1158 PolarHBondContact O-N 3.36Å
1157	R	90	Very high	87.5	Confident	186 Å²	186	73 Å²	73	70%	0.702	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.2	174.6	-72.7	173.3	-164.2	-165.5	7	113.6	E1153 I1155 H1159	E1153-R1157 WeakPolarHBondContact O-CB 3.48Å; E1153-R1157 WeakPolarHBondContact O-CG 3.38Å; E1153-R1157 PolarHBondContact O-N 2.75Å; E1153-R1157 IonicContact OE2-NH2 2.69Å; I1155-R1157 VanDerWaalsContact C-N 3.3Å; I1155-R1157 PolarHBondContact O-N 3.13Å; R1157-H1159 PolarHBondContact O-N 2.58Å
1158	G	87.5	Confident	88.5	Confident	13 Å²	13	71.5 Å²	71.5	13%	0.134	36%	0.359	C	S	.	.			trans	66.5	-9.1	179.3	0	0	0	0	0	116	S1154 I1155 K1156 F1160 I1184	S1154-G1158 PolarHBondContact O-N 2.85Å; I1155-G1158 PolarHBondContact O-N 3.26Å; K1156-G1158 VanDerWaalsContact C-N 3.26Å; K1156-G1158 PolarHBondContact O-N 3.36Å; G1158-F1160 WeakPolarHBondContact O-CD1 3.35Å; G1158-F1160 PolarHBondContact O-N 3.39Å; G1158-I1184 VanDerWaalsContact CA-CD1 3.43Å
1159	H	88.7	Confident	89	Confident	138 Å²	138	72.8 Å²	72.8	64%	0.639	37%	0.37	S	S	*	.			trans	-75	110.1	-177.1	-174.3	73.9	0	0	0	111.3	R1157	R1157-H1159 PolarHBondContact O-N 2.58Å
1160	F	91.6	Very high	89.6	Confident	35 Å²	35	70 Å²	70	15%	0.154	35%	0.349	C	S	.	.			trans	-124.8	163.9	167.7	69.5	-84.6	0	0	0	109.6	Y1132 P1140 F1141 G1158 F1162 I1178 L1182	Y1132-F1160 HydrophobicContact CD2-CD2 4.43Å; Y1132-F1160 HydrophobicContact CE2-CD2 4.09Å; Y1132-F1160 HydrophobicContact CE2-CE2 4.5Å; P1140-F1160 HydrophobicContact CB-CB 3.81Å; P1140-F1160 HydrophobicContact CB-CD2 4.3Å; P1140-F1160 HydrophobicContact CB-CG 4.14Å; F1141-F1160 HydrophobicContact CD1-CB 4.39Å; F1141-F1160 HydrophobicContact CE1-CB 3.84Å; F1141-F1160 HydrophobicContact CE1-CD1 4.37Å; F1141-F1160 HydrophobicContact CZ-CB 4.15Å; F1141-F1160 HydrophobicContact CZ-CD1 4Å; F1141-F1160 HydrophobicContact CZ-CG 4.46Å; G1158-F1160 WeakPolarHBondContact O-CD1 3.35Å; G1158-F1160 PolarHBondContact O-N 3.39Å; F1160-F1162 AromaticContact CE2-CE1 3.92Å; F1160-F1162 HydrophobicContact CE2-CE1 3.92Å; F1160-F1162 HydrophobicContact CE2-CE2 4.04Å; F1160-F1162 AromaticContact CE2-CZ 3.63Å; F1160-F1162 HydrophobicContact CE2-CZ 3.63Å; F1160-F1162 HydrophobicContact CZ-CZ 4.3Å; F1160-I1178 HydrophobicContact CE2-CG2 4.01Å; F1160-I1178 HydrophobicContact CZ-CG2 4.1Å; F1160-L1182 HydrophobicContact CD1-CB 4.26Å; F1160-L1182 HydrophobicContact CD1-CD1 4.1Å; F1160-L1182 HydrophobicContact CE1-CB 3.56Å; F1160-L1182 HydrophobicContact CE1-CD1 3.86Å; F1160-L1182 HydrophobicContact CE1-CG 4.36Å; F1160-L1182 HydrophobicContact CE2-CD1 4.29Å; F1160-L1182 HydrophobicContact CG-CD1 4.44Å; F1160-L1182 HydrophobicContact CZ-CB 4.07Å; F1160-L1182 HydrophobicContact CZ-CD1 3.97Å
1161	V	91.9	Very high	90.2	Very high	73 Å²	73	67.9 Å²	67.9	44%	0.442	34%	0.343	S	S	.	.			trans	-138.2	136.8	-176.6	-73.3	0	0	0	0	111.4	Y1132 L1163	Y1132-V1161 PolarHBondContact OH-O 3.04Å; V1161-L1163 VanDerWaalsContact C-N 3.33Å; V1161-L1163 HydrophobicContact CG2-CD2 3.62Å; V1161-L1163 HydrophobicContact CG2-CG 4.12Å; V1161-L1163 PolarHBondContact O-N 2.73Å
1162	F	94.7	Very high	90.7	Very high	56 Å²	56	70.8 Å²	70.8	25%	0.246	37%	0.366	C	S	.	.			trans	-75.5	81.7	175.4	-64	-65.2	0	0	0	110.5	Y1132 F1160 S1164 W1167 K1175 I1178	Y1132-F1162 HydrophobicContact CD2-CD1 4.32Å; Y1132-F1162 HydrophobicContact CD2-CE1 4.07Å; Y1132-F1162 AromaticContact CE2-CD1 3.83Å; Y1132-F1162 HydrophobicContact CE2-CD1 3.83Å; Y1132-F1162 HydrophobicContact CE2-CE1 4.02Å; F1160-F1162 AromaticContact CE2-CE1 3.92Å; F1160-F1162 HydrophobicContact CE2-CE1 3.92Å; F1160-F1162 HydrophobicContact CE2-CE2 4.04Å; F1160-F1162 AromaticContact CE2-CZ 3.63Å; F1160-F1162 HydrophobicContact CE2-CZ 3.63Å; F1160-F1162 HydrophobicContact CZ-CZ 4.3Å; F1162-S1164 PolarHBondContact O-N 3.13Å; F1162-W1167 HydrophobicContact CB-CB 3.84Å; F1162-W1167 HydrophobicContact CB-CD2 4.17Å; F1162-W1167 HydrophobicContact CB-CG 3.78Å; F1162-W1167 AromaticContact CD1-CD2 3.54Å; F1162-W1167 HydrophobicContact CD1-CD2 3.54Å; F1162-W1167 AromaticContact CD1-CE2 3.84Å; F1162-W1167 AromaticContact CD1-CE3 3.54Å; F1162-W1167 HydrophobicContact CD1-CE3 3.54Å; F1162-W1167 HydrophobicContact CD1-CG 4.09Å; F1162-W1167 HydrophobicContact CD1-CH2 4.2Å; F1162-W1167 HydrophobicContact CD1-CZ2 4.19Å; F1162-W1167 AromaticContact CD1-CZ3 3.87Å; F1162-W1167 HydrophobicContact CD1-CZ3 3.87Å; F1162-W1167 HydrophobicContact CE1-CD2 4.4Å; F1162-W1167 HydrophobicContact CE1-CE3 4.06Å; F1162-W1167 HydrophobicContact CE1-CH2 4.17Å; F1162-W1167 HydrophobicContact CE1-CZ2 4.48Å; F1162-W1167 AromaticContact CE1-CZ3 3.92Å; F1162-W1167 HydrophobicContact CE1-CZ3 3.92Å; F1162-W1167 HydrophobicContact CG-CD2 4.3Å; F1162-W1167 HydrophobicContact CG-CE3 4.39Å; F1162-W1167 HydrophobicContact CG-CG 4.43Å; F1162-K1175 HydrophobicContact CD1-CG 4.03Å; F1162-K1175 HydrophobicContact CD2-CB 4.23Å; F1162-K1175 HydrophobicContact CD2-CG 4.1Å; F1162-K1175 HydrophobicContact CE1-CB 4.18Å; F1162-K1175 HydrophobicContact CE1-CG 3.98Å; F1162-K1175 HydrophobicContact CE2-CB 3.74Å; F1162-K1175 HydrophobicContact CE2-CG 4.07Å; F1162-K1175 HydrophobicContact CG-CG 4.09Å; F1162-K1175 HydrophobicContact CZ-CB 3.71Å; F1162-K1175 HydrophobicContact CZ-CG 4Å; F1162-K1175 WeakPolarHBondContact CZ-O 3.22Å; F1162-I1178 HydrophobicContact CE1-CB 4.29Å; F1162-I1178 HydrophobicContact CE1-CD1 4.32Å; F1162-I1178 HydrophobicContact CE1-CG2 4Å; F1162-I1178 HydrophobicContact CZ-CB 4.21Å; F1162-I1178 HydrophobicContact CZ-CG2 4.05Å
1163	L	90.5	Very high	91.1	Very high	75 Å²	75	70 Å²	70	39%	0.393	36%	0.363	S	S	.	.			trans	-60.8	122.5	-172.6	-65.5	174.6	0	0	0	113.9	F1138 V1161 Y1166 W1167	F1138-L1163 HydrophobicContact CE2-CD1 4.18Å; F1138-L1163 HydrophobicContact CZ-CB 4.39Å; F1138-L1163 HydrophobicContact CZ-CD1 4.1Å; V1161-L1163 VanDerWaalsContact C-N 3.33Å; V1161-L1163 HydrophobicContact CG2-CD2 3.62Å; V1161-L1163 HydrophobicContact CG2-CG 4.12Å; V1161-L1163 PolarHBondContact O-N 2.73Å; L1163-Y1166 HydrophobicContact CB-CD2 4.25Å; L1163-Y1166 WeakPolarHBondContact O-CB 3.2Å; L1163-Y1166 PolarHBondContact O-N 2.74Å; L1163-Y1166 VanDerWaalsContact O-N 3.07Å; L1163-W1167 PolarHBondContact O-N 2.8Å
1164	S	88.2	Confident	91.6	Very high	83 Å²	83	66 Å²	66	58%	0.58	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	148.4	162	-58.2	0	0	0	0	111.5	F1162 Y1166 D1168	F1162-S1164 PolarHBondContact O-N 3.13Å; S1164-Y1166 VanDerWaalsContact C-N 3.32Å; S1164-D1168 VanDerWaalsContact CA-OD1 3.27Å; S1164-D1168 WeakPolarHBondContact CA-OD1 3.49Å; S1164-D1168 WeakPolarHBondContact CB-OD1 3.33Å; S1164-D1168 PolarHBondContact OG-OD1 3.31Å
1165	P	89.5	Confident	92	Very high	92 Å²	92	66.9 Å²	66.9	60%	0.597	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85	2.4	-2.6	36	-36.5	0	0	0	113.8	W1167 D1168	P1165-W1167 VanDerWaalsContact C-N 3.31Å; P1165-W1167 PolarHBondContact O-N 3.41Å; P1165-D1168 WeakPolarHBondContact CA-OD2 3.19Å
1166	Y	89	Confident	92.4	Very high	122 Å²	122	71.2 Å²	71.2	48%	0.478	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.2	-169.2	-53	-84.1	0	0	0	113.4	F1138 L1163 S1164	F1138-Y1166 AromaticContact CE1-CD1 3.76Å; F1138-Y1166 HydrophobicContact CE1-CD1 3.76Å; F1138-Y1166 AromaticContact CE1-CD2 3.7Å; F1138-Y1166 HydrophobicContact CE1-CD2 3.7Å; F1138-Y1166 HydrophobicContact CE1-CE1 4.01Å; F1138-Y1166 AromaticContact CE1-CE2 3.96Å; F1138-Y1166 HydrophobicContact CE1-CE2 3.96Å; F1138-Y1166 AromaticContact CE1-CG 3.59Å; F1138-Y1166 HydrophobicContact CE1-CG 3.59Å; F1138-Y1166 AromaticContact CZ-CD2 3.79Å; F1138-Y1166 HydrophobicContact CZ-CD2 3.79Å; F1138-Y1166 HydrophobicContact CZ-CE2 4.25Å; F1138-Y1166 AromaticContact CZ-CG 3.96Å; F1138-Y1166 HydrophobicContact CZ-CG 3.96Å; L1163-Y1166 HydrophobicContact CB-CD2 4.25Å; L1163-Y1166 WeakPolarHBondContact O-CB 3.2Å; L1163-Y1166 PolarHBondContact O-N 2.74Å; L1163-Y1166 VanDerWaalsContact O-N 3.07Å; S1164-Y1166 VanDerWaalsContact C-N 3.32Å
1167	W	94	Very high	92.8	Very high	1 Å²	1	67.2 Å²	67.2	0%	0.004	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-4.6	-175.7	-74	93.1	0	0	0	114.6	Y1132 L1135 C1136 F1162 L1163 P1165 N1169 I1170 K1175 I1178	Y1132-W1167 HydrophobicContact CD1-CZ2 4.01Å; Y1132-W1167 AromaticContact CD2-CH2 3.83Å; Y1132-W1167 HydrophobicContact CD2-CH2 3.83Å; Y1132-W1167 AromaticContact CD2-CZ2 3.33Å; Y1132-W1167 HydrophobicContact CD2-CZ2 3.33Å; Y1132-W1167 HydrophobicContact CE1-CZ2 4.05Å; Y1132-W1167 AromaticContact CE2-CE2 3.63Å; Y1132-W1167 HydrophobicContact CE2-CH2 4.21Å; Y1132-W1167 AromaticContact CE2-CZ2 3.38Å; Y1132-W1167 HydrophobicContact CE2-CZ2 3.38Å; Y1132-W1167 AromaticContact CE2-NE1 3.72Å; Y1132-W1167 HydrophobicContact CG-CH2 4.21Å; Y1132-W1167 AromaticContact CG-CZ2 3.66Å; Y1132-W1167 HydrophobicContact CG-CZ2 3.66Å; Y1132-W1167 AromaticContact CZ-CE2 3.8Å; Y1132-W1167 AromaticContact CZ-CZ2 3.74Å; Y1132-W1167 AromaticContact CZ-NE1 3.45Å; Y1132-W1167 PolarHBondContact OH-NE1 2.76Å; L1135-W1167 HydrophobicContact CB-CH2 3.71Å; L1135-W1167 HydrophobicContact CB-CZ2 4.35Å; L1135-W1167 HydrophobicContact CB-CZ3 4.09Å; L1135-W1167 HydrophobicContact CD1-CH2 4.03Å; L1135-W1167 HydrophobicContact CD1-CZ3 3.98Å; L1135-W1167 HydrophobicContact CG-CH2 4.49Å; C1136-W1167 HydrophobicContact CB-CZ2 3.85Å; F1162-W1167 HydrophobicContact CB-CB 3.84Å; F1162-W1167 HydrophobicContact CB-CD2 4.17Å; F1162-W1167 HydrophobicContact CB-CG 3.78Å; F1162-W1167 AromaticContact CD1-CD2 3.54Å; F1162-W1167 HydrophobicContact CD1-CD2 3.54Å; F1162-W1167 AromaticContact CD1-CE2 3.84Å; F1162-W1167 AromaticContact CD1-CE3 3.54Å; F1162-W1167 HydrophobicContact CD1-CE3 3.54Å; F1162-W1167 HydrophobicContact CD1-CG 4.09Å; F1162-W1167 HydrophobicContact CD1-CH2 4.2Å; F1162-W1167 HydrophobicContact CD1-CZ2 4.19Å; F1162-W1167 AromaticContact CD1-CZ3 3.87Å; F1162-W1167 HydrophobicContact CD1-CZ3 3.87Å; F1162-W1167 HydrophobicContact CE1-CD2 4.4Å; F1162-W1167 HydrophobicContact CE1-CE3 4.06Å; F1162-W1167 HydrophobicContact CE1-CH2 4.17Å; F1162-W1167 HydrophobicContact CE1-CZ2 4.48Å; F1162-W1167 AromaticContact CE1-CZ3 3.92Å; F1162-W1167 HydrophobicContact CE1-CZ3 3.92Å; F1162-W1167 HydrophobicContact CG-CD2 4.3Å; F1162-W1167 HydrophobicContact CG-CE3 4.39Å; F1162-W1167 HydrophobicContact CG-CG 4.43Å; L1163-W1167 PolarHBondContact O-N 2.8Å; P1165-W1167 VanDerWaalsContact C-N 3.31Å; P1165-W1167 PolarHBondContact O-N 3.41Å; W1167-N1169 PolarHBondContact O-N 2.79Å; W1167-I1170 HydrophobicContact CE3-CB 3.83Å; W1167-I1170 HydrophobicContact CE3-CG1 4.05Å; W1167-I1170 HydrophobicContact CE3-CG2 3.65Å; W1167-I1170 HydrophobicContact CZ3-CB 4.34Å; W1167-I1170 HydrophobicContact CZ3-CG2 3.66Å; W1167-I1170 PolarHBondContact O-N 3.5Å; W1167-I1170 VanDerWaalsContact O-N 3.13Å; W1167-K1175 HydrophobicContact CE3-CG 4.08Å; W1167-K1175 HydrophobicContact CZ3-CG 4.39Å; W1167-K1175 WeakPolarHBondContact O-CE 3.3Å; W1167-K1175 PolarHBondContact O-NZ 2.96Å; W1167-I1178 HydrophobicContact CH2-CD1 3.42Å; W1167-I1178 VanDerWaalsContact CH2-CD1 3.42Å; W1167-I1178 HydrophobicContact CZ2-CD1 4.49Å; W1167-I1178 HydrophobicContact CZ3-CD1 3.81Å
1168	D	92.8	Very high	93.2	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-46.1	-173	-60.4	-2.8	0	0	0	110.8	S1164 P1165 I1170	S1164-D1168 VanDerWaalsContact CA-OD1 3.27Å; S1164-D1168 WeakPolarHBondContact CA-OD1 3.49Å; S1164-D1168 WeakPolarHBondContact CB-OD1 3.33Å; S1164-D1168 PolarHBondContact OG-OD1 3.31Å; P1165-D1168 WeakPolarHBondContact CA-OD2 3.19Å; D1168-I1170 VanDerWaalsContact C-N 3.27Å; D1168-I1170 PolarHBondContact O-N 3.34Å
1169	N	91.7	Very high	93.7	Very high	152 Å²	152	61 Å²	61	81%	0.813	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	19.3	178.3	-62	-19.1	0	0	0	113.9	W1167	W1167-N1169 PolarHBondContact O-N 2.79Å
1170	I	94.5	Very high	94.1	Very high	15 Å²	15	55.7 Å²	55.7	8%	0.077	31%	0.309	C	S	.	.	S	Bend	trans	-107.4	134.9	176.7	-58.9	-64.3	0	0	0	109.6	E1039 L1135 W1167 D1168 A1174 K1175	E1039-I1170 HydrophobicContact CG-CD1 4.34Å; E1039-I1170 WeakPolarHBondContact OE1-CA 3.35Å; L1135-I1170 HydrophobicContact CB-CD1 4.43Å; L1135-I1170 HydrophobicContact CD1-CG2 4.15Å; W1167-I1170 HydrophobicContact CE3-CB 3.83Å; W1167-I1170 HydrophobicContact CE3-CG1 4.05Å; W1167-I1170 HydrophobicContact CE3-CG2 3.65Å; W1167-I1170 HydrophobicContact CZ3-CB 4.34Å; W1167-I1170 HydrophobicContact CZ3-CG2 3.66Å; W1167-I1170 PolarHBondContact O-N 3.5Å; W1167-I1170 VanDerWaalsContact O-N 3.13Å; D1168-I1170 VanDerWaalsContact C-N 3.27Å; D1168-I1170 PolarHBondContact O-N 3.34Å; I1170-A1174 HydrophobicContact CG2-CB 3.68Å; I1170-K1175 VanDerWaalsContact O-CE 3.26Å; I1170-K1175 WeakPolarHBondContact O-CE 3.27Å; I1170-K1175 PolarHBondContact O-NZ 2.91Å
1171	S	95.3	Very high	94.4	Very high	26 Å²	26	54 Å²	54	18%	0.182	30%	0.302	C	S	.	.			trans	-60.7	155.3	-172	76.6	0	0	0	0	114.2	E1039 H1173 A1174 K1175	E1039-S1171 PolarHBondContact OE1-N 3.4Å; E1039-S1171 VanDerWaalsContact OE2-CB 3.22Å; E1039-S1171 WeakPolarHBondContact OE2-CB 3.5Å; E1039-S1171 PolarHBondContact OE2-OG 3.08Å; S1171-H1173 VanDerWaalsContact C-N 3.3Å; S1171-H1173 PolarHBondContact O-N 3.18Å; S1171-A1174 PolarHBondContact O-N 3.33Å; S1171-A1174 PolarHBondContact OG-N 3.46Å; S1171-A1174 VanDerWaalsContact OG-N 3.13Å; S1171-K1175 WeakPolarHBondContact O-CG 3.39Å; S1171-K1175 PolarHBondContact O-N 2.61Å
1172	S	94.7	Very high	94.7	Very high	81 Å²	81	50.8 Å²	50.8	57%	0.566	28%	0.283	S	S	*	.	H	α-helix	trans	-56.6	-44.1	170	46.9	0	0	0	0	111.5	A1174 K1175 D1176	S1172-A1174 VanDerWaalsContact C-N 3.32Å; S1172-A1174 PolarHBondContact O-N 3.08Å; S1172-K1175 WeakPolarHBondContact O-CB 3.47Å; S1172-K1175 PolarHBondContact O-N 3.34Å; S1172-K1175 VanDerWaalsContact O-N 3.14Å; S1172-D1176 VanDerWaalsContact O-CB 3.32Å; S1172-D1176 WeakPolarHBondContact O-CB 3.46Å; S1172-D1176 PolarHBondContact O-N 2.89Å
1173	H	95.4	Very high	94.8	Very high	39 Å²	39	50.1 Å²	50.1	18%	0.181	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-30.9	-178.7	-55	107.3	0	0	0	113.5	S1171 L1177 H1198 W1200	S1171-H1173 VanDerWaalsContact C-N 3.3Å; S1171-H1173 PolarHBondContact O-N 3.18Å; H1173-L1177 WeakPolarHBondContact O-CB 3.48Å; H1173-L1177 PolarHBondContact O-N 3.12Å; H1173-L1177 VanDerWaalsContact O-N 3.14Å; H1173-H1198 PolarHBondContact O-CE1 3.36Å; H1173-W1200 HydrophobicContact CB-CB 3.89Å; H1173-W1200 HydrophobicContact CB-CG 4.33Å
1174	A	97.2	Very high	94.9	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.5	-43.3	171.5	0	0	0	0	0	112.1	L1135 I1170 S1171 S1172 I1178 W1200	L1135-A1174 HydrophobicContact CD1-CB 3.9Å; I1170-A1174 HydrophobicContact CG2-CB 3.68Å; S1171-A1174 PolarHBondContact O-N 3.33Å; S1171-A1174 PolarHBondContact OG-N 3.46Å; S1171-A1174 VanDerWaalsContact OG-N 3.13Å; S1172-A1174 VanDerWaalsContact C-N 3.32Å; S1172-A1174 PolarHBondContact O-N 3.08Å; A1174-I1178 WeakPolarHBondContact O-CG1 3.31Å; A1174-I1178 PolarHBondContact O-N 3.14Å; A1174-I1178 VanDerWaalsContact O-N 3.17Å; A1174-W1200 HydrophobicContact CB-CD2 4.32Å; A1174-W1200 HydrophobicContact CB-CG 4.42Å; A1174-W1200 HydrophobicContact CB-CZ2 4.08Å
1175	K	97.6	Very high	95.2	Very high	50 Å²	50	48.8 Å²	48.8	22%	0.217	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-40.8	178.3	-69	161.6	176.7	158.3	0	111.4	F1162 W1167 I1170 S1171 S1172 I1178 T1179	F1162-K1175 HydrophobicContact CD1-CG 4.03Å; F1162-K1175 HydrophobicContact CD2-CB 4.23Å; F1162-K1175 HydrophobicContact CD2-CG 4.1Å; F1162-K1175 HydrophobicContact CE1-CB 4.18Å; F1162-K1175 HydrophobicContact CE1-CG 3.98Å; F1162-K1175 HydrophobicContact CE2-CB 3.74Å; F1162-K1175 HydrophobicContact CE2-CG 4.07Å; F1162-K1175 HydrophobicContact CG-CG 4.09Å; F1162-K1175 HydrophobicContact CZ-CB 3.71Å; F1162-K1175 HydrophobicContact CZ-CG 4Å; F1162-K1175 WeakPolarHBondContact CZ-O 3.22Å; W1167-K1175 HydrophobicContact CE3-CG 4.08Å; W1167-K1175 HydrophobicContact CZ3-CG 4.39Å; W1167-K1175 WeakPolarHBondContact O-CE 3.3Å; W1167-K1175 PolarHBondContact O-NZ 2.96Å; I1170-K1175 VanDerWaalsContact O-CE 3.26Å; I1170-K1175 WeakPolarHBondContact O-CE 3.27Å; I1170-K1175 PolarHBondContact O-NZ 2.91Å; S1171-K1175 WeakPolarHBondContact O-CG 3.39Å; S1171-K1175 PolarHBondContact O-N 2.61Å; S1172-K1175 WeakPolarHBondContact O-CB 3.47Å; S1172-K1175 PolarHBondContact O-N 3.34Å; S1172-K1175 VanDerWaalsContact O-N 3.14Å; K1175-I1178 PolarHBondContact O-N 3.04Å; K1175-T1179 WeakPolarHBondContact O-CB 3.37Å; K1175-T1179 PolarHBondContact O-N 3.43Å; K1175-T1179 PolarHBondContact O-OG1 3.25Å
1176	D	96.8	Very high	95.4	Very high	90 Å²	90	46.2 Å²	46.2	48%	0.481	26%	0.255	S	S	.	.	H	α-helix	trans	-60.3	-52	175.6	-171.6	43.7	0	0	0	111.3	S1172 I1178 T1179 A1180 H1198	S1172-D1176 VanDerWaalsContact O-CB 3.32Å; S1172-D1176 WeakPolarHBondContact O-CB 3.46Å; S1172-D1176 PolarHBondContact O-N 2.89Å; D1176-I1178 VanDerWaalsContact C-N 3.32Å; D1176-I1178 PolarHBondContact O-N 2.91Å; D1176-T1179 WeakPolarHBondContact O-CB 3.43Å; D1176-T1179 PolarHBondContact O-N 3.03Å; D1176-A1180 PolarHBondContact O-N 3.01Å; D1176-H1198 IonicContact OD2-CE1 3.07Å; D1176-H1198 IonicContact OD2-NE2 3.28Å; D1176-H1198 PolarHBondContact OD2-NE2 3.07Å
1177	L	98	Very high	95.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-53.4	-47.9	175.6	176.1	60.4	0	0	0	112.4	V1046 H1173 T1179 A1180 L1181 L1190 T1195 H1198 W1200 V1201	V1046-L1177 HydrophobicContact CG1-CD2 4.32Å; H1173-L1177 WeakPolarHBondContact O-CB 3.48Å; H1173-L1177 PolarHBondContact O-N 3.12Å; H1173-L1177 VanDerWaalsContact O-N 3.14Å; L1177-T1179 VanDerWaalsContact C-N 3.34Å; L1177-A1180 PolarHBondContact O-N 3.42Å; L1177-L1181 HydrophobicContact CD1-CD1 3.86Å; L1177-L1181 HydrophobicContact CD1-CG 4.16Å; L1177-L1181 HydrophobicContact CG-CD1 3.9Å; L1177-L1181 WeakPolarHBondContact O-CB 3.32Å; L1177-L1181 VanDerWaalsContact O-CG 3.32Å; L1177-L1181 WeakPolarHBondContact O-CG 3.37Å; L1177-L1181 PolarHBondContact O-N 2.92Å; L1177-L1190 HydrophobicContact CD1-CD1 3.77Å; L1177-T1195 HydrophobicContact CD1-CG2 4.16Å; L1177-H1198 HydrophobicContact CD1-CB 4.1Å; L1177-W1200 HydrophobicContact CD2-CD2 4.29Å; L1177-W1200 HydrophobicContact CD2-CE3 3.38Å; L1177-W1200 HydrophobicContact CD2-CZ3 3.84Å; L1177-V1201 HydrophobicContact CD2-CG2 3.64Å
1178	I	98.2	Very high	95.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-40.9	179.6	-71.9	168.5	0	0	0	110.9	T1131 Y1132 L1135 F1160 F1162 W1167 A1174 K1175 D1176 A1180 L1181 L1182	T1131-I1178 HydrophobicContact CG2-CD1 4.07Å; T1131-I1178 HydrophobicContact CG2-CG1 3.91Å; Y1132-I1178 HydrophobicContact CD2-CD1 4.4Å; Y1132-I1178 HydrophobicContact CD2-CG2 4.07Å; L1135-I1178 HydrophobicContact CD1-CD1 4.17Å; F1160-I1178 HydrophobicContact CE2-CG2 4.01Å; F1160-I1178 HydrophobicContact CZ-CG2 4.1Å; F1162-I1178 HydrophobicContact CE1-CB 4.29Å; F1162-I1178 HydrophobicContact CE1-CD1 4.32Å; F1162-I1178 HydrophobicContact CE1-CG2 4Å; F1162-I1178 HydrophobicContact CZ-CB 4.21Å; F1162-I1178 HydrophobicContact CZ-CG2 4.05Å; W1167-I1178 HydrophobicContact CH2-CD1 3.42Å; W1167-I1178 VanDerWaalsContact CH2-CD1 3.42Å; W1167-I1178 HydrophobicContact CZ2-CD1 4.49Å; W1167-I1178 HydrophobicContact CZ3-CD1 3.81Å; A1174-I1178 WeakPolarHBondContact O-CG1 3.31Å; A1174-I1178 PolarHBondContact O-N 3.14Å; A1174-I1178 VanDerWaalsContact O-N 3.17Å; K1175-I1178 PolarHBondContact O-N 3.04Å; D1176-I1178 VanDerWaalsContact C-N 3.32Å; D1176-I1178 PolarHBondContact O-N 2.91Å; I1178-A1180 VanDerWaalsContact C-N 3.31Å; I1178-A1180 PolarHBondContact O-N 3.07Å; I1178-L1181 PolarHBondContact O-N 2.91Å; I1178-L1182 HydrophobicContact CG2-CD1 3.73Å; I1178-L1182 HydrophobicContact CG2-CG 4.25Å; I1178-L1182 WeakPolarHBondContact O-CB 3.48Å; I1178-L1182 WeakPolarHBondContact O-CG 3.48Å; I1178-L1182 PolarHBondContact O-N 2.81Å
1179	T	97.7	Very high	95.9	Very high	68 Å²	68	50.2 Å²	50.2	42%	0.417	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-41.5	178.3	-55.1	0	0	0	0	110.9	K1175 D1176 L1177 L1182 V1183	K1175-T1179 WeakPolarHBondContact O-CB 3.37Å; K1175-T1179 PolarHBondContact O-N 3.43Å; K1175-T1179 PolarHBondContact O-OG1 3.25Å; D1176-T1179 WeakPolarHBondContact O-CB 3.43Å; D1176-T1179 PolarHBondContact O-N 3.03Å; L1177-T1179 VanDerWaalsContact C-N 3.34Å; T1179-L1182 PolarHBondContact O-N 2.77Å; T1179-V1183 VanDerWaalsContact O-CG2 3.31Å; T1179-V1183 WeakPolarHBondContact O-CG2 3.22Å
1180	A	97.7	Very high	96.2	Very high	26 Å²	26	44.5 Å²	44.5	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-77.3	-16.1	177.3	0	0	0	0	0	114.1	D1176 L1177 I1178 L1190	D1176-A1180 PolarHBondContact O-N 3.01Å; L1177-A1180 PolarHBondContact O-N 3.42Å; I1178-A1180 VanDerWaalsContact C-N 3.31Å; I1178-A1180 PolarHBondContact O-N 3.07Å; A1180-L1190 HydrophobicContact CB-CD1 3.53Å; A1180-L1190 HydrophobicContact CB-CD2 4.36Å; A1180-L1190 HydrophobicContact CB-CG 3.63Å; A1180-L1190 PolarHBondContact O-N 2.76Å
1181	L	98.1	Very high	96.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-89.1	-26.6	169.9	-75.5	171.6	0	0	0	113.9	M1124 L1127 L1177 I1178 R1189 L1190	M1124-L1181 HydrophobicContact CB-CD2 4.19Å; M1124-L1181 HydrophobicContact CE-CD2 3.65Å; L1127-L1181 HydrophobicContact CG-CD1 4.44Å; L1177-L1181 HydrophobicContact CD1-CD1 3.86Å; L1177-L1181 HydrophobicContact CD1-CG 4.16Å; L1177-L1181 HydrophobicContact CG-CD1 3.9Å; L1177-L1181 WeakPolarHBondContact O-CB 3.32Å; L1177-L1181 VanDerWaalsContact O-CG 3.32Å; L1177-L1181 WeakPolarHBondContact O-CG 3.37Å; L1177-L1181 PolarHBondContact O-N 2.92Å; I1178-L1181 PolarHBondContact O-N 2.91Å; L1181-R1189 VanDerWaalsContact O-CD 3.23Å; L1181-R1189 WeakPolarHBondContact O-CD 3.33Å; L1181-R1189 WeakPolarHBondContact O-CG 3.22Å; L1181-L1190 HydrophobicContact CD2-CB 4.09Å; L1181-L1190 HydrophobicContact CG-CD1 4.49Å
1182	L	97.4	Very high	96.4	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	-101.6	29.4	-178.7	-63.8	-177.4	0	0	0	113	W1125 I1129 P1140 F1160 I1178 T1179	W1125-L1182 HydrophobicContact CD2-CD2 3.89Å; W1125-L1182 HydrophobicContact CE3-CD2 3.99Å; W1125-L1182 HydrophobicContact CG-CD2 4.35Å; W1125-L1182 HydrophobicContact CZ2-CD2 4.47Å; W1125-L1182 HydrophobicContact CZ3-CB 4.28Å; W1125-L1182 HydrophobicContact CZ3-CD2 4.34Å; W1125-L1182 WeakPolarHBondContact CZ3-O 3.36Å; I1129-L1182 HydrophobicContact CD1-CD1 4.4Å; I1129-L1182 HydrophobicContact CD1-CD2 3.72Å; I1129-L1182 HydrophobicContact CG1-CD2 4.03Å; P1140-L1182 HydrophobicContact CB-CD1 4.45Å; P1140-L1182 HydrophobicContact CG-CD1 4.02Å; F1160-L1182 HydrophobicContact CD1-CB 4.26Å; F1160-L1182 HydrophobicContact CD1-CD1 4.1Å; F1160-L1182 HydrophobicContact CE1-CB 3.56Å; F1160-L1182 HydrophobicContact CE1-CD1 3.86Å; F1160-L1182 HydrophobicContact CE1-CG 4.36Å; F1160-L1182 HydrophobicContact CE2-CD1 4.29Å; F1160-L1182 HydrophobicContact CG-CD1 4.44Å; F1160-L1182 HydrophobicContact CZ-CB 4.07Å; F1160-L1182 HydrophobicContact CZ-CD1 3.97Å; I1178-L1182 HydrophobicContact CG2-CD1 3.73Å; I1178-L1182 HydrophobicContact CG2-CG 4.25Å; I1178-L1182 WeakPolarHBondContact O-CB 3.48Å; I1178-L1182 WeakPolarHBondContact O-CG 3.48Å; I1178-L1182 PolarHBondContact O-N 2.81Å; T1179-L1182 PolarHBondContact O-N 2.77Å
1183	V	95.9	Very high	96.5	Very high	41 Å²	41	43.4 Å²	43.4	25%	0.248	24%	0.236	C	C	.	.			trans	-72.5	129.8	171.9	-174.8	0	0	0	0	109.9	T1179 R1189	T1179-V1183 VanDerWaalsContact O-CG2 3.31Å; T1179-V1183 WeakPolarHBondContact O-CG2 3.22Å; V1183-R1189 HydrophobicContact CB-CB 4.28Å; V1183-R1189 HydrophobicContact CB-CG 4.48Å; V1183-R1189 PolarHBondContact O-NE 3.41Å; V1183-R1189 PolarHBondContact O-NH2 2.82Å; V1183-R1189 VanDerWaalsContact O-NH2 3.12Å
1184	I	94.2	Very high	96.6	Very high	52 Å²	52	43.3 Å²	43.3	27%	0.267	24%	0.235	S	C	.	.	S	Bend	trans	-56.8	-58.2	175.5	-70	-61.6	0	0	0	110.6	P1110 W1125 I1155 G1158 P1186 R1189	P1110-I1184 HydrophobicContact CB-CD1 3.8Å; P1110-I1184 HydrophobicContact CG-CD1 3.61Å; P1110-I1184 HydrophobicContact CG-CG2 4.48Å; W1125-I1184 HydrophobicContact CH2-CD1 4.1Å; W1125-I1184 HydrophobicContact CZ3-CD1 4.22Å; I1155-I1184 WeakPolarHBondContact O-CD1 3.26Å; G1158-I1184 VanDerWaalsContact CA-CD1 3.43Å; I1184-P1186 WeakPolarHBondContact O-CD 3.34Å; I1184-P1186 VanDerWaalsContact O-N 3.17Å; I1184-R1189 PolarHBondContact O-NH2 2.74Å
1185	T	93.8	Very high	96.7	Very high	78 Å²	78	43.3 Å²	43.3	48%	0.479	24%	0.235	S	C	.	.	S	Bend	trans	-61.2	111.8	-179.5	-57.3	0	0	0	0	110.9	K1187 S1188 R1189	T1185-K1187 VanDerWaalsContact C-N 3.31Å; T1185-K1187 PolarHBondContact O-N 2.71Å; T1185-S1188 PolarHBondContact O-N 2.88Å; T1185-R1189 PolarHBondContact O-N 2.7Å
1186	P	93.9	Very high	96.6	Very high	39 Å²	39	41.1 Å²	41.1	25%	0.253	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-61.9	-37.1	-170.9	-26.4	36.3	0	0	0	113.4	E1111 E1121 I1184 S1188 R1189	E1111-P1186 HydrophobicContact CB-CG 4.13Å; E1111-P1186 HydrophobicContact CG-CG 4.04Å; E1121-P1186 HydrophobicContact CB-CB 3.85Å; E1121-P1186 HydrophobicContact CG-CB 3.94Å; I1184-P1186 WeakPolarHBondContact O-CD 3.34Å; I1184-P1186 VanDerWaalsContact O-N 3.17Å; P1186-S1188 PolarHBondContact O-N 3.2Å; P1186-R1189 VanDerWaalsContact O-CB 3.29Å; P1186-R1189 WeakPolarHBondContact O-CB 3.13Å; P1186-R1189 PolarHBondContact O-N 3.07Å
1187	K	93.2	Very high	96.6	Very high	202 Å²	202	36.9 Å²	36.9	88%	0.878	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-65.6	-15.1	176.9	-65.6	-174.8	179	-179.5	0	114.8	T1185	T1185-K1187 VanDerWaalsContact C-N 3.31Å; T1185-K1187 PolarHBondContact O-N 2.71Å
1188	S	95.1	Very high	96.6	Very high	81 Å²	81	37.6 Å²	37.6	57%	0.566	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-106.4	0.7	179.8	-56	0	0	0	0	112.3	T1185 P1186	T1185-S1188 PolarHBondContact O-N 2.88Å; P1186-S1188 PolarHBondContact O-N 3.2Å
1189	R	97.3	Very high	96.4	Very high	9 Å²	9	38.8 Å²	38.8	3%	0.034	21%	0.214	C	C	.	.	S	Bend	trans	-85.4	142.1	176.5	-160.6	-177.7	-62.9	153.6	1.9	109.3	E1111 E1121 L1181 V1183 I1184 T1185 P1186 T1191	E1111-R1189 IonicContact OE1-CZ 3.84Å; E1111-R1189 IonicContact OE1-NH1 2.63Å; E1111-R1189 PolarHBondContact OE1-NH1 3.36Å; E1111-R1189 IonicContact OE1-NH2 2.81Å; E1111-R1189 PolarHBondContact OE1-NH2 3.42Å; E1111-R1189 IonicContact OE2-CZ 2.7Å; E1111-R1189 IonicContact OE2-NH1 3.74Å; E1111-R1189 IonicContact OE2-NH2 2.98Å; E1111-R1189 PolarHBondContact OE2-NH2 3.11Å; E1121-R1189 VanDerWaalsContact C-NH1 3.33Å; E1121-R1189 PolarHBondContact O-NH1 2.95Å; L1181-R1189 VanDerWaalsContact O-CD 3.23Å; L1181-R1189 WeakPolarHBondContact O-CD 3.33Å; L1181-R1189 WeakPolarHBondContact O-CG 3.22Å; V1183-R1189 HydrophobicContact CB-CB 4.28Å; V1183-R1189 HydrophobicContact CB-CG 4.48Å; V1183-R1189 PolarHBondContact O-NE 3.41Å; V1183-R1189 PolarHBondContact O-NH2 2.82Å; V1183-R1189 VanDerWaalsContact O-NH2 3.12Å; I1184-R1189 PolarHBondContact O-NH2 2.74Å; T1185-R1189 PolarHBondContact O-N 2.7Å; P1186-R1189 VanDerWaalsContact O-CB 3.29Å; P1186-R1189 WeakPolarHBondContact O-CB 3.13Å; P1186-R1189 PolarHBondContact O-N 3.07Å; R1189-T1191 PolarHBondContact O-N 3.45Å
1190	L	97.6	Very high	96.4	Very high	32 Å²	32	35.7 Å²	35.7	17%	0.168	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-58.1	132.4	179.6	-71.6	174.9	0	0	0	112	M1124 L1177 A1180 L1181 E1194	M1124-L1190 WeakPolarHBondContact CG-O 3.12Å; L1177-L1190 HydrophobicContact CD1-CD1 3.77Å; A1180-L1190 HydrophobicContact CB-CD1 3.53Å; A1180-L1190 HydrophobicContact CB-CD2 4.36Å; A1180-L1190 HydrophobicContact CB-CG 3.63Å; A1180-L1190 PolarHBondContact O-N 2.76Å; L1181-L1190 HydrophobicContact CD2-CB 4.09Å; L1181-L1190 HydrophobicContact CG-CD1 4.49Å; L1190-E1194 HydrophobicContact CD2-CB 3.87Å
1191	T	97.7	Very high	96.3	Very high	55 Å²	55	34.6 Å²	34.6	34%	0.337	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-77.6	157.3	167.9	64.8	0	0	0	0	111	R1189 R1193 E1194 T1195	R1189-T1191 PolarHBondContact O-N 3.45Å; T1191-R1193 PolarHBondContact O-N 3.07Å; T1191-R1193 VanDerWaalsContact O-N 3.14Å; T1191-R1193 PolarHBondContact OG1-NH2 3.36Å; T1191-E1194 WeakPolarHBondContact CB-OE2 3.44Å; T1191-E1194 PolarHBondContact N-OE2 2.87Å; T1191-E1194 WeakPolarHBondContact O-CA 3.27Å; T1191-E1194 WeakPolarHBondContact O-CB 3.15Å; T1191-E1194 PolarHBondContact O-N 2.7Å; T1191-E1194 VanDerWaalsContact OG1-CD 3.32Å; T1191-E1194 WeakPolarHBondContact OG1-CG 3.34Å; T1191-E1194 PolarHBondContact OG1-OE2 3.26Å; T1191-T1195 PolarHBondContact O-N 2.8Å; T1191-T1195 PolarHBondContact O-OG1 2.81Å
1192	A	97.9	Very high	96.2	Very high	2 Å²	2	37 Å²	37	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-53.8	-37.6	-178.4	0	0	0	0	0	113.9	L1053 F1054 M1124 E1194 T1195 L1196	L1053-A1192 HydrophobicContact CB-CB 3.93Å; F1054-A1192 HydrophobicContact CB-CB 3.92Å; M1124-A1192 HydrophobicContact CE-CB 4.19Å; M1124-A1192 HydrophobicContact SD-CB 3.77Å; A1192-E1194 VanDerWaalsContact C-N 3.25Å; A1192-E1194 PolarHBondContact O-N 3.33Å; A1192-T1195 PolarHBondContact O-N 2.94Å; A1192-L1196 WeakPolarHBondContact O-CG 3.38Å; A1192-L1196 PolarHBondContact O-N 3.12Å
1193	R	96.5	Very high	96	Very high	42 Å²	42	37.1 Å²	37.1	16%	0.158	20%	0.199	C	C	.	.	H	α-helix	trans	-54.6	-39	171.2	172.1	-175.7	56.7	101.9	16.9	112.7	F1054 T1191 A1197 L1224 E1225	F1054-R1193 HydrophobicContact CD2-CB 3.88Å; F1054-R1193 HydrophobicContact CE2-CB 3.89Å; F1054-R1193 HydrophobicContact CE2-CG 4.36Å; T1191-R1193 PolarHBondContact O-N 3.07Å; T1191-R1193 VanDerWaalsContact O-N 3.14Å; T1191-R1193 PolarHBondContact OG1-NH2 3.36Å; R1193-A1197 PolarHBondContact O-N 2.86Å; R1193-L1224 HydrophobicContact CG-CB 4.01Å; R1193-E1225 WeakPolarHBondContact CD-OE2 3.19Å; R1193-E1225 IonicContact CZ-OE2 2.67Å; R1193-E1225 VanDerWaalsContact CZ-OE2 3.26Å; R1193-E1225 IonicContact NE-OE2 2.67Å; R1193-E1225 PolarHBondContact NE-OE2 2.84Å; R1193-E1225 IonicContact NH1-OE2 3.24Å; R1193-E1225 PolarHBondContact NH1-OE2 3.34Å
1194	E	97.1	Very high	95.8	Very high	37 Å²	37	38.3 Å²	38.3	17%	0.173	21%	0.209	C	C	.	.	H	α-helix	trans	-89.4	-30.8	-172.8	-60.3	173.7	123.9	0	0	111.5	L1190 T1191 A1192 A1197 H1198 R1221	L1190-E1194 HydrophobicContact CD2-CB 3.87Å; T1191-E1194 WeakPolarHBondContact CB-OE2 3.44Å; T1191-E1194 PolarHBondContact N-OE2 2.87Å; T1191-E1194 WeakPolarHBondContact O-CA 3.27Å; T1191-E1194 WeakPolarHBondContact O-CB 3.15Å; T1191-E1194 PolarHBondContact O-N 2.7Å; T1191-E1194 VanDerWaalsContact OG1-CD 3.32Å; T1191-E1194 WeakPolarHBondContact OG1-CG 3.34Å; T1191-E1194 PolarHBondContact OG1-OE2 3.26Å; A1192-E1194 VanDerWaalsContact C-N 3.25Å; A1192-E1194 PolarHBondContact O-N 3.33Å; E1194-A1197 CarbonylContact O-C 3.58Å; E1194-A1197 PolarHBondContact O-N 3.23Å; E1194-H1198 PolarHBondContact O-N 3.32Å; E1194-R1221 IonicContact OE1-CZ 2.7Å; E1194-R1221 IonicContact OE1-NH1 3.39Å; E1194-R1221 IonicContact OE1-NH2 2.75Å; E1194-R1221 PolarHBondContact OE1-NH2 2.89Å
1195	T	98.1	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-46.3	163.4	-58.3	0	0	0	0	111.4	V1046 A1050 M1124 L1127 L1177 T1191 A1192 A1197 H1198 V1201	V1046-T1195 HydrophobicContact CG1-CG2 3.96Å; A1050-T1195 HydrophobicContact CB-CG2 3.7Å; M1124-T1195 WeakPolarHBondContact CE-OG1 3.42Å; L1127-T1195 HydrophobicContact CD2-CG2 4.07Å; L1177-T1195 HydrophobicContact CD1-CG2 4.16Å; T1191-T1195 PolarHBondContact O-N 2.8Å; T1191-T1195 PolarHBondContact O-OG1 2.81Å; A1192-T1195 PolarHBondContact O-N 2.94Å; T1195-A1197 VanDerWaalsContact C-N 3.31Å; T1195-A1197 PolarHBondContact O-N 3.1Å; T1195-H1198 WeakPolarHBondContact O-CB 3.3Å; T1195-H1198 PolarHBondContact O-N 2.93Å; T1195-H1198 VanDerWaalsContact O-N 3.16Å; T1195-V1201 HydrophobicContact CG2-CG2 4.26Å; T1195-V1201 VanDerWaalsContact O-CB 3.29Å; T1195-V1201 WeakPolarHBondContact O-CB 3.45Å; T1195-V1201 VanDerWaalsContact O-CG2 3.26Å; T1195-V1201 WeakPolarHBondContact O-CG2 3.08Å
1196	L	97.5	Very high	95.1	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-38	175	-74.3	167.7	0	0	0	112.8	A1050 F1054 A1192 H1198 Y1220 L1224	A1050-L1196 HydrophobicContact CB-CD2 3.92Å; A1050-L1196 HydrophobicContact CB-CG 3.85Å; F1054-L1196 HydrophobicContact CB-CD1 3.97Å; F1054-L1196 HydrophobicContact CG-CD1 4.22Å; A1192-L1196 WeakPolarHBondContact O-CG 3.38Å; A1192-L1196 PolarHBondContact O-N 3.12Å; L1196-H1198 VanDerWaalsContact C-N 3.31Å; L1196-Y1220 HydrophobicContact CB-CE1 4.23Å; L1196-L1224 HydrophobicContact CB-CD1 3.63Å; L1196-L1224 HydrophobicContact CD1-CD1 4.03Å; L1196-L1224 HydrophobicContact CD1-CD2 4.19Å; L1196-L1224 HydrophobicContact CG-CD1 4.49Å
1197	A	96.3	Very high	93.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	5.4	177.5	0	0	0	0	0	114.3	R1193 E1194 T1195 R1217 R1221	R1193-A1197 PolarHBondContact O-N 2.86Å; E1194-A1197 CarbonylContact O-C 3.58Å; E1194-A1197 PolarHBondContact O-N 3.23Å; T1195-A1197 VanDerWaalsContact C-N 3.31Å; T1195-A1197 PolarHBondContact O-N 3.1Å; A1197-R1217 WeakPolarHBondContact O-CD 3.47Å; A1197-R1217 WeakPolarHBondContact O-CG 3.28Å; A1197-R1217 PolarHBondContact O-NH1 3.32Å; A1197-R1221 HydrophobicContact CB-CB 3.76Å; A1197-R1221 HydrophobicContact CB-CG 3.86Å
1198	H	96.7	Very high	92.9	Very high	15 Å²	15	34.7 Å²	34.7	7%	0.069	20%	0.201	C	C	.	.	S	Bend	trans	-74.8	137	-179.1	-165.7	-89.7	0	0	0	110.6	H1173 D1176 L1177 E1194 T1195 L1196 W1200 V1201 F1202	H1173-H1198 PolarHBondContact O-CE1 3.36Å; D1176-H1198 IonicContact OD2-CE1 3.07Å; D1176-H1198 IonicContact OD2-NE2 3.28Å; D1176-H1198 PolarHBondContact OD2-NE2 3.07Å; L1177-H1198 HydrophobicContact CD1-CB 4.1Å; E1194-H1198 PolarHBondContact O-N 3.32Å; T1195-H1198 WeakPolarHBondContact O-CB 3.3Å; T1195-H1198 PolarHBondContact O-N 2.93Å; T1195-H1198 VanDerWaalsContact O-N 3.16Å; L1196-H1198 VanDerWaalsContact C-N 3.31Å; H1198-W1200 VanDerWaalsContact C-N 3.26Å; H1198-W1200 PolarHBondContact ND1-N 2.87Å; H1198-W1200 PolarHBondContact O-N 2.86Å; H1198-W1200 VanDerWaalsContact O-N 3.11Å; H1198-V1201 HydrophobicContact CB-CG2 4.25Å; H1198-V1201 PolarHBondContact O-N 3.47Å; H1198-F1202 PolarHBondContact O-N 3.35Å
1199	P	95.3	Very high	91.7	Very high	25 Å²	25	36 Å²	36	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-49.9	-42.4	-177.2	-29.5	34.3	0	0	0	114.1	V1201 G1203 F1213	P1199-V1201 PolarHBondContact O-N 3.28Å; P1199-G1203 WeakPolarHBondContact O-CA 3.49Å; P1199-G1203 PolarHBondContact O-N 3.09Å; P1199-F1213 HydrophobicContact CB-CE1 4.46Å
1200	W	96.5	Very high	91.2	Very high	3 Å²	3	37.8 Å²	37.8	1%	0.011	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-38.7	177.4	-167.9	75.1	0	0	0	114.6	E1039 A1042 A1043 V1046 T1131 L1135 H1173 A1174 L1177 H1198 S1204 G1205	E1039-W1200 HydrophobicContact CB-CZ2 3.93Å; E1039-W1200 HydrophobicContact CG-CZ2 4.08Å; E1039-W1200 PolarHBondContact OE2-NE1 3.15Å; A1042-W1200 HydrophobicContact CB-CH2 3.8Å; A1042-W1200 HydrophobicContact CB-CZ2 4.33Å; A1043-W1200 HydrophobicContact CB-CD2 4.13Å; A1043-W1200 HydrophobicContact CB-CE3 3.86Å; A1043-W1200 HydrophobicContact CB-CH2 3.92Å; A1043-W1200 HydrophobicContact CB-CZ2 4.11Å; A1043-W1200 HydrophobicContact CB-CZ3 3.77Å; V1046-W1200 HydrophobicContact CB-CZ3 4.29Å; V1046-W1200 HydrophobicContact CG2-CZ3 4.17Å; T1131-W1200 HydrophobicContact CG2-CH2 4.23Å; T1131-W1200 HydrophobicContact CG2-CZ3 4.15Å; L1135-W1200 HydrophobicContact CD1-CH2 4.21Å; L1135-W1200 HydrophobicContact CD1-CZ2 4.04Å; L1135-W1200 HydrophobicContact CD2-CH2 4.44Å; L1135-W1200 HydrophobicContact CD2-CZ2 4.17Å; H1173-W1200 HydrophobicContact CB-CB 3.89Å; H1173-W1200 HydrophobicContact CB-CG 4.33Å; A1174-W1200 HydrophobicContact CB-CD2 4.32Å; A1174-W1200 HydrophobicContact CB-CG 4.42Å; A1174-W1200 HydrophobicContact CB-CZ2 4.08Å; L1177-W1200 HydrophobicContact CD2-CD2 4.29Å; L1177-W1200 HydrophobicContact CD2-CE3 3.38Å; L1177-W1200 HydrophobicContact CD2-CZ3 3.84Å; H1198-W1200 VanDerWaalsContact C-N 3.26Å; H1198-W1200 PolarHBondContact ND1-N 2.87Å; H1198-W1200 PolarHBondContact O-N 2.86Å; H1198-W1200 VanDerWaalsContact O-N 3.11Å; W1200-S1204 PolarHBondContact O-N 3.33Å; W1200-G1205 PolarHBondContact O-N 3.2Å
1201	V	96.9	Very high	90.8	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-79.8	-48.2	-177.6	-177.2	0	0	0	0	109.7	V1046 L1177 T1195 H1198 P1199 G1203 S1204	V1046-V1201 HydrophobicContact CG1-CG2 3.89Å; L1177-V1201 HydrophobicContact CD2-CG2 3.64Å; T1195-V1201 HydrophobicContact CG2-CG2 4.26Å; T1195-V1201 VanDerWaalsContact O-CB 3.29Å; T1195-V1201 WeakPolarHBondContact O-CB 3.45Å; T1195-V1201 VanDerWaalsContact O-CG2 3.26Å; T1195-V1201 WeakPolarHBondContact O-CG2 3.08Å; H1198-V1201 HydrophobicContact CB-CG2 4.25Å; H1198-V1201 PolarHBondContact O-N 3.47Å; P1199-V1201 PolarHBondContact O-N 3.28Å; V1201-G1203 VanDerWaalsContact C-N 3.31Å; V1201-G1203 PolarHBondContact O-N 3.25Å; V1201-S1204 PolarHBondContact O-N 3.33Å
1202	F	95.2	Very high	90.4	Very high	51 Å²	51	48.3 Å²	48.3	22%	0.224	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-37.7	177	-170.8	-105.3	0	0	0	112.1	H1198 S1204 F1213 R1216 R1217 Y1220	H1198-F1202 PolarHBondContact O-N 3.35Å; F1202-S1204 PolarHBondContact O-N 2.88Å; F1202-F1213 HydrophobicContact CB-CZ 4.5Å; F1202-F1213 HydrophobicContact CD1-CD2 4.2Å; F1202-F1213 HydrophobicContact CD1-CE1 4.4Å; F1202-F1213 AromaticContact CD1-CE2 3.54Å; F1202-F1213 HydrophobicContact CD1-CE2 3.54Å; F1202-F1213 AromaticContact CD1-CZ 3.67Å; F1202-F1213 HydrophobicContact CD1-CZ 3.67Å; F1202-F1213 HydrophobicContact CE1-CD2 4.27Å; F1202-F1213 HydrophobicContact CE1-CE2 4.04Å; F1202-F1213 HydrophobicContact CE1-CZ 4.49Å; F1202-R1216 HydrophobicContact CE1-CB 4.16Å; F1202-R1216 HydrophobicContact CZ-CB 4.01Å; F1202-R1216 WeakPolarHBondContact CZ-O 3.22Å; F1202-R1217 HydrophobicContact CB-CG 4.05Å; F1202-R1217 HydrophobicContact CD1-CB 3.53Å; F1202-R1217 HydrophobicContact CD1-CG 3.66Å; F1202-R1217 VanDerWaalsContact CE1-CA 3.45Å; F1202-R1217 HydrophobicContact CE1-CB 3.63Å; F1202-R1217 HydrophobicContact CE1-CG 4.24Å; F1202-R1217 HydrophobicContact CG-CB 4.17Å; F1202-R1217 HydrophobicContact CG-CG 3.84Å; F1202-R1217 HydrophobicContact CZ-CB 4.32Å; F1202-Y1220 AromaticContact CD2-CD1 3.52Å; F1202-Y1220 HydrophobicContact CD2-CD1 3.52Å; F1202-Y1220 HydrophobicContact CD2-CE1 4.07Å; F1202-Y1220 HydrophobicContact CD2-CG 4.18Å; F1202-Y1220 AromaticContact CE2-CD1 3.57Å; F1202-Y1220 HydrophobicContact CE2-CD1 3.57Å; F1202-Y1220 HydrophobicContact CE2-CE1 4.36Å; F1202-Y1220 AromaticContact CE2-CG 3.74Å; F1202-Y1220 HydrophobicContact CE2-CG 3.74Å
1203	G	93	Very high	90.1	Very high	9 Å²	9	48.7 Å²	48.7	9%	0.093	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	3.2	173.4	0	0	0	0	0	115.2	P1199 V1201 G1205 L1206	P1199-G1203 WeakPolarHBondContact O-CA 3.49Å; P1199-G1203 PolarHBondContact O-N 3.09Å; V1201-G1203 VanDerWaalsContact C-N 3.31Å; V1201-G1203 PolarHBondContact O-N 3.25Å; G1203-G1205 VanDerWaalsContact C-N 3.26Å; G1203-G1205 PolarHBondContact O-N 2.85Å; G1203-L1206 WeakPolarHBondContact O-CB 3.3Å; G1203-L1206 PolarHBondContact O-N 3.48Å
1204	S	92.5	Very high	89.9	Confident	65 Å²	65	49.3 Å²	49.3	46%	0.455	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	45.8	-178.4	-58.4	0	0	0	0	112.8	P1040 W1200 V1201 F1202 L1206	P1040-S1204 VanDerWaalsContact CA-O 3.23Å; P1040-S1204 WeakPolarHBondContact CA-O 3.37Å; P1040-S1204 VanDerWaalsContact CB-O 3.32Å; P1040-S1204 WeakPolarHBondContact CB-O 3.4Å; W1200-S1204 PolarHBondContact O-N 3.33Å; V1201-S1204 PolarHBondContact O-N 3.33Å; F1202-S1204 PolarHBondContact O-N 2.88Å; S1204-L1206 VanDerWaalsContact C-N 3.26Å; S1204-L1206 PolarHBondContact O-N 3.48Å
1205	G	88.7	Confident	89.7	Confident	6 Å²	6	54 Å²	54	6%	0.062	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	3.4	179.9	0	0	0	0	0	115.5	A1043 W1200 G1203	A1043-G1205 VanDerWaalsContact CB-N 3.29Å; W1200-G1205 PolarHBondContact O-N 3.2Å; G1203-G1205 VanDerWaalsContact C-N 3.26Å; G1203-G1205 PolarHBondContact O-N 2.85Å
1206	L	83.8	Confident	89.5	Confident	107 Å²	107	59.1 Å²	59.1	56%	0.56	31%	0.305	S	S	*	.			trans	-97.3	137	-179.8	-58.5	176.7	0	0	0	111.9	P1040 G1203 S1204 N1208	P1040-L1206 HydrophobicContact CG-CD2 4.19Å; G1203-L1206 WeakPolarHBondContact O-CB 3.3Å; G1203-L1206 PolarHBondContact O-N 3.48Å; S1204-L1206 VanDerWaalsContact C-N 3.26Å; S1204-L1206 PolarHBondContact O-N 3.48Å; L1206-N1208 PolarHBondContact O-N 3.06Å; L1206-N1208 VanDerWaalsContact O-N 3.08Å
1207	P	68	Low	89.4	Confident	104 Å²	104	61 Å²	61	68%	0.675	31%	0.311	S	S	*	.			trans	-77.8	90.5	171.3	32.3	-33.1	0	0	0	110.2
1208	N	72.3	Confident	89.2	Confident	79 Å²	79	65.2 Å²	65.2	42%	0.422	33%	0.333	S	S	.	.			trans	-120.5	130	165.6	-168.8	-11.9	0	0	0	108.5	L1206 S1210 F1213	L1206-N1208 PolarHBondContact O-N 3.06Å; L1206-N1208 VanDerWaalsContact O-N 3.08Å; N1208-S1210 PolarHBondContact OD1-N 3.29Å; N1208-F1213 HydrophobicContact CB-CD2 4.45Å; N1208-F1213 WeakPolarHBondContact O-CD1 3.47Å; N1208-F1213 VanDerWaalsContact O-CE1 3.23Å; N1208-F1213 WeakPolarHBondContact O-CE1 3.34Å
1209	L	70.9	Confident	89.2	Confident	109 Å²	109	68.4 Å²	68.4	57%	0.571	35%	0.351	S	S	*	.			trans	-134.4	31.5	-176.1	-66.7	174.8	0	0	0	111.1
1210	S	87.4	Confident	89.1	Confident	45 Å²	45	70.2 Å²	70.2	32%	0.315	36%	0.355	S	S	.	.			trans	-65.7	150.3	170.5	72.6	0	0	0	0	111	N1208 E1212 F1213 E1214	N1208-S1210 PolarHBondContact OD1-N 3.29Å; S1210-E1212 PolarHBondContact O-N 3Å; S1210-F1213 WeakPolarHBondContact O-CA 3.37Å; S1210-F1213 WeakPolarHBondContact O-CB 3.42Å; S1210-F1213 PolarHBondContact O-N 3.15Å; S1210-F1213 WeakPolarHBondContact OG-CB 3.47Å; S1210-F1213 PolarHBondContact OG-N 3.08Å; S1210-F1213 VanDerWaalsContact OG-N 3.15Å; S1210-E1214 PolarHBondContact O-N 3.33Å
1211	E	87.9	Confident	89.1	Confident	179 Å²	179	73.6 Å²	73.6	84%	0.836	37%	0.368	S	S	*	.	H	α-helix	trans	-57	-34.2	176.4	-61.7	179.5	170.3	0	0	111.9	E1214 K1215	E1211-E1214 PolarHBondContact O-N 3.29Å; E1211-K1215 VanDerWaalsContact O-CB 3.22Å; E1211-K1215 WeakPolarHBondContact O-CB 3.48Å; E1211-K1215 PolarHBondContact O-N 2.92Å
1212	E	90.6	Very high	89	Confident	129 Å²	129	77.7 Å²	77.7	60%	0.603	39%	0.39	S	S	*	.	H	α-helix	trans	-67.2	-36.8	174.2	-164.3	-155.3	159.1	0	0	112.6	S1210 R1216	S1210-E1212 PolarHBondContact O-N 3Å; E1212-R1216 WeakPolarHBondContact O-CB 3.17Å; E1212-R1216 VanDerWaalsContact O-CG 3.29Å; E1212-R1216 WeakPolarHBondContact O-CG 3.42Å; E1212-R1216 PolarHBondContact O-N 3.43Å; E1212-R1216 PolarHBondContact O-NE 2.95Å; E1212-R1216 IonicContact OE1-NE 3.9Å
1213	F	91.9	Very high	89	Confident	10 Å²	10	79.4 Å²	79.4	4%	0.044	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-49.1	173.7	172.5	-92.6	0	0	0	110.7	P1199 F1202 N1208 S1210 K1215 R1216 R1217	P1199-F1213 HydrophobicContact CB-CE1 4.46Å; F1202-F1213 HydrophobicContact CB-CZ 4.5Å; F1202-F1213 HydrophobicContact CD1-CD2 4.2Å; F1202-F1213 HydrophobicContact CD1-CE1 4.4Å; F1202-F1213 AromaticContact CD1-CE2 3.54Å; F1202-F1213 HydrophobicContact CD1-CE2 3.54Å; F1202-F1213 AromaticContact CD1-CZ 3.67Å; F1202-F1213 HydrophobicContact CD1-CZ 3.67Å; F1202-F1213 HydrophobicContact CE1-CD2 4.27Å; F1202-F1213 HydrophobicContact CE1-CE2 4.04Å; F1202-F1213 HydrophobicContact CE1-CZ 4.49Å; N1208-F1213 HydrophobicContact CB-CD2 4.45Å; N1208-F1213 WeakPolarHBondContact O-CD1 3.47Å; N1208-F1213 VanDerWaalsContact O-CE1 3.23Å; N1208-F1213 WeakPolarHBondContact O-CE1 3.34Å; S1210-F1213 WeakPolarHBondContact O-CA 3.37Å; S1210-F1213 WeakPolarHBondContact O-CB 3.42Å; S1210-F1213 PolarHBondContact O-N 3.15Å; S1210-F1213 WeakPolarHBondContact OG-CB 3.47Å; S1210-F1213 PolarHBondContact OG-N 3.08Å; S1210-F1213 VanDerWaalsContact OG-N 3.15Å; F1213-K1215 PolarHBondContact O-N 3.42Å; F1213-R1216 PolarHBondContact O-N 2.92Å; F1213-R1217 WeakPolarHBondContact O-CB 3.43Å; F1213-R1217 PolarHBondContact O-N 3.2Å
1214	E	91.5	Very high	89.1	Confident	55 Å²	55	79.3 Å²	79.3	26%	0.257	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-38.6	179.9	-77.8	-62	109.3	0	0	112.5	S1210 E1211 R1217 L1218	S1210-E1214 PolarHBondContact O-N 3.33Å; E1211-E1214 PolarHBondContact O-N 3.29Å; E1214-R1217 VanDerWaalsContact CD-NE 3.32Å; E1214-R1217 WeakPolarHBondContact O-CB 3.28Å; E1214-R1217 PolarHBondContact O-N 3.01Å; E1214-R1217 WeakPolarHBondContact OE1-CD 3.14Å; E1214-R1217 IonicContact OE1-CZ 2.75Å; E1214-R1217 IonicContact OE1-NE 2.73Å; E1214-R1217 PolarHBondContact OE1-NE 2.91Å; E1214-R1217 IonicContact OE1-NH2 3.17Å; E1214-R1217 IonicContact OE2-CZ 3.32Å; E1214-R1217 VanDerWaalsContact OE2-CZ 3.29Å; E1214-R1217 IonicContact OE2-NE 2.82Å; E1214-R1217 PolarHBondContact OE2-NE 2.7Å; E1214-R1217 VanDerWaalsContact OE2-NE 3.1Å; E1214-R1217 IonicContact OE2-NH2 3.03Å; E1214-R1217 PolarHBondContact OE2-NH2 3.17Å; E1214-L1218 WeakPolarHBondContact O-CB 3.36Å; E1214-L1218 PolarHBondContact O-N 3.05Å
1215	K	93.1	Very high	89.1	Confident	137 Å²	137	79 Å²	79	60%	0.596	39%	0.387	S	S	*	.	H	α-helix	trans	-59	-53.4	171.2	-178.3	178	177.7	-178.4	0	111.3	E1211 F1213 R1217 L1218 D1219	E1211-K1215 VanDerWaalsContact O-CB 3.22Å; E1211-K1215 WeakPolarHBondContact O-CB 3.48Å; E1211-K1215 PolarHBondContact O-N 2.92Å; F1213-K1215 PolarHBondContact O-N 3.42Å; K1215-R1217 PolarHBondContact O-N 3.45Å; K1215-L1218 PolarHBondContact O-N 3.48Å; K1215-L1218 VanDerWaalsContact O-N 3.1Å; K1215-D1219 VanDerWaalsContact O-CG 3.32Å; K1215-D1219 PolarHBondContact O-N 3.22Å
1216	R	93.9	Very high	89.3	Confident	107 Å²	107	85 Å²	85	40%	0.404	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-33.8	178.2	-72.8	-177	-66.9	116.1	-4	112.4	F1202 E1212 F1213 Y1220	F1202-R1216 HydrophobicContact CE1-CB 4.16Å; F1202-R1216 HydrophobicContact CZ-CB 4.01Å; F1202-R1216 WeakPolarHBondContact CZ-O 3.22Å; E1212-R1216 WeakPolarHBondContact O-CB 3.17Å; E1212-R1216 VanDerWaalsContact O-CG 3.29Å; E1212-R1216 WeakPolarHBondContact O-CG 3.42Å; E1212-R1216 PolarHBondContact O-N 3.43Å; E1212-R1216 PolarHBondContact O-NE 2.95Å; E1212-R1216 IonicContact OE1-NE 3.9Å; F1213-R1216 PolarHBondContact O-N 2.92Å; R1216-Y1220 WeakPolarHBondContact O-CB 3.29Å; R1216-Y1220 PolarHBondContact O-N 3.37Å
1217	R	94.4	Very high	89.8	Confident	42 Å²	42	84.3 Å²	84.3	16%	0.158	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-40.5	175.4	-168.4	-176.1	67.1	69.8	4.6	111.9	A1197 F1202 F1213 E1214 K1215 R1221	A1197-R1217 WeakPolarHBondContact O-CD 3.47Å; A1197-R1217 WeakPolarHBondContact O-CG 3.28Å; A1197-R1217 PolarHBondContact O-NH1 3.32Å; F1202-R1217 HydrophobicContact CB-CG 4.05Å; F1202-R1217 HydrophobicContact CD1-CB 3.53Å; F1202-R1217 HydrophobicContact CD1-CG 3.66Å; F1202-R1217 VanDerWaalsContact CE1-CA 3.45Å; F1202-R1217 HydrophobicContact CE1-CB 3.63Å; F1202-R1217 HydrophobicContact CE1-CG 4.24Å; F1202-R1217 HydrophobicContact CG-CB 4.17Å; F1202-R1217 HydrophobicContact CG-CG 3.84Å; F1202-R1217 HydrophobicContact CZ-CB 4.32Å; F1213-R1217 WeakPolarHBondContact O-CB 3.43Å; F1213-R1217 PolarHBondContact O-N 3.2Å; E1214-R1217 VanDerWaalsContact CD-NE 3.32Å; E1214-R1217 WeakPolarHBondContact O-CB 3.28Å; E1214-R1217 PolarHBondContact O-N 3.01Å; E1214-R1217 WeakPolarHBondContact OE1-CD 3.14Å; E1214-R1217 IonicContact OE1-CZ 2.75Å; E1214-R1217 IonicContact OE1-NE 2.73Å; E1214-R1217 PolarHBondContact OE1-NE 2.91Å; E1214-R1217 IonicContact OE1-NH2 3.17Å; E1214-R1217 IonicContact OE2-CZ 3.32Å; E1214-R1217 VanDerWaalsContact OE2-CZ 3.29Å; E1214-R1217 IonicContact OE2-NE 2.82Å; E1214-R1217 PolarHBondContact OE2-NE 2.7Å; E1214-R1217 VanDerWaalsContact OE2-NE 3.1Å; E1214-R1217 IonicContact OE2-NH2 3.03Å; E1214-R1217 PolarHBondContact OE2-NH2 3.17Å; K1215-R1217 PolarHBondContact O-N 3.45Å; R1217-R1221 PolarHBondContact O-N 3.35Å
1218	L	93.1	Very high	90.8	Very high	89 Å²	89	81.1 Å²	81.1	47%	0.466	38%	0.38	S	S	.	.	H	α-helix	trans	-71.2	-42.7	176.3	-174.9	60.2	0	0	0	111.9	E1214 K1215 Y1220 R1221 N1222	E1214-L1218 WeakPolarHBondContact O-CB 3.36Å; E1214-L1218 PolarHBondContact O-N 3.05Å; K1215-L1218 PolarHBondContact O-N 3.48Å; K1215-L1218 VanDerWaalsContact O-N 3.1Å; L1218-Y1220 VanDerWaalsContact C-N 3.3Å; L1218-Y1220 PolarHBondContact O-N 2.94Å; L1218-R1221 WeakPolarHBondContact O-CB 3.46Å; L1218-R1221 PolarHBondContact O-N 3.47Å; L1218-R1221 VanDerWaalsContact O-N 3.15Å; L1218-N1222 VanDerWaalsContact O-CG 3.24Å; L1218-N1222 PolarHBondContact O-N 2.76Å; L1218-N1222 PolarHBondContact O-ND2 3.06Å
1219	D	95.5	Very high	91.7	Very high	83 Å²	83	80 Å²	80	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-57.9	-44	173.8	-68.6	-28.5	0	0	0	110.8	K1215 N1222 E1223	K1215-D1219 VanDerWaalsContact O-CG 3.32Å; K1215-D1219 PolarHBondContact O-N 3.22Å; D1219-N1222 WeakPolarHBondContact O-CB 3.47Å; D1219-N1222 PolarHBondContact O-N 3.2Å; D1219-E1223 PolarHBondContact O-N 3.37Å
1220	Y	95.2	Very high	92.6	Very high	63 Å²	63	78.9 Å²	78.9	25%	0.247	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-38.5	174.4	-178.8	-119.5	0	0	0	113.2	L1196 F1202 R1216 L1218 N1222 E1223 L1224	L1196-Y1220 HydrophobicContact CB-CE1 4.23Å; F1202-Y1220 AromaticContact CD2-CD1 3.52Å; F1202-Y1220 HydrophobicContact CD2-CD1 3.52Å; F1202-Y1220 HydrophobicContact CD2-CE1 4.07Å; F1202-Y1220 HydrophobicContact CD2-CG 4.18Å; F1202-Y1220 AromaticContact CE2-CD1 3.57Å; F1202-Y1220 HydrophobicContact CE2-CD1 3.57Å; F1202-Y1220 HydrophobicContact CE2-CE1 4.36Å; F1202-Y1220 AromaticContact CE2-CG 3.74Å; F1202-Y1220 HydrophobicContact CE2-CG 3.74Å; R1216-Y1220 WeakPolarHBondContact O-CB 3.29Å; R1216-Y1220 PolarHBondContact O-N 3.37Å; L1218-Y1220 VanDerWaalsContact C-N 3.3Å; L1218-Y1220 PolarHBondContact O-N 2.94Å; Y1220-N1222 VanDerWaalsContact C-N 3.27Å; Y1220-N1222 PolarHBondContact O-N 3.22Å; Y1220-E1223 WeakPolarHBondContact O-CB 3.23Å; Y1220-E1223 PolarHBondContact O-N 3.42Å; Y1220-L1224 HydrophobicContact CD1-CD1 4.1Å; Y1220-L1224 HydrophobicContact CE1-CD1 3.67Å; Y1220-L1224 HydrophobicContact CE1-CG 4.32Å; Y1220-L1224 HydrophobicContact CE2-CD1 4.38Å; Y1220-L1224 HydrophobicContact CE2-CD2 4.23Å; Y1220-L1224 HydrophobicContact CE2-CG 4.16Å; Y1220-L1224 WeakPolarHBondContact O-CG 3.32Å; Y1220-L1224 PolarHBondContact O-N 3.36Å
1221	R	95	Very high	92.5	Very high	73 Å²	73	78.4 Å²	78.4	28%	0.275	36%	0.358	S	S	.	.	H	α-helix	trans	-58.6	-41.1	172.1	-172.3	179.1	171.4	99.2	4.2	111.3	E1194 A1197 R1217 L1218 L1224 E1225	E1194-R1221 IonicContact OE1-CZ 2.7Å; E1194-R1221 IonicContact OE1-NH1 3.39Å; E1194-R1221 IonicContact OE1-NH2 2.75Å; E1194-R1221 PolarHBondContact OE1-NH2 2.89Å; A1197-R1221 HydrophobicContact CB-CB 3.76Å; A1197-R1221 HydrophobicContact CB-CG 3.86Å; R1217-R1221 PolarHBondContact O-N 3.35Å; L1218-R1221 WeakPolarHBondContact O-CB 3.46Å; L1218-R1221 PolarHBondContact O-N 3.47Å; L1218-R1221 VanDerWaalsContact O-N 3.15Å; R1221-L1224 PolarHBondContact O-N 2.98Å; R1221-E1225 PolarHBondContact O-N 3.34Å
1222	N	95.3	Very high	92.2	Very high	90 Å²	90	74.5 Å²	74.5	48%	0.481	34%	0.338	S	S	.	.	H	α-helix	trans	-69.6	-36.9	177.6	-63.6	-26.6	0	0	0	112	L1218 D1219 Y1220 E1225 K1226	L1218-N1222 VanDerWaalsContact O-CG 3.24Å; L1218-N1222 PolarHBondContact O-N 2.76Å; L1218-N1222 PolarHBondContact O-ND2 3.06Å; D1219-N1222 WeakPolarHBondContact O-CB 3.47Å; D1219-N1222 PolarHBondContact O-N 3.2Å; Y1220-N1222 VanDerWaalsContact C-N 3.27Å; Y1220-N1222 PolarHBondContact O-N 3.22Å; N1222-E1225 PolarHBondContact O-N 3.37Å; N1222-K1226 PolarHBondContact O-N 3.1Å
1223	E	95.4	Very high	91.7	Very high	87 Å²	87	73.8 Å²	73.8	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-43.5	173.2	-164.1	-156.3	136.3	0	0	112	D1219 Y1220 K1226 K1227	D1219-E1223 PolarHBondContact O-N 3.37Å; Y1220-E1223 WeakPolarHBondContact O-CB 3.23Å; Y1220-E1223 PolarHBondContact O-N 3.42Å; E1223-K1226 PolarHBondContact O-N 3.03Å; E1223-K1227 WeakPolarHBondContact O-CG 3.36Å; E1223-K1227 PolarHBondContact O-N 3.43Å; E1223-K1227 VanDerWaalsContact OE1-CE 3.26Å; E1223-K1227 WeakPolarHBondContact OE1-CE 2.95Å; E1223-K1227 IonicContact OE1-NZ 3.88Å; E1223-K1227 PolarHBondContact OE1-NZ 3.19Å
1224	L	94.2	Very high	91	Very high	6 Å²	6	75.3 Å²	75.3	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-38.1	175.1	-67.3	174.1	0	0	0	112.1	F1054 R1193 L1196 Y1220 R1221 K1227 H1228	F1054-L1224 HydrophobicContact CD1-CD2 4.43Å; F1054-L1224 HydrophobicContact CE1-CD2 4.04Å; F1054-L1224 HydrophobicContact CZ-CB 4.45Å; F1054-L1224 HydrophobicContact CZ-CD2 4.31Å; F1054-L1224 WeakPolarHBondContact CZ-O 3.23Å; R1193-L1224 HydrophobicContact CG-CB 4.01Å; L1196-L1224 HydrophobicContact CB-CD1 3.63Å; L1196-L1224 HydrophobicContact CD1-CD1 4.03Å; L1196-L1224 HydrophobicContact CD1-CD2 4.19Å; L1196-L1224 HydrophobicContact CG-CD1 4.49Å; Y1220-L1224 HydrophobicContact CD1-CD1 4.1Å; Y1220-L1224 HydrophobicContact CE1-CD1 3.67Å; Y1220-L1224 HydrophobicContact CE1-CG 4.32Å; Y1220-L1224 HydrophobicContact CE2-CD1 4.38Å; Y1220-L1224 HydrophobicContact CE2-CD2 4.23Å; Y1220-L1224 HydrophobicContact CE2-CG 4.16Å; Y1220-L1224 WeakPolarHBondContact O-CG 3.32Å; Y1220-L1224 PolarHBondContact O-N 3.36Å; R1221-L1224 PolarHBondContact O-N 2.98Å; L1224-K1227 PolarHBondContact O-N 3.26Å; L1224-H1228 WeakPolarHBondContact O-CB 3.48Å; L1224-H1228 PolarHBondContact O-N 3.18Å
1225	E	93.3	Very high	89.9	Confident	58 Å²	58	76.7 Å²	76.7	27%	0.271	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-42.7	173.8	-170.4	59.3	-137	0	0	111.6	R1193 R1221 N1222 H1228 N1229	R1193-E1225 WeakPolarHBondContact CD-OE2 3.19Å; R1193-E1225 IonicContact CZ-OE2 2.67Å; R1193-E1225 VanDerWaalsContact CZ-OE2 3.26Å; R1193-E1225 IonicContact NE-OE2 2.67Å; R1193-E1225 PolarHBondContact NE-OE2 2.84Å; R1193-E1225 IonicContact NH1-OE2 3.24Å; R1193-E1225 PolarHBondContact NH1-OE2 3.34Å; R1221-E1225 PolarHBondContact O-N 3.34Å; N1222-E1225 PolarHBondContact O-N 3.37Å; E1225-H1228 PolarHBondContact O-N 2.78Å; E1225-N1229 PolarHBondContact O-N 2.74Å; E1225-N1229 PolarHBondContact O-ND2 3.29Å; E1225-N1229 PolarHBondContact OE1-ND2 2.71Å
1226	K	93.8	Very high	88.4	Confident	132 Å²	132	75.5 Å²	75.5	57%	0.574	36%	0.355	S	S	*	.	H	α-helix	trans	-58.7	-51	174.3	-172.7	174.4	-174.9	-79.8	0	110.9	N1222 E1223 H1228 N1229 E1230	N1222-K1226 PolarHBondContact O-N 3.1Å; E1223-K1226 PolarHBondContact O-N 3.03Å; K1226-H1228 VanDerWaalsContact C-N 3.3Å; K1226-H1228 PolarHBondContact O-N 3.44Å; K1226-N1229 PolarHBondContact O-N 3.23Å; K1226-N1229 VanDerWaalsContact O-N 3.17Å; K1226-E1230 HydrophobicContact CG-CG 4.43Å; K1226-E1230 IonicContact NZ-OE1 3.35Å; K1226-E1230 PolarHBondContact NZ-OE1 3.22Å; K1226-E1230 WeakPolarHBondContact O-CB 3.18Å; K1226-E1230 VanDerWaalsContact O-CG 3.31Å; K1226-E1230 WeakPolarHBondContact O-CG 3.33Å; K1226-E1230 PolarHBondContact O-N 3.17Å
1227	K	92.4	Very high	86.5	Confident	94 Å²	94	75.7 Å²	75.7	41%	0.409	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-38.2	176.7	-76.5	170.1	168.3	173.2	0	113.2	F1054 E1223 L1224 F1231	F1054-K1227 HydrophobicContact CE1-CB 4.46Å; F1054-K1227 HydrophobicContact CZ-CB 4.34Å; E1223-K1227 WeakPolarHBondContact O-CG 3.36Å; E1223-K1227 PolarHBondContact O-N 3.43Å; E1223-K1227 VanDerWaalsContact OE1-CE 3.26Å; E1223-K1227 WeakPolarHBondContact OE1-CE 2.95Å; E1223-K1227 IonicContact OE1-NZ 3.88Å; E1223-K1227 PolarHBondContact OE1-NZ 3.19Å; L1224-K1227 PolarHBondContact O-N 3.26Å; K1227-F1231 WeakPolarHBondContact O-CB 3.44Å; K1227-F1231 PolarHBondContact O-N 3.24Å
1228	H	90.4	Very high	84.4	Confident	37 Å²	37	78.9 Å²	78.9	17%	0.171	38%	0.375	C	S	.	.	H	α-helix	trans	-66.2	-40.8	177.4	-176	63.6	0	0	0	112	F1054 C1058 L1224 E1225 K1226 F1231 K1232	F1054-H1228 HydrophobicContact CE2-CB 4.03Å; F1054-H1228 HydrophobicContact CZ-CB 4.09Å; C1058-H1228 PolarHBondContact SG-ND1 3.23Å; L1224-H1228 WeakPolarHBondContact O-CB 3.48Å; L1224-H1228 PolarHBondContact O-N 3.18Å; E1225-H1228 PolarHBondContact O-N 2.78Å; K1226-H1228 VanDerWaalsContact C-N 3.3Å; K1226-H1228 PolarHBondContact O-N 3.44Å; H1228-F1231 PolarHBondContact O-N 3.14Å; H1228-K1232 PolarHBondContact CD2-NZ 3.4Å; H1228-K1232 WeakPolarHBondContact NE2-CE 3.45Å; H1228-K1232 PolarHBondContact NE2-NZ 3.39Å; H1228-K1232 WeakPolarHBondContact O-CG 3.5Å; H1228-K1232 PolarHBondContact O-N 2.79Å
1229	N	90.5	Very high	81.9	Confident	56 Å²	56	77.9 Å²	77.9	30%	0.299	37%	0.37	S	S	.	.	H	α-helix	trans	-79.2	-36.5	179.8	-68	-52.5	0	0	0	113.2	E1225 K1226 F1231 K1232 Q1233	E1225-N1229 PolarHBondContact O-N 2.74Å; E1225-N1229 PolarHBondContact O-ND2 3.29Å; E1225-N1229 PolarHBondContact OE1-ND2 2.71Å; K1226-N1229 PolarHBondContact O-N 3.23Å; K1226-N1229 VanDerWaalsContact O-N 3.17Å; N1229-F1231 PolarHBondContact O-N 3.47Å; N1229-K1232 PolarHBondContact O-N 2.76Å; N1229-Q1233 WeakPolarHBondContact O-CB 3.13Å; N1229-Q1233 VanDerWaalsContact O-CG 3.28Å; N1229-Q1233 WeakPolarHBondContact O-CG 3.28Å; N1229-Q1233 PolarHBondContact O-N 3.11Å
1230	E	89.7	Confident	78.8	Confident	84 Å²	84	76.5 Å²	76.5	39%	0.393	37%	0.366	S	S	.	.	H	α-helix	trans	-54.3	-43.5	165.8	-74.3	170.7	169.5	0	0	110.8	K1226 Q1233 S1234	K1226-E1230 HydrophobicContact CG-CG 4.43Å; K1226-E1230 IonicContact NZ-OE1 3.35Å; K1226-E1230 PolarHBondContact NZ-OE1 3.22Å; K1226-E1230 WeakPolarHBondContact O-CB 3.18Å; K1226-E1230 VanDerWaalsContact O-CG 3.31Å; K1226-E1230 WeakPolarHBondContact O-CG 3.33Å; K1226-E1230 PolarHBondContact O-N 3.17Å; E1230-Q1233 PolarHBondContact O-N 3.03Å; E1230-S1234 WeakPolarHBondContact O-CB 3.36Å; E1230-S1234 PolarHBondContact O-N 3.22Å
1231	F	84.9	Confident	75.8	Confident	35 Å²	35	78 Å²	78	15%	0.154	38%	0.377	C	S	.	.	H	α-helix	trans	-66.5	-46.4	177.7	-166.3	-89.3	0	0	0	112.3	C1058 R1059 K1227 H1228 N1229 Q1233 S1234 M1235	C1058-F1231 VanDerWaalsContact C-CD1 3.44Å; C1058-F1231 VanDerWaalsContact C-CE1 3.42Å; C1058-F1231 HydrophobicContact CB-CB 4.25Å; C1058-F1231 HydrophobicContact CB-CD1 3.64Å; C1058-F1231 HydrophobicContact CB-CE1 4.28Å; C1058-F1231 HydrophobicContact CB-CG 3.89Å; C1058-F1231 WeakPolarHBondContact O-CD1 3.41Å; C1058-F1231 WeakPolarHBondContact O-CE1 3.46Å; R1059-F1231 HydrophobicContact CB-CE1 4.35Å; R1059-F1231 HydrophobicContact CB-CZ 4.36Å; R1059-F1231 HydrophobicContact CG-CE1 3.76Å; R1059-F1231 HydrophobicContact CG-CE2 4.13Å; R1059-F1231 HydrophobicContact CG-CZ 3.35Å; K1227-F1231 WeakPolarHBondContact O-CB 3.44Å; K1227-F1231 PolarHBondContact O-N 3.24Å; H1228-F1231 PolarHBondContact O-N 3.14Å; N1229-F1231 PolarHBondContact O-N 3.47Å; F1231-Q1233 VanDerWaalsContact C-N 3.34Å; F1231-Q1233 PolarHBondContact O-N 3.47Å; F1231-S1234 PolarHBondContact O-N 2.82Å; F1231-S1234 VanDerWaalsContact O-N 3.14Å; F1231-S1234 PolarHBondContact O-OG 2.9Å; F1231-M1235 HydrophobicContact CD1-CG 3.82Å; F1231-M1235 HydrophobicContact CE1-CG 3.22Å; F1231-M1235 HydrophobicContact CE1-SD 3.58Å; F1231-M1235 VanDerWaalsContact CE1-SD 3.58Å; F1231-M1235 HydrophobicContact CZ-CG 3.8Å; F1231-M1235 HydrophobicContact CZ-SD 3.66Å; F1231-M1235 WeakPolarHBondContact O-CG 3.25Å; F1231-M1235 PolarHBondContact O-N 3.39Å
1232	K	81.5	Confident	73	Confident	97 Å²	97	77.5 Å²	77.5	42%	0.422	38%	0.38	S	S	.	.	H	α-helix	trans	-56	-44.1	174	-80.3	167.1	160.9	165.6	0	112.6	H1228 N1229 M1235 N1236	H1228-K1232 PolarHBondContact CD2-NZ 3.4Å; H1228-K1232 WeakPolarHBondContact NE2-CE 3.45Å; H1228-K1232 PolarHBondContact NE2-NZ 3.39Å; H1228-K1232 WeakPolarHBondContact O-CG 3.5Å; H1228-K1232 PolarHBondContact O-N 2.79Å; N1229-K1232 PolarHBondContact O-N 2.76Å; K1232-M1235 PolarHBondContact O-N 2.93Å; K1232-N1236 VanDerWaalsContact O-CG 3.29Å; K1232-N1236 PolarHBondContact O-N 3.23Å; K1232-N1236 VanDerWaalsContact O-N 3.12Å; K1232-N1236 PolarHBondContact O-ND2 3.48Å
1233	Q	80.4	Confident	70	Confident	115 Å²	115	77 Å²	77	54%	0.537	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-48.6	174.2	-72.1	166.4	-2.8	0	0	110.5	N1229 E1230 F1231 M1235 N1236 E1237	N1229-Q1233 WeakPolarHBondContact O-CB 3.13Å; N1229-Q1233 VanDerWaalsContact O-CG 3.28Å; N1229-Q1233 WeakPolarHBondContact O-CG 3.28Å; N1229-Q1233 PolarHBondContact O-N 3.11Å; E1230-Q1233 PolarHBondContact O-N 3.03Å; F1231-Q1233 VanDerWaalsContact C-N 3.34Å; F1231-Q1233 PolarHBondContact O-N 3.47Å; Q1233-M1235 VanDerWaalsContact C-N 3.28Å; Q1233-M1235 PolarHBondContact O-N 3.35Å; Q1233-N1236 PolarHBondContact O-N 2.85Å; Q1233-N1236 VanDerWaalsContact O-N 3.12Å; Q1233-E1237 PolarHBondContact O-N 2.83Å
1234	S	77.7	Confident	67	Low	42 Å²	42	80.8 Å²	80.8	29%	0.294	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-32.6	178.8	80.3	0	0	0	0	113.9	E1230 F1231 K1238	E1230-S1234 WeakPolarHBondContact O-CB 3.36Å; E1230-S1234 PolarHBondContact O-N 3.22Å; F1231-S1234 PolarHBondContact O-N 2.82Å; F1231-S1234 VanDerWaalsContact O-N 3.14Å; F1231-S1234 PolarHBondContact O-OG 2.9Å; S1234-K1238 WeakPolarHBondContact O-CB 3.45Å; S1234-K1238 WeakPolarHBondContact O-CG 3.34Å; S1234-K1238 PolarHBondContact O-N 2.84Å
1235	M	69.1	Low	64.1	Low	83 Å²	83	85.5 Å²	85.5	41%	0.409	41%	0.414	S	S	.	.	H	α-helix	trans	-69.2	-42.9	174	-71.4	-71.1	-74.6	0	0	112	F1231 K1232 Q1233 E1237 K1238 N1239	F1231-M1235 HydrophobicContact CD1-CG 3.82Å; F1231-M1235 HydrophobicContact CE1-CG 3.22Å; F1231-M1235 HydrophobicContact CE1-SD 3.58Å; F1231-M1235 VanDerWaalsContact CE1-SD 3.58Å; F1231-M1235 HydrophobicContact CZ-CG 3.8Å; F1231-M1235 HydrophobicContact CZ-SD 3.66Å; F1231-M1235 WeakPolarHBondContact O-CG 3.25Å; F1231-M1235 PolarHBondContact O-N 3.39Å; K1232-M1235 PolarHBondContact O-N 2.93Å; Q1233-M1235 VanDerWaalsContact C-N 3.28Å; Q1233-M1235 PolarHBondContact O-N 3.35Å; M1235-E1237 VanDerWaalsContact C-N 3.34Å; M1235-K1238 PolarHBondContact O-N 2.93Å; M1235-N1239 PolarHBondContact O-N 3.38Å; M1235-N1239 VanDerWaalsContact O-N 3.16Å
1236	N	61.6	Low	61.5	Low	113 Å²	113	90.2 Å²	90.2	60%	0.604	43%	0.434	S	S	*	.	H	α-helix	trans	-65.6	-36.7	177.4	-66.1	-16.7	0	0	0	111.9	K1232 Q1233	K1232-N1236 VanDerWaalsContact O-CG 3.29Å; K1232-N1236 PolarHBondContact O-N 3.23Å; K1232-N1236 VanDerWaalsContact O-N 3.12Å; K1232-N1236 PolarHBondContact O-ND2 3.48Å; Q1233-N1236 PolarHBondContact O-N 2.85Å; Q1233-N1236 VanDerWaalsContact O-N 3.12Å
1237	E	53	Low	58.9	Low	111 Å²	111	90.5 Å²	90.5	52%	0.519	44%	0.435	S	S	.	.	H	α-helix	trans	-77.1	-33.7	176.1	-70.1	178.7	-166.2	0	0	113.1	Q1233 M1235 N1239 L1243	Q1233-E1237 PolarHBondContact O-N 2.83Å; M1235-E1237 VanDerWaalsContact C-N 3.34Å; E1237-N1239 VanDerWaalsContact C-N 3.29Å; E1237-N1239 PolarHBondContact O-N 3.01Å; E1237-L1243 VanDerWaalsContact O-CD1 3.28Å; E1237-L1243 WeakPolarHBondContact O-CD1 3.41Å
1238	K	51.5	Low	56.3	Low	109 Å²	109	91.7 Å²	91.7	47%	0.474	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	12.6	176.2	-71.7	-164.4	164.7	-146.5	0	114.2	S1234 M1235 P1240 E1268	S1234-K1238 WeakPolarHBondContact O-CB 3.45Å; S1234-K1238 WeakPolarHBondContact O-CG 3.34Å; S1234-K1238 PolarHBondContact O-N 2.84Å; M1235-K1238 PolarHBondContact O-N 2.93Å; K1238-P1240 WeakPolarHBondContact O-CD 3.46Å; K1238-E1268 IonicContact NZ-OE1 2.69Å; K1238-E1268 IonicContact NZ-OE2 3.27Å; K1238-E1268 PolarHBondContact NZ-OE2 2.75Å
1239	N	39.5	Very low	53.8	Low	67 Å²	67	96.7 Å²	96.7	36%	0.358	47%	0.473	S	S	.	.			trans	-97.2	94.9	170.2	-149.1	19.2	0	0	0	109.8	M1235 E1237 I1241 D1242	M1235-N1239 PolarHBondContact O-N 3.38Å; M1235-N1239 VanDerWaalsContact O-N 3.16Å; E1237-N1239 VanDerWaalsContact C-N 3.29Å; E1237-N1239 PolarHBondContact O-N 3.01Å; N1239-I1241 PolarHBondContact O-N 3.33Å; N1239-D1242 WeakPolarHBondContact CB-OD2 3.43Å; N1239-D1242 PolarHBondContact ND2-OD2 3.19Å; N1239-D1242 PolarHBondContact O-N 2.9Å
1240	P	29.8	Very low	51.2	Low	54 Å²	54	100.8 Å²	100.8	35%	0.351	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	48.5	-178.7	36	-40.4	0	0	0	111.8	K1238 K1276	K1238-P1240 WeakPolarHBondContact O-CD 3.46Å; P1240-K1276 PolarHBondContact O-NZ 3.4Å
1241	I	33.4	Very low	48.5	Very low	95 Å²	95	103.2 Å²	103.2	49%	0.487	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-61.5	176.3	-61.8	176.6	0	0	0	106.3	N1239 L1243 Y1244 D1245	N1239-I1241 PolarHBondContact O-N 3.33Å; I1241-L1243 PolarHBondContact O-N 2.88Å; I1241-L1243 VanDerWaalsContact O-N 3.1Å; I1241-Y1244 PolarHBondContact O-N 3.28Å; I1241-D1245 PolarHBondContact O-N 3.26Å
1242	D	35.8	Very low	46	Very low	63 Å²	63	110.4 Å²	110.4	34%	0.337	54%	0.542	S	S	.	.	H	α-helix	trans	-56.8	-30.7	176.5	-63.9	-70.3	0	0	0	113.8	N1239 Y1244 K1246	N1239-D1242 WeakPolarHBondContact CB-OD2 3.43Å; N1239-D1242 PolarHBondContact ND2-OD2 3.19Å; N1239-D1242 PolarHBondContact O-N 2.9Å; D1242-Y1244 VanDerWaalsContact C-N 3.32Å; D1242-Y1244 PolarHBondContact O-N 3.16Å; D1242-K1246 WeakPolarHBondContact O-CB 3.21Å; D1242-K1246 PolarHBondContact O-N 3.17Å; D1242-K1246 VanDerWaalsContact O-N 3.08Å
1243	L	33.1	Very low	43.7	Very low	80 Å²	80	112.5 Å²	112.5	42%	0.419	56%	0.558	S	S	.	*	H	α-helix	trans	-76.6	-12.7	179.6	-110.5	155.3	0	0	0	114.4	E1237 I1241	E1237-L1243 VanDerWaalsContact O-CD1 3.28Å; E1237-L1243 WeakPolarHBondContact O-CD1 3.41Å; I1241-L1243 PolarHBondContact O-N 2.88Å; I1241-L1243 VanDerWaalsContact O-N 3.1Å
1244	Y	31.3	Very low	41.5	Very low	165 Å²	165	114.9 Å²	114.9	65%	0.647	57%	0.574	S	S	*	*	H	α-helix	trans	-86.9	-51.3	167.8	-92.3	-88.3	0	0	0	110.4	I1241 D1242 K1246 K1247 N1248	I1241-Y1244 PolarHBondContact O-N 3.28Å; D1242-Y1244 VanDerWaalsContact C-N 3.32Å; D1242-Y1244 PolarHBondContact O-N 3.16Å; Y1244-K1246 VanDerWaalsContact C-N 3.33Å; Y1244-K1246 PolarHBondContact O-N 3.47Å; Y1244-K1247 PolarHBondContact O-N 3.31Å; Y1244-K1247 VanDerWaalsContact O-N 3.11Å; Y1244-N1248 PolarHBondContact O-N 3.47Å
1245	D	34.5	Very low	39.4	Very low	105 Å²	105	119.7 Å²	119.7	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-61.4	-38.6	-177.5	-67.4	-23.9	0	0	0	112.7	I1241 K1247	I1241-D1245 PolarHBondContact O-N 3.26Å; D1245-K1247 VanDerWaalsContact C-N 3.35Å; D1245-K1247 PolarHBondContact O-N 3.25Å
1246	K	38.3	Very low	37.7	Very low	158 Å²	158	123 Å²	123	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-74.4	-18.6	177.7	-75.4	179.1	175.9	171	0	114.7	D1242 Y1244	D1242-K1246 WeakPolarHBondContact O-CB 3.21Å; D1242-K1246 PolarHBondContact O-N 3.17Å; D1242-K1246 VanDerWaalsContact O-N 3.08Å; Y1244-K1246 VanDerWaalsContact C-N 3.33Å; Y1244-K1246 PolarHBondContact O-N 3.47Å
1247	K	39.5	Very low	36.5	Very low	138 Å²	138	126.5 Å²	126.5	60%	0.6	63%	0.634	S	S	*	*	H	α-helix	trans	-91.2	-27.1	178.7	-77.2	-163.1	168.9	-159.6	0	113.6	Y1244 D1245 N1249	Y1244-K1247 PolarHBondContact O-N 3.31Å; Y1244-K1247 VanDerWaalsContact O-N 3.11Å; D1245-K1247 VanDerWaalsContact C-N 3.35Å; D1245-K1247 PolarHBondContact O-N 3.25Å; K1247-N1249 VanDerWaalsContact C-N 3.27Å; K1247-N1249 PolarHBondContact O-N 3.43Å
1248	N	37.5	Very low	35.6	Very low	118 Å²	118	126.7 Å²	126.7	63%	0.631	64%	0.639	S	S	*	*	H	α-helix	trans	-70.9	-19.8	177.3	-75.9	-9.8	0	0	0	113.9	Y1244	Y1244-N1248 PolarHBondContact O-N 3.47Å
1249	N	38.3	Very low	35	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	65%	0.654	S	S	*	*	H	α-helix	trans	-95.8	-22.3	177.6	-73.5	-29.7	0	0	0	114.7	K1247	K1247-N1249 VanDerWaalsContact C-N 3.27Å; K1247-N1249 PolarHBondContact O-N 3.43Å
1250	N	34.9	Very low	35.1	Very low	142 Å²	142	134.8 Å²	134.8	76%	0.759	68%	0.677	S	S	*	*	S	Bend	trans	-117.5	71	-178	-77.1	4.9	0	0	0	110.5
1251	N	32.6	Very low	35.4	Very low	135 Å²	135	136.9 Å²	136.9	72%	0.722	68%	0.681	S	S	*	*			trans	-115.8	82.8	-174.9	-135	0.6	0	0	0	111.2
1252	K	32.2	Very low	35.7	Very low	186 Å²	186	136.8 Å²	136.8	81%	0.809	68%	0.681	S	S	*	*			trans	-167.8	147.5	147.6	-105	158.8	-172.1	-177.1	0	111
1253	D	34.6	Very low	35.8	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	69%	0.694	S	S	*	*	S	Bend	trans	70.1	147.8	166.4	-45.8	-33.5	0	0	0	119.3
1254	N	34.3	Very low	35.9	Very low	165 Å²	165	140 Å²	140	88%	0.882	70%	0.697	S	S	*	*			trans	62.9	67.9	174.8	-63.7	-35.2	0	0	0	118.6
1255	V	32.3	Very low	36.4	Very low	143 Å²	143	138.2 Å²	138.2	87%	0.867	69%	0.692	S	S	*	*			trans	-97.9	96	157.6	178.7	0	0	0	0	109.9
1256	N	33.9	Very low	36.7	Very low	152 Å²	152	140.4 Å²	140.4	81%	0.813	70%	0.697	S	S	*	*			trans	-162.4	64.2	165.8	-120.4	-18.5	0	0	0	115
1257	Q	36.3	Very low	36.9	Very low	188 Å²	188	140 Å²	140	88%	0.879	70%	0.701	S	S	*	*			trans	-172.1	164.2	160.4	-107.1	154.7	60.5	0	0	111.4
1258	N	34.8	Very low	37.2	Very low	115 Å²	115	137.5 Å²	137.5	62%	0.615	69%	0.692	S	S	*	*			trans	89.3	53	172.9	-59.3	-38.6	0	0	0	120.5	K1260	N1258-K1260 PolarHBondContact O-N 3.37Å
1259	N	38.3	Very low	37.4	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-61.6	-7.1	160.8	-77.9	-14.7	0	0	0	114.7	F1261	N1259-F1261 VanDerWaalsContact C-N 3.34Å; N1259-F1261 PolarHBondContact O-N 3.04Å
1260	K	41.8	Very low	37.5	Very low	197 Å²	197	133.1 Å²	133.1	86%	0.857	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-82.7	-2.9	-175.6	-141.5	171.4	-172.9	175.3	0	114.9	N1258	N1258-K1260 PolarHBondContact O-N 3.37Å
1261	F	35.7	Very low	37.9	Very low	99 Å²	99	135.2 Å²	135.2	43%	0.434	67%	0.67	S	S	.	*	G	3₁₀ helix	trans	-99.2	-1.1	-175.3	-107.7	-85.5	0	0	0	115	N1259 M1264	N1259-F1261 VanDerWaalsContact C-N 3.34Å; N1259-F1261 PolarHBondContact O-N 3.04Å; F1261-M1264 HydrophobicContact CD1-CE 4.38Å; F1261-M1264 HydrophobicContact CE1-CE 4.23Å
1262	I	40.2	Very low	38.5	Very low	93 Å²	93	132 Å²	132	48%	0.477	65%	0.652	S	S	.	*	S	Bend	trans	-86.1	-38	-168.9	-63.2	177.6	0	0	0	112.4	M1264 K1265	I1262-M1264 PolarHBondContact O-N 2.98Å; I1262-K1265 WeakPolarHBondContact O-CB 3.32Å; I1262-K1265 PolarHBondContact O-N 2.75Å
1263	D	37.3	Very low	38.9	Very low	113 Å²	113	125.9 Å²	125.9	60%	0.604	63%	0.63	S	S	*	*	H	α-helix	trans	-71.4	-32.6	-173.7	-64.9	-51.4	0	0	0	114.1	K1265 K1266	D1263-K1265 PolarHBondContact O-N 3.12Å; D1263-K1266 PolarHBondContact O-N 3.1Å; D1263-K1266 VanDerWaalsContact O-N 3.08Å
1264	M	35.5	Very low	39.3	Very low	98 Å²	98	125.6 Å²	125.6	48%	0.483	62%	0.622	S	S	.	*	H	α-helix	trans	-57.7	-30	169.6	-82.9	-159.9	-67.6	0	0	112.3	F1261 I1262 K1266	F1261-M1264 HydrophobicContact CD1-CE 4.38Å; F1261-M1264 HydrophobicContact CE1-CE 4.23Å; I1262-M1264 PolarHBondContact O-N 2.98Å; M1264-K1266 VanDerWaalsContact C-N 3.33Å; M1264-K1266 PolarHBondContact O-N 3.02Å
1265	K	40.8	Very low	39.8	Very low	127 Å²	127	121.4 Å²	121.4	55%	0.552	60%	0.599	S	S	*	*	H	α-helix	trans	-71.8	-24.6	178.8	-65.9	-174.7	176.4	-177.4	0	112.9	I1262 D1263 L1269	I1262-K1265 WeakPolarHBondContact O-CB 3.32Å; I1262-K1265 PolarHBondContact O-N 2.75Å; D1263-K1265 PolarHBondContact O-N 3.12Å; K1265-L1269 HydrophobicContact CB-CD1 4.06Å; K1265-L1269 HydrophobicContact CB-CD2 4.47Å; K1265-L1269 HydrophobicContact CG-CD1 4.25Å; K1265-L1269 WeakPolarHBondContact O-CB 3.47Å; K1265-L1269 PolarHBondContact O-N 2.73Å
1266	K	41.4	Very low	40	Very low	151 Å²	151	118.1 Å²	118.1	66%	0.657	57%	0.573	S	S	*	*	H	α-helix	trans	-75	-32.6	-177.3	-79	-177.2	174.4	174.7	0	114	D1263 M1264	D1263-K1266 PolarHBondContact O-N 3.1Å; D1263-K1266 VanDerWaalsContact O-N 3.08Å; M1264-K1266 VanDerWaalsContact C-N 3.33Å; M1264-K1266 PolarHBondContact O-N 3.02Å
1267	L	43.7	Very low	40.6	Very low	149 Å²	149	117 Å²	117	78%	0.78	56%	0.563	S	S	*	*	H	α-helix	trans	-89.5	-37.1	-178.7	-95.1	72.2	0	0	0	114.2
1268	E	44.3	Very low	40.9	Very low	86 Å²	86	113.5 Å²	113.5	40%	0.402	55%	0.55	S	S	.	.	H	α-helix	trans	-92.4	-28.8	-173.6	-63.2	-167.8	144.1	0	0	113.9	K1238 R1271 I1272	K1238-E1268 IonicContact NZ-OE1 2.69Å; K1238-E1268 IonicContact NZ-OE2 3.27Å; K1238-E1268 PolarHBondContact NZ-OE2 2.75Å; E1268-R1271 PolarHBondContact O-N 2.78Å; E1268-I1272 HydrophobicContact CB-CD1 3.86Å; E1268-I1272 WeakPolarHBondContact O-CG1 3.44Å; E1268-I1272 PolarHBondContact O-N 3.43Å
1269	L	43	Very low	40.9	Very low	81 Å²	81	115.3 Å²	115.3	42%	0.424	55%	0.549	S	S	.	.	H	α-helix	trans	-59.5	-42.2	-178.9	-98	60.9	0	0	0	114.5	K1265 R1271 I1272 T1273	K1265-L1269 HydrophobicContact CB-CD1 4.06Å; K1265-L1269 HydrophobicContact CB-CD2 4.47Å; K1265-L1269 HydrophobicContact CG-CD1 4.25Å; K1265-L1269 WeakPolarHBondContact O-CB 3.47Å; K1265-L1269 PolarHBondContact O-N 2.73Å; L1269-R1271 PolarHBondContact O-N 3.5Å; L1269-R1271 VanDerWaalsContact O-N 3.16Å; L1269-I1272 PolarHBondContact O-N 3.18Å; L1269-T1273 WeakPolarHBondContact O-CA 3.19Å; L1269-T1273 WeakPolarHBondContact O-CB 3.33Å; L1269-T1273 PolarHBondContact O-N 3.48Å; L1269-T1273 PolarHBondContact O-OG1 3.02Å
1270	P	39.9	Very low	40.8	Very low	86 Å²	86	112.6 Å²	112.6	56%	0.558	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-25	-179	-26.5	36.2	0	0	0	113.8	K1274	P1270-K1274 WeakPolarHBondContact O-CB 3.29Å
1271	R	42.9	Very low	40.7	Very low	186 Å²	186	108.4 Å²	108.4	70%	0.702	52%	0.518	S	S	*	.	H	α-helix	trans	-87.7	-45.6	172.5	-72.3	-178.2	171.3	-167.5	-5.6	111.9	E1268 L1269 K1274 I1275	E1268-R1271 PolarHBondContact O-N 2.78Å; L1269-R1271 PolarHBondContact O-N 3.5Å; L1269-R1271 VanDerWaalsContact O-N 3.16Å; R1271-K1274 PolarHBondContact O-N 3.21Å; R1271-I1275 WeakPolarHBondContact O-CB 3.33Å; R1271-I1275 VanDerWaalsContact O-CG1 3.28Å; R1271-I1275 WeakPolarHBondContact O-CG1 3.35Å; R1271-I1275 PolarHBondContact O-N 3.48Å
1272	I	44.5	Very low	41	Very low	67 Å²	67	108.8 Å²	108.8	34%	0.344	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-39.2	-178.8	-67.1	173.2	0	0	0	111.8	E1268 L1269 I1275 K1276	E1268-I1272 HydrophobicContact CB-CD1 3.86Å; E1268-I1272 WeakPolarHBondContact O-CG1 3.44Å; E1268-I1272 PolarHBondContact O-N 3.43Å; L1269-I1272 PolarHBondContact O-N 3.18Å; I1272-I1275 PolarHBondContact O-N 3.34Å; I1272-K1276 PolarHBondContact O-N 3.45Å
1273	T	41.1	Very low	41.1	Very low	59 Å²	59	109.7 Å²	109.7	36%	0.362	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-45	176.5	-49.1	0	0	0	0	110	L1269 I1275 K1276 E1277	L1269-T1273 WeakPolarHBondContact O-CA 3.19Å; L1269-T1273 WeakPolarHBondContact O-CB 3.33Å; L1269-T1273 PolarHBondContact O-N 3.48Å; L1269-T1273 PolarHBondContact O-OG1 3.02Å; T1273-I1275 VanDerWaalsContact C-N 3.28Å; T1273-I1275 PolarHBondContact O-N 3.43Å; T1273-K1276 CarbonylContact O-C 3.6Å; T1273-K1276 WeakPolarHBondContact O-CA 2.96Å; T1273-K1276 WeakPolarHBondContact O-CB 3.44Å; T1273-K1276 PolarHBondContact O-N 3.44Å; T1273-E1277 VanDerWaalsContact O-CG 3.32Å; T1273-E1277 WeakPolarHBondContact O-CG 3.41Å; T1273-E1277 PolarHBondContact O-N 3.24Å
1274	K	42.6	Very low	41.3	Very low	135 Å²	135	109.5 Å²	109.5	59%	0.587	52%	0.52	S	S	*	.	H	α-helix	trans	-66	-27.9	175.7	-161.7	166.6	-167.4	167.1	0	113.8	P1270 R1271 L1278	P1270-K1274 WeakPolarHBondContact O-CB 3.29Å; R1271-K1274 PolarHBondContact O-N 3.21Å; K1274-L1278 WeakPolarHBondContact O-CD1 3.38Å; K1274-L1278 VanDerWaalsContact O-CG 3.25Å; K1274-L1278 WeakPolarHBondContact O-CG 3.43Å; K1274-L1278 PolarHBondContact O-N 2.95Å
1275	I	45.5	Very low	41.6	Very low	77 Å²	77	110.3 Å²	110.3	40%	0.395	52%	0.523	S	S	.	.	H	α-helix	trans	-72.6	-39.9	168.6	-71.5	166	0	0	0	110.7	R1271 I1272 T1273 L1278 Y1279	R1271-I1275 WeakPolarHBondContact O-CB 3.33Å; R1271-I1275 VanDerWaalsContact O-CG1 3.28Å; R1271-I1275 WeakPolarHBondContact O-CG1 3.35Å; R1271-I1275 PolarHBondContact O-N 3.48Å; I1272-I1275 PolarHBondContact O-N 3.34Å; T1273-I1275 VanDerWaalsContact C-N 3.28Å; T1273-I1275 PolarHBondContact O-N 3.43Å; I1275-L1278 CarbonylContact O-C 3.52Å; I1275-L1278 PolarHBondContact O-N 2.91Å; I1275-L1278 VanDerWaalsContact O-N 3.16Å; I1275-Y1279 WeakPolarHBondContact O-CB 3.3Å; I1275-Y1279 PolarHBondContact O-N 3.33Å
1276	K	37.5	Very low	41.7	Very low	74 Å²	74	109.1 Å²	109.1	32%	0.322	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-41.3	172.9	-77.1	-172	171.4	-165.5	0	112.3	P1240 I1272 T1273 L1278 Y1279 N1280	P1240-K1276 PolarHBondContact O-NZ 3.4Å; I1272-K1276 PolarHBondContact O-N 3.45Å; T1273-K1276 CarbonylContact O-C 3.6Å; T1273-K1276 WeakPolarHBondContact O-CA 2.96Å; T1273-K1276 WeakPolarHBondContact O-CB 3.44Å; T1273-K1276 PolarHBondContact O-N 3.44Å; K1276-L1278 PolarHBondContact O-N 3.29Å; K1276-Y1279 PolarHBondContact O-N 3.06Å; K1276-N1280 WeakPolarHBondContact O-CB 3.43Å; K1276-N1280 PolarHBondContact O-N 2.9Å
1277	E	45.4	Very low	41.7	Very low	128 Å²	128	106.1 Å²	106.1	60%	0.598	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.7	172.6	-70.1	164.6	-174.4	0	0	113.8	T1273	T1273-E1277 VanDerWaalsContact O-CG 3.32Å; T1273-E1277 WeakPolarHBondContact O-CG 3.41Å; T1273-E1277 PolarHBondContact O-N 3.24Å
1278	L	43.4	Very low	41.6	Very low	114 Å²	114	102.8 Å²	102.8	60%	0.597	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	6.1	175.6	-67.2	172.2	0	0	0	112.6	A928 K1274 I1275 K1276	A928-L1278 HydrophobicContact CB-CD1 3.78Å; K1274-L1278 WeakPolarHBondContact O-CD1 3.38Å; K1274-L1278 VanDerWaalsContact O-CG 3.25Å; K1274-L1278 WeakPolarHBondContact O-CG 3.43Å; K1274-L1278 PolarHBondContact O-N 2.95Å; I1275-L1278 CarbonylContact O-C 3.52Å; I1275-L1278 PolarHBondContact O-N 2.91Å; I1275-L1278 VanDerWaalsContact O-N 3.16Å; K1276-L1278 PolarHBondContact O-N 3.29Å
1279	Y	33.9	Very low	41.3	Very low	154 Å²	154	104.3 Å²	104.3	60%	0.604	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-26.7	-178.7	-167.6	-93.6	0	0	0	112.5	I1275 K1276	I1275-Y1279 WeakPolarHBondContact O-CB 3.3Å; I1275-Y1279 PolarHBondContact O-N 3.33Å; K1276-Y1279 PolarHBondContact O-N 3.06Å
1280	N	36.4	Very low	41.2	Very low	90 Å²	90	106.4 Å²	106.4	48%	0.481	51%	0.505	S	S	.	.			trans	-79.2	0	163.4	-65.9	3.8	0	0	0	110.9	L904 K1276	L904-N1280 VanDerWaalsContact CB-O 3.3Å; L904-N1280 WeakPolarHBondContact CB-O 3.31Å; K1276-N1280 WeakPolarHBondContact O-CB 3.43Å; K1276-N1280 PolarHBondContact O-N 2.9Å

Retrieved 1,280 of 1,280 residues in 456.6 ms (Link to these results)

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