A0A5K4F1R3_SCHMA Loading...

Eyes absent homolog

AlphaFold DB , UniProt , Accession A0A5K4F1R3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 839 aa.

						>A0A5K4F1R3_SCHMA|A0A5K4F1R3
MSTIIQENDDHFTNEPSTKRTKYLFETSSSNNGEGFNLNTSFNSLIEENFTKLHSTNILSSYLGTDNASINNMNSSDLNIPQCDHGNEFSHSKPHLSSCHLSSTNIHSVSSHSNLDSYSLNKPPTSQQQLQQYPHYQHSEQLENLCAEMSNPTSDKLLHVLSTSSSTSSFTHRNDLNFPGISGDISKTSELSAATSTCSNLQQFISNGNYNTTTSNNRSLLLLNNGSLNNSSNHLSINEESIVNTPSIFCQYQSLITTTTTTNTTTTTTAKKAFTTISNVTTRSDNEIELMNSKGCNMDLMPNLTESNENNHNSPKFINNTLNLLEIPTSSYPITTNHMKDSYLPSMFIHDNVLSENNQCTTNEEQSWIISDNNNNNQNYLSSQIQNDDHQVYFPYNGHHSQYQQNTYKHDDIYPNNLINYSKNTLQQEKEEEEQISSSTLLSNLYNNNDGYLHTKVMNSMRLHSINEALHGSNQQQQQHQQHPHSQHQQLNVNYKGLEKSDDKFTRIFIWDLDETLIIFHTLLTGYYAHRYGKDPAVAGTYGLRMEELIYNLADTYLFFNELEECDQVHIDDIRGDDNYQDLMNFRSDPEAYGDNSSTITQSIILSSSSTSSSSTTITTTVHAPTTSSLETSSPINGSMLSPPPISSLSSAAPLTNMIGEIPTRVNTPTLHGSMEWMRKLGFRYRRIREIYNYSRYNVSVLLGYPKANQWINLKNNLDILTDHWLSMAMKATEKINNREDSVNILVTTTQFIPSLAKILLYGYGNSFQIENIYSATKVGKENCFERIASRFGRKCTYVVIGDGKEEEDAAKQFNWPFWRINAHSDLNALNHALDLGYL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	33.9	Very low	243 Å²	243	151.9 Å²	151.9	100%	1.197	79%	0.793	S	S	*	*				0	133.8	0	-72.1	169.3	168	0	0	106.4
2	S	26.7	Very low	33.9	Very low	119 Å²	119	156.9 Å²	156.9	83%	0.832	80%	0.804	S	S	*	*			trans	-120.8	123.1	-179.4	-51.3	0	0	0	0	108.3
3	T	37.2	Very low	34.2	Very low	128 Å²	128	153.5 Å²	153.5	79%	0.785	80%	0.796	S	S	*	*			trans	-122.7	105.5	170.8	-55.6	0	0	0	0	106.5	I5	T3-I5 HydrophobicContact CG2-CG1 4.49Å
4	I	34.4	Very low	34.1	Very low	145 Å²	145	154.6 Å²	154.6	74%	0.744	80%	0.803	S	S	*	*			trans	-74.8	125.9	172.4	-63.7	166.8	0	0	0	106.7	Q6	I4-Q6 HydrophobicContact CG2-CG 4.14Å
5	I	39.8	Very low	34	Very low	134 Å²	134	153.3 Å²	153.3	69%	0.687	79%	0.792	S	S	*	*			trans	-111.5	105.6	162	-61.9	179.4	0	0	0	105.6	T3 E7	T3-I5 HydrophobicContact CG2-CG1 4.49Å; I5-E7 HydrophobicContact CG2-CG 3.96Å
6	Q	30.7	Very low	34.1	Very low	158 Å²	158	149.7 Å²	149.7	74%	0.738	78%	0.781	S	S	*	*			trans	-85.9	120.3	156.6	-73.2	176.6	-110	0	0	106.3	I4	I4-Q6 HydrophobicContact CG2-CG 4.14Å
7	E	36.8	Very low	34.1	Very low	180 Å²	180	147.2 Å²	147.2	84%	0.841	78%	0.779	S	S	*	*			trans	-117	134.5	154.5	-74.3	-175.1	148.1	0	0	107.2	I5	I5-E7 HydrophobicContact CG2-CG 3.96Å
8	N	34.3	Very low	34.1	Very low	116 Å²	116	144.4 Å²	144.4	62%	0.62	77%	0.769	S	S	*	*			trans	-102.3	147.9	-171.9	-76	8.8	0	0	0	110
9	D	32.7	Very low	34.2	Very low	133 Å²	133	143.6 Å²	143.6	71%	0.711	76%	0.758	S	S	*	*			trans	56.9	123.3	141.8	-49.7	-25.2	0	0	0	121
10	D	30.5	Very low	34.1	Very low	149 Å²	149	149.1 Å²	149.1	80%	0.797	77%	0.768	S	S	*	*			trans	78.3	145.5	142.8	-65	-26.1	0	0	0	122.9
11	H	32.6	Very low	34	Very low	166 Å²	166	146.2 Å²	146.2	77%	0.769	76%	0.757	S	S	*	*			trans	55.6	89.4	168.9	-80.4	-76.7	0	0	0	118.6
12	F	34.1	Very low	33.8	Very low	212 Å²	212	142.2 Å²	142.2	93%	0.93	73%	0.733	S	S	*	*			trans	-134.6	144.7	130.3	-109.4	-79.6	0	0	0	112.1
13	T	38	Very low	34	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.693	73%	0.729	S	S	*	*			trans	-103.2	155.5	-170.7	49.3	0	0	0	0	112.7	E15	T13-E15 PolarHBondContact O-N 2.83Å
14	N	32.1	Very low	33.6	Very low	168 Å²	168	146.2 Å²	146.2	90%	0.898	73%	0.727	S	S	*	*			trans	-44.8	118.9	178.1	-54.9	-3	0	0	0	114
15	E	33.4	Very low	33.4	Very low	136 Å²	136	147.8 Å²	147.8	64%	0.636	73%	0.729	S	S	*	*			trans	-124.6	127.4	149.9	-144.6	-161	-155.7	0	0	106.9	T13 S17 K19	T13-E15 PolarHBondContact O-N 2.83Å; E15-S17 PolarHBondContact O-N 3.1Å; E15-K19 IonicContact OE1-NZ 3.81Å; E15-K19 PolarHBondContact OE1-NZ 3.08Å; E15-K19 IonicContact OE2-NZ 3.84Å; E15-K19 PolarHBondContact OE2-NZ 3.38Å
16	P	35.5	Very low	32.9	Very low	95 Å²	95	149.7 Å²	149.7	62%	0.617	74%	0.735	S	S	*	*			trans	-69.2	121.6	173.9	27.9	-32.9	0	0	0	109.4	T18	P16-T18 PolarHBondContact O-N 3.29Å
17	S	33.4	Very low	32.9	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	74%	0.737	S	S	*	*			trans	-80.3	46.6	-165.4	49.5	0	0	0	0	115	E15 K19	E15-S17 PolarHBondContact O-N 3.1Å; S17-K19 PolarHBondContact O-N 3.03Å
18	T	33.7	Very low	32.6	Very low	96 Å²	96	144.7 Å²	144.7	59%	0.589	73%	0.731	S	S	*	*			trans	-74.2	50.3	172.5	-36.9	0	0	0	0	111.9	P16	P16-T18 PolarHBondContact O-N 3.29Å
19	K	37.1	Very low	32.3	Very low	129 Å²	129	144.3 Å²	144.3	56%	0.561	74%	0.738	S	S	*	*			trans	-133.7	98	178.8	-72.9	174.3	-167.8	150.8	0	110.5	E15 S17 T21	E15-K19 IonicContact OE1-NZ 3.81Å; E15-K19 PolarHBondContact OE1-NZ 3.08Å; E15-K19 IonicContact OE2-NZ 3.84Å; E15-K19 PolarHBondContact OE2-NZ 3.38Å; S17-K19 PolarHBondContact O-N 3.03Å; K19-T21 VanDerWaalsContact C-N 3.34Å; K19-T21 PolarHBondContact O-N 3.09Å; K19-T21 PolarHBondContact O-OG1 3.35Å
20	R	32.4	Very low	32.2	Very low	253 Å²	253	143.1 Å²	143.1	96%	0.955	74%	0.74	S	S	*	*			trans	-55.6	82.2	177.5	-172.5	-175	-169.3	176.3	6.3	112.6	K22	R20-K22 PolarHBondContact O-N 3.08Å
21	T	32.1	Very low	32.3	Very low	90 Å²	90	143.7 Å²	143.7	55%	0.552	74%	0.743	S	S	*	*			trans	-91.1	103.4	-173.4	-54.2	0	0	0	0	110.9	K19 Y23	K19-T21 VanDerWaalsContact C-N 3.34Å; K19-T21 PolarHBondContact O-N 3.09Å; K19-T21 PolarHBondContact O-OG1 3.35Å; T21-Y23 HydrophobicContact CG2-CD2 3.74Å; T21-Y23 HydrophobicContact CG2-CE2 3.34Å; T21-Y23 PolarHBondContact O-N 3.13Å
22	K	32.1	Very low	32.4	Very low	159 Å²	159	144 Å²	144	69%	0.691	75%	0.75	S	S	*	*			trans	-79	75.4	-172.2	-167.2	-176.4	-177.4	-175	0	112.1	R20 L24	R20-K22 PolarHBondContact O-N 3.08Å; K22-L24 PolarHBondContact O-N 2.92Å
23	Y	30.3	Very low	32.3	Very low	191 Å²	191	137.5 Å²	137.5	75%	0.749	74%	0.744	S	S	*	*			trans	-71.5	94.4	175.8	-79.8	-72.6	0	0	0	112.3	T21	T21-Y23 HydrophobicContact CG2-CD2 3.74Å; T21-Y23 HydrophobicContact CG2-CE2 3.34Å; T21-Y23 PolarHBondContact O-N 3.13Å
24	L	29.1	Very low	32	Very low	140 Å²	140	141.8 Å²	141.8	73%	0.733	76%	0.756	S	S	*	*			trans	-85.7	115.4	159.4	-91	162.8	0	0	0	109	K22 E26	K22-L24 PolarHBondContact O-N 2.92Å; L24-E26 PolarHBondContact O-N 2.71Å
25	F	31.5	Very low	31.9	Very low	178 Å²	178	137.1 Å²	137.1	78%	0.781	75%	0.747	S	S	*	*			trans	-89.9	95.1	169.7	-108.6	-79.6	0	0	0	110.1	T27	F25-T27 HydrophobicContact CD1-CG2 4.37Å; F25-T27 PolarHBondContact O-N 2.95Å
26	E	28.7	Very low	31.8	Very low	174 Å²	174	141 Å²	141	81%	0.813	76%	0.763	S	S	*	*			trans	-82.2	103.1	164.1	-68.9	-170.2	140.6	0	0	109.7	L24 S28	L24-E26 PolarHBondContact O-N 2.71Å; E26-S28 VanDerWaalsContact C-N 3.34Å; E26-S28 PolarHBondContact O-N 2.76Å
27	T	30.8	Very low	31.5	Very low	129 Å²	129	143.9 Å²	143.9	79%	0.791	77%	0.772	S	S	*	*			trans	-89.4	70.8	171.9	42.7	0	0	0	0	110.8	F25 S29	F25-T27 HydrophobicContact CD1-CG2 4.37Å; F25-T27 PolarHBondContact O-N 2.95Å; T27-S29 PolarHBondContact O-N 3.02Å
28	S	29.8	Very low	31.5	Very low	103 Å²	103	146.8 Å²	146.8	72%	0.72	78%	0.779	S	S	*	*			trans	-68.1	98.6	-178.2	61.8	0	0	0	0	113.2	E26	E26-S28 VanDerWaalsContact C-N 3.34Å; E26-S28 PolarHBondContact O-N 2.76Å
29	S	27.9	Very low	31.3	Very low	108 Å²	108	148.2 Å²	148.2	76%	0.755	78%	0.783	S	S	*	*			trans	39.5	110.6	142.5	62.5	0	0	0	0	119.7	T27	T27-S29 PolarHBondContact O-N 3.02Å
30	S	31	Very low	31	Very low	109 Å²	109	148.3 Å²	148.3	76%	0.762	79%	0.794	S	S	*	*				-159	112.7	126.3	55.5	0	0	0	0	112.6
31	N	33.8	Very low	31.2	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	78%	0.778	S	S	*	*				-174.4	145.2	129.7	-98.4	-41.5	0	0	0	110.9
32	N	33.6	Very low	31.4	Very low	172 Å²	172	144.1 Å²	144.1	92%	0.92	79%	0.787	S	S	*	*			trans	-82.2	138.4	-169	-53.2	-50.3	0	0	0	112
33	G	31.8	Very low	31.6	Very low	77 Å²	77	142.6 Å²	142.6	79%	0.794	79%	0.786	S	S	*	*			trans	-170.1	125.4	173.5	0	0	0	0	0	110.6
34	E	31.7	Very low	31.8	Very low	203 Å²	203	137.4 Å²	137.4	95%	0.949	78%	0.778	S	S	*	*			trans	-83.9	143.4	-161.1	-56.2	174.1	128.3	0	0	115.1
35	G	30.2	Very low	32	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	77%	0.773	S	S	*	*			trans	75.9	132.4	159.6	0	0	0	0	0	116.3
36	F	30.9	Very low	32.4	Very low	219 Å²	219	133.3 Å²	133.3	96%	0.961	76%	0.763	S	S	*	*			cis	-146.8	164	26.5	-104.3	-98.6	0	0	0	112.6
37	N	30.1	Very low	32.8	Very low	154 Å²	154	133 Å²	133	82%	0.824	76%	0.762	S	S	*	*			trans	-74.5	128.5	-178.9	-81.6	-59.6	0	0	0	114
38	L	32.1	Very low	33.1	Very low	170 Å²	170	134.3 Å²	134.3	89%	0.89	76%	0.759	S	S	*	*			trans	-157.2	50.3	153.3	-116.8	175.6	0	0	0	112
39	N	30	Very low	33.3	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	76%	0.758	S	S	*	*			trans	-109.2	72.6	-171	-159.9	2.8	0	0	0	113.6
40	T	32.2	Very low	33.7	Very low	130 Å²	130	138.4 Å²	138.4	80%	0.798	76%	0.756	S	S	*	*			trans	-144.1	80.5	175.2	53.2	0	0	0	0	112
41	S	36	Very low	33.8	Very low	89 Å²	89	138.8 Å²	138.8	62%	0.622	76%	0.755	S	S	*	*	S	Bend	trans	-176.1	-38.8	155.6	-167.9	0	0	0	0	112.5	N43 S44	S41-N43 PolarHBondContact O-N 3.47Å; S41-S44 PolarHBondContact O-OG 3.05Å
42	F	36	Very low	33.8	Very low	166 Å²	166	140 Å²	140	73%	0.728	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-72	-22.8	-156.3	-141.3	-99.1	0	0	0	115.9
43	N	35.9	Very low	33.7	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-90.2	7.6	-174.5	-69.7	5.7	0	0	0	114.5	S41	S41-N43 PolarHBondContact O-N 3.47Å
44	S	35.1	Very low	33.7	Very low	81 Å²	81	145.7 Å²	145.7	57%	0.566	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-110.7	8.6	-176.8	70	0	0	0	0	115.9	S41	S41-S44 PolarHBondContact O-OG 3.05Å
45	L	33.6	Very low	33.7	Very low	121 Å²	121	140.8 Å²	140.8	63%	0.634	75%	0.745	S	S	*	*	S	Bend	trans	-113	-6.8	175.8	-93.7	81.6	0	0	0	114.7	N49	L45-N49 PolarHBondContact O-ND2 3.24Å
46	I	39.6	Very low	33.7	Very low	112 Å²	112	143.6 Å²	143.6	57%	0.574	75%	0.748	S	S	*	*	S	Bend	trans	-91	-31.6	-172.8	-64.7	177.9	0	0	0	112.2
47	E	37.4	Very low	33.7	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	74%	0.735	S	S	*	*	S	Bend	trans	-82	-27.9	177.9	-66.4	-171.4	118.1	0	0	113.8	N49	E47-N49 PolarHBondContact O-N 3.02Å
48	E	36.3	Very low	33.7	Very low	157 Å²	157	137.6 Å²	137.6	73%	0.734	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-7.6	-169.9	-146.6	177.1	-163.5	0	0	114.8
49	N	35.3	Very low	33.6	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-9	179.1	-75.4	-69.2	0	0	0	114.7	L45 E47 T51	L45-N49 PolarHBondContact O-ND2 3.24Å; E47-N49 PolarHBondContact O-N 3.02Å; N49-T51 PolarHBondContact O-N 3.18Å
50	F	35.3	Very low	33.5	Very low	165 Å²	165	136.2 Å²	136.2	72%	0.724	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-0.4	-176.6	-103	-75.5	0	0	0	115.1
51	T	33.9	Very low	33.2	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.724	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	18.8	-168.3	46.7	0	0	0	0	114.9	N49	N49-T51 PolarHBondContact O-N 3.18Å
52	K	33.2	Very low	32.9	Very low	186 Å²	186	140.2 Å²	140.2	81%	0.809	73%	0.727	S	S	*	*	S	Bend	trans	-131.6	8	-172.8	-104.7	172.7	-177	166.2	0	118.4
53	L	30.5	Very low	32.8	Very low	167 Å²	167	140.6 Å²	140.6	87%	0.874	74%	0.736	S	S	*	*	S	Bend	trans	-134.3	60.2	174.9	-77.3	171.8	0	0	0	112.4
54	H	32.4	Very low	32.4	Very low	200 Å²	200	137.5 Å²	137.5	93%	0.926	74%	0.735	S	S	*	*			trans	-155.5	89.5	161.7	-105	-66.6	0	0	0	110.5
55	S	30.9	Very low	32.3	Very low	100 Å²	100	139.8 Å²	139.8	70%	0.699	75%	0.745	S	S	*	*			trans	-163.4	140.7	173.1	52.7	0	0	0	0	109.5
56	T	31.3	Very low	32.1	Very low	129 Å²	129	140.5 Å²	140.5	79%	0.791	75%	0.75	S	S	*	*			trans	70.3	131.8	-159	72.5	0	0	0	0	112.8
57	N	31.5	Very low	31.7	Very low	128 Å²	128	142.5 Å²	142.5	68%	0.684	76%	0.761	S	S	*	*			cis	-140.8	140	-5.8	-102.6	-12.7	0	0	0	113.9
58	I	29.4	Very low	31.3	Very low	119 Å²	119	138.7 Å²	138.7	61%	0.61	76%	0.759	S	S	*	*			trans	40	113.4	136.1	-50.8	167.9	0	0	0	118.3
59	L	30.5	Very low	31	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	76%	0.761	S	S	*	*			trans	-148.8	115.4	137.2	-128.4	166.3	0	0	0	110.1
60	S	26.5	Very low	30.7	Very low	98 Å²	98	136.9 Å²	136.9	69%	0.685	76%	0.762	S	S	*	*			trans	-143.5	111.5	-175.8	59.7	0	0	0	0	112.4
61	S	27.6	Very low	30.5	Very low	91 Å²	91	136 Å²	136	64%	0.636	76%	0.764	S	S	*	*			trans	177.6	166.6	152.9	42.1	0	0	0	0	110.8
62	Y	29.1	Very low	30.4	Very low	212 Å²	212	135.8 Å²	135.8	83%	0.831	76%	0.759	S	S	*	*			trans	59	96.3	174	-54.6	-78.7	0	0	0	115.1
63	L	33	Very low	30.3	Very low	175 Å²	175	134.9 Å²	134.9	92%	0.916	76%	0.76	S	S	*	*				-157.7	164.7	50.3	-83.8	159.1	0	0	0	111.6
64	G	29	Very low	30.3	Very low	63 Å²	63	133.8 Å²	133.8	65%	0.649	75%	0.754	S	S	*	*			trans	-136.4	-168.4	174.4	0	0	0	0	0	112.8
65	T	33.2	Very low	30.2	Very low	128 Å²	128	129.3 Å²	129.3	79%	0.785	75%	0.746	S	S	*	*			trans	79.8	84.3	178.8	68.4	0	0	0	0	118.5
66	D	27.9	Very low	30.4	Very low	137 Å²	137	129.3 Å²	129.3	73%	0.733	75%	0.746	S	S	*	*				60	146.2	108.8	-49.3	-20.2	0	0	0	123.7
67	N	31.1	Very low	30.5	Very low	153 Å²	153	129.6 Å²	129.6	82%	0.818	74%	0.743	S	S	*	*			trans	75	110.8	166.4	-50	-61.2	0	0	0	115.6
68	A	29.1	Very low	30.4	Very low	88 Å²	88	130 Å²	130	73%	0.727	74%	0.744	S	S	*	*			cis	86.2	138	33.5	0	0	0	0	0	115.5
69	S	30.8	Very low	30.6	Very low	112 Å²	112	131.5 Å²	131.5	78%	0.783	75%	0.753	S	S	*	*			trans	72.2	148.7	176.4	-53.9	0	0	0	0	117
70	I	28.2	Very low	30.7	Very low	138 Å²	138	130.6 Å²	130.6	71%	0.708	75%	0.748	S	S	*	*			cis	-177.8	158.9	-35.4	-111.2	159.2	0	0	0	106
71	N	32.2	Very low	31.2	Very low	145 Å²	145	131.8 Å²	131.8	78%	0.775	75%	0.753	S	S	*	*			trans	73.4	153.9	175.3	-67.2	-35.5	0	0	0	117.2
72	N	31.7	Very low	31.2	Very low	115 Å²	115	136.3 Å²	136.3	62%	0.615	76%	0.764	S	S	*	*			cis	150.8	123.8	-24.5	168.2	25.2	0	0	0	107.1
73	M	31.3	Very low	31.4	Very low	167 Å²	167	132 Å²	132	82%	0.823	76%	0.764	S	S	*	*			trans	170.2	154.4	140.1	-91.1	-74.6	164.7	0	0	110.7
74	N	29.3	Very low	31.5	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	75%	0.75	S	S	*	*			trans	-105.4	171.1	-170	-65.5	-46.5	0	0	0	113.8
75	S	31.4	Very low	32	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	76%	0.757	S	S	*	*				113.9	145	124.6	75.2	0	0	0	0	119.8
76	S	35	Very low	32.1	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	75%	0.75	S	S	*	*			trans	68.9	147	160.7	72.8	0	0	0	0	118.9
77	D	32	Very low	32.4	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	76%	0.755	S	S	*	*			cis	-163.8	162.4	-29.3	-110.8	-46.5	0	0	0	111.2
78	L	30.8	Very low	32.4	Very low	135 Å²	135	133.2 Å²	133.2	71%	0.707	75%	0.754	S	S	*	*			trans	31.8	118	147	-59.4	165.1	0	0	0	120.1
79	N	32.4	Very low	32.5	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	76%	0.758	S	S	*	*				173.6	156.3	95.5	-90.9	-61.4	0	0	0	114
80	I	32.2	Very low	32.6	Very low	150 Å²	150	137.8 Å²	137.8	77%	0.769	76%	0.759	S	S	*	*			trans	-129.9	145.2	174.5	-62.6	169.3	0	0	0	108.5
81	P	37.8	Very low	32.8	Very low	123 Å²	123	139.6 Å²	139.6	80%	0.799	76%	0.763	S	S	*	*			trans	-117.8	120.8	153.2	29.6	-15.3	0	0	0	112.1
82	Q	28.7	Very low	32.9	Very low	185 Å²	185	138.6 Å²	138.6	86%	0.864	77%	0.768	S	S	*	*			trans	-83.3	145.6	157.2	-72.6	179.8	-92	0	0	109.7
83	C	33.2	Very low	33	Very low	122 Å²	122	142.4 Å²	142.4	82%	0.824	78%	0.779	S	S	*	*			trans	-172.1	150.4	154.6	-95.9	0	0	0	0	108.6
84	D	34.8	Very low	33.2	Very low	118 Å²	118	140.2 Å²	140.2	63%	0.631	78%	0.778	S	S	*	*			cis	-164.6	161.9	-33.2	-141.3	-39.1	0	0	0	109.7
85	H	39.1	Very low	33.5	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.796	78%	0.783	S	S	*	*			trans	63.1	146.9	165.5	-46.5	-16.5	0	0	0	117.7
86	G	34.9	Very low	33.5	Very low	62 Å²	62	145 Å²	145	64%	0.639	79%	0.787	S	S	*	*			cis	162.9	139.3	-10.8	0	0	0	0	0	113.4
87	N	33.5	Very low	33.5	Very low	154 Å²	154	145.3 Å²	145.3	82%	0.824	79%	0.789	S	S	*	*			trans	63.6	159.5	163.2	-61.7	2.6	0	0	0	117.2
88	E	32.9	Very low	33.4	Very low	175 Å²	175	143.4 Å²	143.4	82%	0.818	79%	0.787	S	S	*	*			cis	-144.1	157	15	-156.3	148.8	-117.2	0	0	113.9
89	F	30.2	Very low	33.5	Very low	184 Å²	184	143.4 Å²	143.4	81%	0.807	80%	0.796	S	S	*	*			trans	-82.2	152	175.2	-95.3	-121.7	0	0	0	111.8
90	S	33	Very low	33.6	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	80%	0.795	S	S	*	*				167.7	158.8	105.5	54	0	0	0	0	116.3
91	H	32.3	Very low	33.7	Very low	175 Å²	175	144.7 Å²	144.7	81%	0.81	80%	0.798	S	S	*	*			trans	-53.3	147.8	-173.8	-48.1	-91	0	0	0	118.4
92	S	34.8	Very low	33.3	Very low	124 Å²	124	143 Å²	143	87%	0.867	79%	0.789	S	S	*	*				-156.6	155.7	126.4	66.2	0	0	0	0	114.6
93	K	33.8	Very low	33.3	Very low	195 Å²	195	139.1 Å²	139.1	85%	0.848	78%	0.782	S	S	*	*			trans	-49.2	162.5	-168.9	-66.4	166.7	176.2	175.8	0	118.8
94	P	35.6	Very low	33.1	Very low	122 Å²	122	139 Å²	139	79%	0.792	78%	0.778	S	S	*	*			trans	-73.3	160.9	165.3	34.5	-37.1	0	0	0	112.1
95	H	35.7	Very low	32.7	Very low	191 Å²	191	140.2 Å²	140.2	88%	0.884	79%	0.785	S	S	*	*			trans	-143.4	150.4	169.2	-135	-83.3	0	0	0	112.8
96	L	30	Very low	32.2	Very low	160 Å²	160	139.2 Å²	139.2	84%	0.838	78%	0.784	S	S	*	*			trans	-108.5	138.2	-179.9	-140.7	80.7	0	0	0	110.4
97	S	35.1	Very low	32.1	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	79%	0.79	S	S	*	*			trans	-168.7	108.3	158.5	53.4	0	0	0	0	108.8
98	S	31	Very low	31.7	Very low	95 Å²	95	141.8 Å²	141.8	66%	0.664	79%	0.785	S	S	*	*				84.7	96	51.8	77	0	0	0	0	114.4
99	C	33.4	Very low	31.7	Very low	134 Å²	134	140.1 Å²	140.1	91%	0.905	79%	0.787	S	S	*	*			trans	-137.9	132.9	153.8	-88.9	0	0	0	0	109.9
100	H	34.1	Very low	31.5	Very low	169 Å²	169	136.9 Å²	136.9	78%	0.782	79%	0.787	S	S	*	*			trans	-81	177.6	177.5	-62.1	-109.3	0	0	0	109.8
101	L	33.4	Very low	31.5	Very low	159 Å²	159	137 Å²	137	83%	0.832	79%	0.788	S	S	*	*			cis	-142.8	151.1	26.7	-87.7	89.7	0	0	0	115.9
102	S	30.8	Very low	31.3	Very low	88 Å²	88	137.7 Å²	137.7	62%	0.615	79%	0.791	S	S	*	*			trans	-21.7	134	154.5	55	0	0	0	0	122.6
103	S	27.1	Very low	31.4	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	79%	0.789	S	S	*	*				61.1	144.5	110.8	-44.8	0	0	0	0	124.7
104	T	29	Very low	31.1	Very low	121 Å²	121	134.6 Å²	134.6	74%	0.742	78%	0.783	S	S	*	*			trans	76.5	113.3	146.7	37.7	0	0	0	0	122
105	N	26.5	Very low	30.9	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	78%	0.78	S	S	*	*			trans	38.3	133.3	131.6	-50.9	-7.2	0	0	0	121
106	I	29.2	Very low	30.8	Very low	151 Å²	151	133.1 Å²	133.1	77%	0.774	77%	0.774	S	S	*	*				166.6	145.5	114.8	-87.7	161.9	0	0	0	113.6
107	H	32.2	Very low	30.7	Very low	166 Å²	166	129.7 Å²	129.7	77%	0.769	76%	0.764	S	S	*	*			trans	49.9	112.5	162.3	-70.8	-41.7	0	0	0	124
108	S	26.6	Very low	30.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	77%	0.773	S	S	*	*				-27.9	133.8	126.8	53.8	0	0	0	0	118
109	V	31.8	Very low	30.5	Very low	140 Å²	140	135.9 Å²	135.9	85%	0.848	77%	0.772	S	S	*	*			trans	-145.5	138.2	144.8	174.6	0	0	0	0	109.3
110	S	25.9	Very low	30.6	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	77%	0.771	S	S	*	*			trans	-102.3	146.3	170.8	52.3	0	0	0	0	111.7
111	S	34.1	Very low	30.4	Very low	117 Å²	117	136.1 Å²	136.1	82%	0.818	77%	0.769	S	S	*	*			trans	-161.9	150.6	161.6	50	0	0	0	0	112.9
112	H	28.5	Very low	30.5	Very low	188 Å²	188	138.4 Å²	138.4	87%	0.87	77%	0.773	S	S	*	*			trans	-94.7	144.3	-175.6	-72.7	-110.6	0	0	0	113.4
113	S	35.2	Very low	30.6	Very low	118 Å²	118	139.6 Å²	139.6	83%	0.825	78%	0.778	S	S	*	*			trans	-169.2	115.8	135.4	4.2	0	0	0	0	106.8
114	N	29.2	Very low	31.4	Very low	137 Å²	137	140.2 Å²	140.2	73%	0.733	78%	0.78	S	S	*	*			cis	81.8	122.1	35.7	-155.9	31	0	0	0	113.5
115	L	31.1	Very low	31.8	Very low	139 Å²	139	141.2 Å²	141.2	73%	0.728	79%	0.786	S	S	*	*			trans	69.5	146.3	177.1	-54.3	168.8	0	0	0	115.1
116	D	32.8	Very low	32.1	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	79%	0.787	S	S	*	*			cis	-137.4	163.4	13.5	-114.5	-42.3	0	0	0	114.4
117	S	28.1	Very low	32.4	Very low	89 Å²	89	141.8 Å²	141.8	62%	0.622	79%	0.793	S	S	*	*			trans	-82.3	156.2	177.3	63.3	0	0	0	0	113.9
118	Y	34.6	Very low	32.5	Very low	239 Å²	239	142.8 Å²	142.8	94%	0.937	80%	0.798	S	S	*	*			trans	-152.9	156.5	135	-102.3	-68.6	0	0	0	112.1
119	S	28.1	Very low	32.9	Very low	91 Å²	91	147.3 Å²	147.3	64%	0.636	81%	0.808	S	S	*	*			trans	-124.6	148.7	-168.2	172.7	0	0	0	0	111.7
120	L	33.7	Very low	32.9	Very low	168 Å²	168	147.5 Å²	147.5	88%	0.88	80%	0.804	S	S	*	*				-165.5	149.6	127.9	-132.5	67.2	0	0	0	114.8
121	N	31.4	Very low	33	Very low	140 Å²	140	149.8 Å²	149.8	75%	0.749	80%	0.801	S	S	*	*			trans	-86.6	151.1	174.5	-62.1	-62.7	0	0	0	112.8
122	K	34.7	Very low	32.9	Very low	207 Å²	207	152.6 Å²	152.6	90%	0.9	80%	0.802	S	S	*	*			trans	-172.7	126.9	138.6	-113.4	174	-176.8	-178.4	0	115.2
123	P	33.8	Very low	32.7	Very low	114 Å²	114	154.6 Å²	154.6	74%	0.74	80%	0.803	S	S	*	*			trans	-134.5	-173.5	137.7	39.9	-28.6	0	0	0	110.7
124	P	42.4	Very low	32.9	Very low	116 Å²	116	153.9 Å²	153.9	75%	0.753	80%	0.796	S	S	*	*			cis	-114.6	-174	-49.1	37.3	-25	0	0	0	110
125	T	38.3	Very low	33	Very low	141 Å²	141	155.7 Å²	155.7	87%	0.865	80%	0.799	S	S	*	*			trans	-150.8	136	162.1	-43.2	0	0	0	0	110.9
126	S	31.7	Very low	33.2	Very low	113 Å²	113	158.5 Å²	158.5	79%	0.79	80%	0.802	S	S	*	*			trans	-102.6	145.4	178	45.5	0	0	0	0	111.6
127	Q	36.6	Very low	33	Very low	194 Å²	194	159.7 Å²	159.7	91%	0.907	80%	0.803	S	S	*	*			trans	-135.7	142.6	160.5	-75.7	-165.8	-19.3	0	0	109.8
128	Q	33.4	Very low	33.2	Very low	187 Å²	187	164 Å²	164	87%	0.874	81%	0.813	S	S	*	*			trans	-89.4	142.2	176.2	-62.4	167.3	-28.4	0	0	109.5
129	Q	34.8	Very low	32.9	Very low	198 Å²	198	156.9 Å²	156.9	93%	0.925	80%	0.798	S	S	*	*			trans	-148.3	164.8	145.7	-117.6	172	27.4	0	0	111.1
130	L	31.7	Very low	33.1	Very low	145 Å²	145	160.4 Å²	160.4	76%	0.759	80%	0.804	S	S	*	*			trans	-93.7	165.7	-162.1	-91.9	71.8	0	0	0	113.4
131	Q	29.8	Very low	33.1	Very low	162 Å²	162	160.9 Å²	160.9	76%	0.757	80%	0.802	S	S	*	*			trans	86.6	143.2	145.5	-86.4	168.6	17.9	0	0	121
132	Q	30.2	Very low	33	Very low	176 Å²	176	161.3 Å²	161.3	82%	0.822	80%	0.803	S	S	*	*			trans	77.3	122.5	159.3	-68.9	172.5	11.3	0	0	119.8
133	Y	26	Very low	32.8	Very low	231 Å²	231	159.3 Å²	159.3	91%	0.906	80%	0.797	S	S	*	*			trans	-72.9	143.7	161.2	-69.8	-104.2	0	0	0	110.2
134	P	39.3	Very low	32.8	Very low	103 Å²	103	160.7 Å²	160.7	67%	0.669	80%	0.798	S	S	*	*			trans	-97.6	110.9	157.6	31.8	-23.5	0	0	0	110.8	Y136	P134-Y136 HydrophobicContact CB-CD2 4.17Å; P134-Y136 HydrophobicContact CB-CE2 4.04Å
135	H	31.3	Very low	32.2	Very low	174 Å²	174	162.3 Å²	162.3	81%	0.806	80%	0.8	S	S	*	*			trans	-77.6	121.6	161.2	-150.8	-69.3	0	0	0	107.1
136	Y	34.1	Very low	31.7	Very low	198 Å²	198	161.4 Å²	161.4	78%	0.776	80%	0.798	S	S	*	*			trans	-101.5	99.4	175.3	-96.2	-82.5	0	0	0	110.9	P134	P134-Y136 HydrophobicContact CB-CD2 4.17Å; P134-Y136 HydrophobicContact CB-CE2 4.04Å
137	Q	28.5	Very low	31.5	Very low	167 Å²	167	160.8 Å²	160.8	78%	0.78	80%	0.8	S	S	*	*			trans	-99.5	141.3	145.5	-70.2	-176.1	-80.5	0	0	107.3
138	H	33.8	Very low	31.3	Very low	180 Å²	180	159.8 Å²	159.8	83%	0.833	80%	0.795	S	S	*	*			trans	-137.5	123.8	154.9	-136.8	-62.6	0	0	0	108.9
139	S	27.2	Very low	31.2	Very low	89 Å²	89	157.9 Å²	157.9	62%	0.622	79%	0.788	S	S	*	*			trans	-114.9	178.7	172	51.6	0	0	0	0	109.2
140	E	32.9	Very low	31.1	Very low	166 Å²	166	153.6 Å²	153.6	78%	0.776	78%	0.78	S	S	*	*			trans	69.8	144	-175.8	-45.5	178.9	174.9	0	0	112.1
141	Q	32.8	Very low	31	Very low	178 Å²	178	154.2 Å²	154.2	83%	0.832	78%	0.784	S	S	*	*			cis	-128.6	130.4	12.9	-62.8	151.8	-11.2	0	0	108.3
142	L	30.7	Very low	31.2	Very low	148 Å²	148	151.2 Å²	151.2	78%	0.775	78%	0.778	S	S	*	*				54.9	109.8	78.4	-88.8	173	0	0	0	116
143	E	29.7	Very low	31.4	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	78%	0.779	S	S	*	*			trans	50.5	120.5	151.4	-64.4	178	151.4	0	0	120.6
144	N	32.9	Very low	31.7	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	76%	0.764	S	S	*	*				-169.2	154.7	107.3	-104.8	-72.3	0	0	0	113.9
145	L	31	Very low	31.3	Very low	149 Å²	149	145.2 Å²	145.2	78%	0.78	77%	0.774	S	S	*	*			trans	41.5	98.3	153.3	-58	166.2	0	0	0	117.5
146	C	26.4	Very low	31.4	Very low	122 Å²	122	145.1 Å²	145.1	82%	0.824	77%	0.771	S	S	*	*				55.3	119.8	68.4	-64.1	0	0	0	0	116.4
147	A	29.4	Very low	31.1	Very low	101 Å²	101	143.9 Å²	143.9	84%	0.835	78%	0.777	S	S	*	*			trans	65.8	110.4	161.4	0	0	0	0	0	119.1
148	E	31.9	Very low	31.1	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	78%	0.775	S	S	*	*				-150.6	145.1	115.1	-116.1	178.6	-172.8	0	0	112.5
149	M	31.8	Very low	30.9	Very low	146 Å²	146	142.1 Å²	142.1	72%	0.719	77%	0.773	S	S	*	*			trans	20.3	105.4	164.7	-59.3	173.5	-73.6	0	0	118.5
150	S	31.2	Very low	31	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	78%	0.778	S	S	*	*				51.4	102	66.1	86.2	0	0	0	0	115.3
151	N	30.7	Very low	30.6	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	77%	0.774	S	S	*	*			trans	-146.3	92.4	156.3	-162.7	23.6	0	0	0	111.5
152	P	33	Very low	30.3	Very low	98 Å²	98	138.5 Å²	138.5	64%	0.636	77%	0.769	S	S	*	*			trans	-85	-172.3	168.9	37	-34.4	0	0	0	111.1
153	T	34.6	Very low	30.2	Very low	137 Å²	137	137.9 Å²	137.9	84%	0.84	77%	0.771	S	S	*	*			trans	78	142.9	-174.4	79.1	0	0	0	0	114.3
154	S	32.5	Very low	30.1	Very low	83 Å²	83	135.1 Å²	135.1	58%	0.58	77%	0.77	S	S	*	*			cis	-140.3	139.3	-0.3	61.7	0	0	0	0	111.9	K156	S154-K156 PolarHBondContact O-N 3.42Å
155	D	31.7	Very low	30	Very low	165 Å²	165	133.7 Å²	133.7	88%	0.882	77%	0.772	S	S	*	*			trans	-54.1	125.8	152.5	-71.5	-70.7	0	0	0	109.9
156	K	31.9	Very low	29.8	Very low	171 Å²	171	131.5 Å²	131.5	74%	0.743	77%	0.768	S	S	*	*			trans	-133.1	91.4	160.7	-80.1	-169	177.4	178.6	0	109.7	S154 L158	S154-K156 PolarHBondContact O-N 3.42Å; K156-L158 PolarHBondContact O-N 3.19Å; K156-L158 VanDerWaalsContact O-N 3.1Å
157	L	28.1	Very low	30	Very low	172 Å²	172	132.4 Å²	132.4	90%	0.901	77%	0.771	S	S	*	*			trans	-54.5	111.7	153.8	-75	167.8	0	0	0	108.4
158	L	29.3	Very low	30	Very low	142 Å²	142	132.9 Å²	132.9	74%	0.743	77%	0.768	S	S	*	*			trans	-117.9	96.5	161	-86.2	176.2	0	0	0	109.1	K156 V160	K156-L158 PolarHBondContact O-N 3.19Å; K156-L158 VanDerWaalsContact O-N 3.1Å; L158-V160 HydrophobicContact CB-CG2 4.48Å; L158-V160 PolarHBondContact O-N 2.8Å; L158-V160 VanDerWaalsContact O-N 3.13Å
159	H	28.9	Very low	30	Very low	169 Å²	169	129.9 Å²	129.9	78%	0.782	77%	0.766	S	S	*	*			trans	-59.2	109.4	153.7	-111.6	-93.5	0	0	0	107.9
160	V	29.5	Very low	29.9	Very low	120 Å²	120	132 Å²	132	73%	0.727	77%	0.772	S	S	*	*			trans	-106.2	85.3	162	-176.6	0	0	0	0	107.4	L158	L158-V160 HydrophobicContact CB-CG2 4.48Å; L158-V160 PolarHBondContact O-N 2.8Å; L158-V160 VanDerWaalsContact O-N 3.13Å
161	L	25.7	Very low	29.9	Very low	134 Å²	134	132.4 Å²	132.4	70%	0.702	77%	0.769	S	S	*	*			trans	-74.3	135.3	161.5	-86.1	166.6	0	0	0	109
162	S	25.7	Very low	30	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	76%	0.761	S	S	*	*			trans	47.1	103.2	153.4	59.9	0	0	0	0	118.7
163	T	27.9	Very low	30	Very low	135 Å²	135	136.5 Å²	136.5	83%	0.828	77%	0.766	S	S	*	*			trans	-122.4	98.1	137.9	52.9	0	0	0	0	109.5	S165	T163-S165 PolarHBondContact O-N 2.79Å
164	S	27.5	Very low	30	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	76%	0.757	S	S	*	*			trans	-69.2	116.7	171.4	50.2	0	0	0	0	110.7	S166	S164-S166 PolarHBondContact O-N 3.39Å
165	S	30.4	Very low	29.9	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	76%	0.762	S	S	*	*			trans	-98.1	55.1	174.9	62.9	0	0	0	0	112.1	T163 T167	T163-S165 PolarHBondContact O-N 2.79Å; S165-T167 PolarHBondContact O-N 3.07Å
166	S	27.8	Very low	30	Very low	102 Å²	102	138.2 Å²	138.2	71%	0.713	76%	0.763	S	S	*	*			trans	-73	101.3	169.6	53.9	0	0	0	0	109.7	S164 S168	S164-S166 PolarHBondContact O-N 3.39Å; S166-S168 PolarHBondContact O-N 3.42Å
167	T	30.7	Very low	30	Very low	142 Å²	142	136.7 Å²	136.7	87%	0.871	76%	0.763	S	S	*	*			trans	-68.8	116.6	179.7	33.9	0	0	0	0	111.3	S165	S165-T167 PolarHBondContact O-N 3.07Å
168	S	29.5	Very low	30.2	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	76%	0.762	S	S	*	*			trans	-85.6	129.3	-174.7	58.5	0	0	0	0	113.1	S166	S166-S168 PolarHBondContact O-N 3.42Å
169	S	32	Very low	30.5	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	77%	0.765	S	S	*	*			trans	-138.8	100.2	162.9	57.3	0	0	0	0	111.4
170	F	29.6	Very low	30.5	Very low	192 Å²	192	132.5 Å²	132.5	84%	0.842	76%	0.761	S	S	*	*			trans	18.7	120.4	141.6	-74.7	-97.3	0	0	0	116.6
171	T	31.7	Very low	30.7	Very low	116 Å²	116	135.1 Å²	135.1	71%	0.712	77%	0.769	S	S	*	*				-169.7	150.9	54.3	41.5	0	0	0	0	115.5
172	H	33	Very low	30.9	Very low	143 Å²	143	134.2 Å²	134.2	66%	0.662	78%	0.775	S	S	*	*			trans	63.3	107.3	140.9	-81.3	-113	0	0	0	123.3
173	R	31.3	Very low	31.2	Very low	200 Å²	200	133 Å²	133	76%	0.755	78%	0.779	S	S	*	*				92	121.7	119.1	-76.2	-166.1	174.5	159.7	-2.2	122.4
174	N	34.8	Very low	31.2	Very low	120 Å²	120	134.1 Å²	134.1	64%	0.642	78%	0.779	S	S	*	*			trans	70.6	106.5	134	-66	57.4	0	0	0	117.5
175	D	30.6	Very low	31.4	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	79%	0.785	S	S	*	*				88	106.6	71.4	-72.2	-39.1	0	0	0	112
176	L	35.1	Very low	31.1	Very low	172 Å²	172	136.5 Å²	136.5	90%	0.901	78%	0.781	S	S	*	*				173.9	139.7	108.9	-89.6	173.8	0	0	0	111.1
177	N	30.4	Very low	31.3	Very low	138 Å²	138	141 Å²	141	74%	0.738	79%	0.787	S	S	*	*			trans	-81.2	152.1	169.2	-72	-61	0	0	0	110.9
178	F	33	Very low	31.3	Very low	204 Å²	204	140.2 Å²	140.2	90%	0.895	78%	0.782	S	S	*	*				176.3	130.9	110.7	-99.1	-70	0	0	0	111.4
179	P	35.7	Very low	31.4	Very low	123 Å²	123	139.1 Å²	139.1	80%	0.799	78%	0.775	S	S	*	*			trans	-103.1	159	178.6	38.1	-33.7	0	0	0	114.2
180	G	29.1	Very low	31.4	Very low	69 Å²	69	142.2 Å²	142.2	71%	0.711	78%	0.778	S	S	*	*			trans	118.2	123	151.3	0	0	0	0	0	116.8
181	I	33.7	Very low	31.5	Very low	174 Å²	174	140.5 Å²	140.5	89%	0.892	78%	0.776	S	S	*	*				176.6	143.7	126	-90.5	157.5	0	0	0	109
182	S	28.6	Very low	31.4	Very low	116 Å²	116	140 Å²	140	81%	0.811	78%	0.777	S	S	*	*			trans	-83.7	152.7	179.7	51.7	0	0	0	0	113.6
183	G	33.6	Very low	31.3	Very low	78 Å²	78	137.7 Å²	137.7	80%	0.804	78%	0.783	S	S	*	*			trans	-168.3	124.1	164.3	0	0	0	0	0	113.2
184	D	26.6	Very low	31.3	Very low	158 Å²	158	132.7 Å²	132.7	85%	0.845	79%	0.785	S	S	*	*			trans	-70.5	160.5	172.7	-56.8	-83.7	0	0	0	112.6
185	I	32.1	Very low	31.3	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	79%	0.789	S	S	*	*				-176.4	138	122.7	-95	154	0	0	0	110.7
186	S	24.3	Very low	31.5	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	79%	0.79	S	S	*	*			trans	-104	147	178.5	56.6	0	0	0	0	112.9
187	K	31	Very low	31.3	Very low	197 Å²	197	129.5 Å²	129.5	86%	0.857	79%	0.786	S	S	*	*			trans	156.9	152.4	162.9	-87.5	151.4	-168.4	174	0	108.3
188	T	31.3	Very low	31.3	Very low	125 Å²	125	128.4 Å²	128.4	77%	0.767	79%	0.787	S	S	*	*			cis	-153.7	175.8	7.7	-7.5	0	0	0	0	111.9
189	S	31.5	Very low	31.1	Very low	89 Å²	89	123.2 Å²	123.2	62%	0.622	78%	0.777	S	S	*	*			trans	-32.4	166.2	166.6	51.3	0	0	0	0	118.9
190	E	32.1	Very low	30.8	Very low	174 Å²	174	124.4 Å²	124.4	81%	0.813	78%	0.776	S	S	*	*			cis	-149.8	142.1	42	-71.8	176	148.6	0	0	111.8
191	L	31.9	Very low	30.7	Very low	156 Å²	156	129.7 Å²	129.7	82%	0.817	79%	0.787	S	S	*	*				56.8	144.8	86.7	-82.2	84.1	0	0	0	116.8
192	S	30.1	Very low	30.4	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	78%	0.782	S	S	*	*			cis	-177.3	143.7	-13.3	53.1	0	0	0	0	113.6
193	A	31.7	Very low	30.2	Very low	95 Å²	95	131.8 Å²	131.8	79%	0.785	78%	0.78	S	S	*	*			trans	172.3	119.2	148.4	0	0	0	0	0	109.2
194	A	31.2	Very low	29.9	Very low	95 Å²	95	138 Å²	138	79%	0.785	79%	0.786	S	S	*	*				72.6	130.9	69.9	0	0	0	0	0	113
195	T	34	Very low	29.9	Very low	121 Å²	121	137.5 Å²	137.5	74%	0.742	78%	0.782	S	S	*	*			cis	-148.9	150.4	26.2	51.5	0	0	0	0	115
196	S	34	Very low	29.6	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	77%	0.773	S	S	*	*			trans	35.1	140.3	139.5	68.5	0	0	0	0	121.5
197	T	32.2	Very low	29.7	Very low	132 Å²	132	137.4 Å²	137.4	81%	0.81	78%	0.783	S	S	*	*			cis	-171	176.8	8.4	12	0	0	0	0	107.2
198	C	29.9	Very low	29.6	Very low	115 Å²	115	131 Å²	131	78%	0.777	77%	0.773	S	S	*	*			cis	-141.6	-151	9.4	-153	0	0	0	0	110.7
199	S	28.6	Very low	29.3	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	78%	0.776	S	S	*	*			trans	-156.1	171.8	-177.5	-49.6	0	0	0	0	114.2
200	N	28.6	Very low	29.2	Very low	148 Å²	148	139 Å²	139	79%	0.791	79%	0.789	S	S	*	*			trans	79.1	115.7	158.4	-49.3	-28.4	0	0	0	119.2
201	L	28.1	Very low	28.9	Very low	180 Å²	180	138 Å²	138	94%	0.942	79%	0.789	S	S	*	*				-164.9	159.7	93.6	-100.3	167.5	0	0	0	111.1
202	Q	27.1	Very low	28.5	Very low	168 Å²	168	136.9 Å²	136.9	79%	0.785	79%	0.788	S	S	*	*			trans	-149.9	145.3	-168.8	-167.7	175.1	16.6	0	0	111.2
203	Q	25.4	Very low	28.3	Very low	166 Å²	166	138.9 Å²	138.9	78%	0.776	80%	0.797	S	S	*	*			trans	61.1	125.5	174.9	-72.9	168.7	15.9	0	0	118.4
204	F	26.8	Very low	28	Very low	210 Å²	210	140.9 Å²	140.9	92%	0.921	80%	0.799	S	S	*	*				-157.6	167.6	114.7	-115.7	-78.6	0	0	0	109.9
205	I	25.7	Very low	27.8	Very low	147 Å²	147	141.2 Å²	141.2	75%	0.754	80%	0.795	S	S	*	*			trans	-122.4	147.3	-164.7	-45.4	174	0	0	0	110.8
206	S	26.6	Very low	27.6	Very low	100 Å²	100	142.3 Å²	142.3	70%	0.699	80%	0.797	S	S	*	*			trans	116.7	126.7	148.3	-47.4	0	0	0	0	117.6
207	N	25.3	Very low	27.5	Very low	168 Å²	168	144.1 Å²	144.1	90%	0.898	80%	0.799	S	S	*	*			trans	49.3	106.5	142	-57.2	-4.7	0	0	0	119.9
208	G	29.9	Very low	27.3	Very low	62 Å²	62	150.3 Å²	150.3	64%	0.639	81%	0.807	S	S	*	*			trans	-165.4	109.4	160.6	0	0	0	0	0	112	Y210	G208-Y210 PolarHBondContact O-N 2.96Å
209	N	24.7	Very low	27.2	Very low	158 Å²	158	148.8 Å²	148.8	85%	0.845	80%	0.798	S	S	*	*			trans	-66.3	126.4	177.8	-70	-13.3	0	0	0	110.8
210	Y	29.3	Very low	27.1	Very low	225 Å²	225	152.3 Å²	152.3	88%	0.882	81%	0.809	S	S	*	*			trans	-132.8	137.9	162	-79.8	-77.2	0	0	0	110.9	G208	G208-Y210 PolarHBondContact O-N 2.96Å
211	N	26.8	Very low	27	Very low	152 Å²	152	151.5 Å²	151.5	81%	0.813	80%	0.803	S	S	*	*			trans	-81.2	158.1	-167.5	-68.7	-32.3	0	0	0	113.1
212	T	22.5	Very low	26.9	Very low	132 Å²	132	151.1 Å²	151.1	81%	0.81	80%	0.802	S	S	*	*			trans	-57.4	132.2	168.1	49.4	0	0	0	0	112.9
213	T	25.2	Very low	26.9	Very low	148 Å²	148	149.6 Å²	149.6	91%	0.908	80%	0.798	S	S	*	*			trans	-146.8	126.9	148.7	8.4	0	0	0	0	110.1
214	T	25.1	Very low	26.9	Very low	137 Å²	137	148.8 Å²	148.8	84%	0.84	80%	0.799	S	S	*	*			trans	-106	139.3	-179	49.1	0	0	0	0	111.3
215	S	27.2	Very low	26.9	Very low	101 Å²	101	147 Å²	147	71%	0.706	80%	0.799	S	S	*	*			trans	-164	161.5	160	56.4	0	0	0	0	113.4
216	N	31.4	Very low	27	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	79%	0.789	S	S	*	*			trans	78.3	75.7	172.5	-52.1	-15.2	0	0	0	114.2
217	N	30.3	Very low	27.1	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	79%	0.79	S	S	*	*				50.8	105.6	50.9	-68.1	-7.7	0	0	0	113.9
218	R	27.8	Very low	27.3	Very low	262 Å²	262	142.5 Å²	142.5	99%	0.989	79%	0.788	S	S	*	*			trans	-109.9	66.4	151	-94.6	-169.6	170.1	-176.9	-2.5	109.6	L220	R218-L220 PolarHBondContact O-N 3.34Å
219	S	29.4	Very low	27.2	Very low	84 Å²	84	145 Å²	145	59%	0.587	79%	0.787	S	S	*	*			trans	-74.7	108.2	167	-51.5	0	0	0	0	108.2	L221	S219-L221 PolarHBondContact O-N 3.43Å
220	L	25.7	Very low	27.4	Very low	169 Å²	169	144.4 Å²	144.4	89%	0.885	78%	0.784	S	S	*	*			trans	-78.9	79.1	173.8	-123	173.7	0	0	0	109.4	R218 L222	R218-L220 PolarHBondContact O-N 3.34Å; L220-L222 PolarHBondContact O-N 3.48Å; L220-L222 VanDerWaalsContact O-N 3.08Å
221	L	26.4	Very low	27.5	Very low	130 Å²	130	138.7 Å²	138.7	68%	0.681	78%	0.777	S	S	*	*			trans	-65	102.9	168.6	-81	164.8	0	0	0	109	S219 L223	S219-L221 PolarHBondContact O-N 3.43Å; L221-L223 HydrophobicContact CB-CG 4.34Å; L221-L223 PolarHBondContact O-N 2.88Å
222	L	25.8	Very low	27.5	Very low	173 Å²	173	136.5 Å²	136.5	91%	0.906	77%	0.773	S	S	*	*			trans	-69.7	83	155	-86.7	167.5	0	0	0	107.8	L220	L220-L222 PolarHBondContact O-N 3.48Å; L220-L222 VanDerWaalsContact O-N 3.08Å
223	L	27.6	Very low	27.9	Very low	136 Å²	136	137.5 Å²	137.5	71%	0.712	77%	0.774	S	S	*	*			trans	-66.4	134	176.6	-100.1	164.5	0	0	0	110.2	L221 N225	L221-L223 HydrophobicContact CB-CG 4.34Å; L221-L223 PolarHBondContact O-N 2.88Å; L223-N225 PolarHBondContact O-N 3.32Å
224	N	25.7	Very low	28	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	77%	0.769	S	S	*	*			trans	-69.1	97.3	-174.6	-168.8	12.1	0	0	0	110.7	G226	N224-G226 PolarHBondContact O-N 3.43Å
225	N	27.3	Very low	28.1	Very low	173 Å²	173	140 Å²	140	93%	0.925	77%	0.769	S	S	*	*			trans	-74.9	66.2	172.6	-92.6	-7.9	0	0	0	110.7	L223	L223-N225 PolarHBondContact O-N 3.32Å
226	G	27.4	Very low	27.9	Very low	52 Å²	52	139.8 Å²	139.8	54%	0.536	77%	0.768	S	S	.	*			trans	-108.6	124.7	180	0	0	0	0	0	112.7	N224	N224-G226 PolarHBondContact O-N 3.43Å
227	S	28.1	Very low	27.8	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	77%	0.772	S	S	*	*			trans	68.9	105.2	170.1	-160.6	0	0	0	0	118.2
228	L	30	Very low	27.4	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	78%	0.775	S	S	*	*			trans	-139.6	75	144	-121.8	173.8	0	0	0	111
229	N	28	Very low	27.5	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	77%	0.771	S	S	*	*			trans	46.3	120.5	145.3	-64.2	-17.5	0	0	0	121.7
230	N	29.2	Very low	27.3	Very low	145 Å²	145	143.6 Å²	143.6	78%	0.775	79%	0.787	S	S	*	*			trans	111.7	140.5	130.1	-67.2	-18.2	0	0	0	121.4
231	S	30.5	Very low	27.5	Very low	105 Å²	105	140.7 Å²	140.7	73%	0.734	78%	0.781	S	S	*	*			trans	67.7	78.5	154.2	45.4	0	0	0	0	120
232	S	27.1	Very low	27.6	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	79%	0.787	S	S	*	*				63.6	145.9	111.4	-53.6	0	0	0	0	122.6
233	N	30.7	Very low	27.9	Very low	154 Å²	154	139.7 Å²	139.7	82%	0.824	78%	0.78	S	S	*	*			trans	79.4	96.9	165.5	-51.3	-25.1	0	0	0	114.8
234	H	27.4	Very low	28	Very low	173 Å²	173	140.1 Å²	140.1	80%	0.801	78%	0.783	S	S	*	*				75.3	82.6	58.9	-170.7	-62.2	0	0	0	113.5
235	L	26.9	Very low	28.2	Very low	163 Å²	163	139.3 Å²	139.3	85%	0.853	78%	0.783	S	S	*	*			trans	-165.6	150.8	138.4	-107.1	159.9	0	0	0	110.5
236	S	23.1	Very low	28.2	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	78%	0.777	S	S	*	*			trans	-96.9	150.7	-176.1	53.5	0	0	0	0	112.7
237	I	28.8	Very low	28.4	Very low	167 Å²	167	139.6 Å²	139.6	86%	0.856	79%	0.788	S	S	*	*			trans	-166.5	155.2	135.3	-99.1	148.6	0	0	0	108.5
238	N	23.5	Very low	28.3	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	79%	0.792	S	S	*	*			trans	-74	149.5	-177.8	-47	-29	0	0	0	111.7
239	E	29.7	Very low	28.2	Very low	194 Å²	194	143.3 Å²	143.3	91%	0.907	79%	0.79	S	S	*	*				-170.1	165.6	124.7	-107.5	164	-158.4	0	0	111.5
240	E	25.3	Very low	28.2	Very low	199 Å²	199	142.9 Å²	142.9	93%	0.93	80%	0.795	S	S	*	*			trans	-79.8	134.3	-169.3	-58.8	177.3	128.7	0	0	112.5
241	S	29.9	Very low	28	Very low	108 Å²	108	144.5 Å²	144.5	76%	0.755	80%	0.798	S	S	*	*			trans	-153.7	136.2	159.9	51	0	0	0	0	112.3
242	I	27.7	Very low	27.9	Very low	156 Å²	156	149.8 Å²	149.8	80%	0.8	80%	0.803	S	S	*	*			trans	-89.3	121.7	-176	-63.6	165	0	0	0	109.2
243	V	31.3	Very low	27.9	Very low	127 Å²	127	152.8 Å²	152.8	77%	0.77	81%	0.806	S	S	*	*			trans	-100.9	100.7	176.8	-177.9	0	0	0	0	110.4
244	N	29.4	Very low	27.8	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	80%	0.803	S	S	*	*			trans	-70.7	147.7	169.4	-70.5	-47.5	0	0	0	111.2
245	T	30.5	Very low	27.8	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	80%	0.798	S	S	*	*			trans	-126.3	149.3	160.8	41.3	0	0	0	0	110.5
246	P	28.1	Very low	27.7	Very low	123 Å²	123	148.5 Å²	148.5	80%	0.799	80%	0.796	S	S	*	*			trans	-98.9	137.5	-147	35.3	-34.5	0	0	0	115.2
247	S	30.9	Very low	28	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	79%	0.793	S	S	*	*			trans	-98.2	123.8	159.3	-177.3	0	0	0	0	109.5	F249	S247-F249 PolarHBondContact O-N 3.41Å
248	I	26.5	Very low	27.8	Very low	162 Å²	162	147 Å²	147	83%	0.831	79%	0.79	S	S	*	*			trans	-74.8	106.2	-177.9	-62.7	170.4	0	0	0	109.2
249	F	27.4	Very low	28.1	Very low	186 Å²	186	145.4 Å²	145.4	82%	0.816	79%	0.786	S	S	*	*			trans	-98.4	119.3	170.8	-125.1	-85.1	0	0	0	110.5	S247 Q251	S247-F249 PolarHBondContact O-N 3.41Å; F249-Q251 PolarHBondContact O-N 3.44Å
250	C	27.6	Very low	28.2	Very low	106 Å²	106	142.6 Å²	142.6	72%	0.716	78%	0.783	S	S	*	*			trans	-78.3	112	173	-164.8	0	0	0	0	108.9	Y252	C250-Y252 PolarHBondContact O-N 3.05Å
251	Q	25.6	Very low	28.5	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	78%	0.776	S	S	*	*			trans	-66.7	130.8	175.8	-69.4	177.7	-26.3	0	0	110.4	F249	F249-Q251 PolarHBondContact O-N 3.44Å
252	Y	28.6	Very low	28.7	Very low	217 Å²	217	140.4 Å²	140.4	85%	0.851	78%	0.779	S	S	*	*			trans	-133.5	109	160.4	-115.6	-85	0	0	0	109.9	C250 S254	C250-Y252 PolarHBondContact O-N 3.05Å; Y252-S254 PolarHBondContact O-N 3.06Å
253	Q	26.2	Very low	28.8	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	78%	0.78	S	S	*	*			trans	-71.6	122.2	-179.3	-161.1	83.6	-11.7	0	0	109.6	L255	Q253-L255 HydrophobicContact CG-CD1 4.06Å
254	S	29	Very low	29	Very low	109 Å²	109	141.1 Å²	141.1	76%	0.762	79%	0.785	S	S	*	*			trans	-121.2	105.7	169	-179.1	0	0	0	0	108.8	Y252 I256	Y252-S254 PolarHBondContact O-N 3.06Å; S254-I256 PolarHBondContact O-N 3.49Å
255	L	27.4	Very low	29	Very low	133 Å²	133	140.5 Å²	140.5	70%	0.696	79%	0.787	S	S	*	*			trans	-66.2	126.9	179.2	-80.3	75.4	0	0	0	110	Q253	Q253-L255 HydrophobicContact CG-CD1 4.06Å
256	I	26.1	Very low	29.1	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	79%	0.786	S	S	*	*			trans	-76.1	123.1	159	-61.1	174.6	0	0	0	106.5	S254	S254-I256 PolarHBondContact O-N 3.49Å
257	T	27.8	Very low	29.3	Very low	100 Å²	100	139.9 Å²	139.9	61%	0.613	78%	0.781	S	S	*	*			trans	-129.1	96.6	174.3	-61.4	0	0	0	0	108.9	T259	T257-T259 HydrophobicContact CG2-CG2 4.27Å; T257-T259 PolarHBondContact O-N 3.45Å
258	T	26.2	Very low	29.3	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	78%	0.782	S	S	*	*			trans	-68.1	114.3	175.4	-28.7	0	0	0	0	109.1
259	T	29.6	Very low	29.6	Very low	115 Å²	115	139.7 Å²	139.7	71%	0.706	78%	0.783	S	S	*	*			trans	-121.4	109.1	173.8	38.3	0	0	0	0	110.8	T257	T257-T259 HydrophobicContact CG2-CG2 4.27Å; T257-T259 PolarHBondContact O-N 3.45Å
260	T	30.5	Very low	29.5	Very low	136 Å²	136	135.7 Å²	135.7	83%	0.834	78%	0.784	S	S	*	*			trans	-73.5	118.8	170.1	32.8	0	0	0	0	110.2
261	T	31.8	Very low	29.7	Very low	128 Å²	128	140.9 Å²	140.9	79%	0.785	80%	0.795	S	S	*	*			trans	-82.8	117.7	176.9	48.5	0	0	0	0	111.3
262	T	33.5	Very low	29.7	Very low	133 Å²	133	142.5 Å²	142.5	82%	0.816	80%	0.799	S	S	*	*			trans	-110.5	142.7	160.6	46.8	0	0	0	0	109.7
263	N	31.4	Very low	29.8	Very low	154 Å²	154	137 Å²	137	82%	0.824	80%	0.798	S	S	*	*			trans	-78	136.5	-169.3	-66.2	-25.3	0	0	0	112.4
264	T	35	Very low	29.7	Very low	144 Å²	144	138.5 Å²	138.5	88%	0.883	80%	0.803	S	S	*	*			trans	-159.9	129.6	144	-3.7	0	0	0	0	111
265	T	29.4	Very low	29.7	Very low	130 Å²	130	139 Å²	139	80%	0.798	80%	0.801	S	S	*	*			trans	-90.2	126.8	178.2	46.3	0	0	0	0	111.4
266	T	32.8	Very low	29.7	Very low	130 Å²	130	138.2 Å²	138.2	80%	0.798	80%	0.802	S	S	*	*			trans	-171.8	118.4	133.4	12.7	0	0	0	0	114.4
267	T	31.7	Very low	29.7	Very low	111 Å²	111	137.7 Å²	137.7	68%	0.681	80%	0.799	S	S	*	*			trans	42.7	110.5	139.9	55.4	0	0	0	0	122.5
268	T	31.3	Very low	29.7	Very low	126 Å²	126	138.3 Å²	138.3	77%	0.773	81%	0.808	S	S	*	*				83.6	154.2	126.1	59.9	0	0	0	0	123.2
269	T	32.3	Very low	29.7	Very low	141 Å²	141	139.1 Å²	139.1	87%	0.865	81%	0.807	S	S	*	*			trans	68.1	103.2	171	31.2	0	0	0	0	118.6
270	A	25.7	Very low	29.6	Very low	101 Å²	101	139.5 Å²	139.5	84%	0.835	81%	0.809	S	S	*	*			trans	-89.4	149.9	169.4	0	0	0	0	0	112.7
271	K	30.9	Very low	29.5	Very low	216 Å²	216	138.6 Å²	138.6	94%	0.939	80%	0.804	S	S	*	*			trans	-155.8	150.4	153.9	-116	166.7	-173.3	174.6	0	111.8
272	K	27.4	Very low	29.2	Very low	211 Å²	211	138.9 Å²	138.9	92%	0.917	81%	0.805	S	S	*	*			trans	-80.1	139.7	-176.2	-56.5	171.6	178.8	178.7	0	111.7
273	A	29.8	Very low	29	Very low	101 Å²	101	143.8 Å²	143.8	84%	0.835	81%	0.809	S	S	*	*			trans	-160.3	150.3	146	0	0	0	0	0	110.6
274	F	24.4	Very low	28.8	Very low	201 Å²	201	140.3 Å²	140.3	88%	0.882	80%	0.796	S	S	*	*			trans	-94.6	169.4	173.9	-110	-120.9	0	0	0	111.4
275	T	28.2	Very low	28.4	Very low	119 Å²	119	140.4 Å²	140.4	73%	0.73	79%	0.792	S	S	*	*			trans	117.9	140	133	-15.2	0	0	0	0	117.4
276	T	28.3	Very low	28.4	Very low	117 Å²	117	140.2 Å²	140.2	72%	0.718	79%	0.786	S	S	*	*			trans	66.2	101	157.4	-45.4	0	0	0	0	115.8
277	I	25.3	Very low	28.2	Very low	146 Å²	146	141.3 Å²	141.3	75%	0.749	78%	0.782	S	S	*	*				60.4	96.1	52.8	-50.1	-179.7	0	0	0	114.4
278	S	29.1	Very low	28	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	78%	0.779	S	S	*	*			trans	173.5	104.7	144.1	-76.7	0	0	0	0	107.2
279	N	26.3	Very low	27.8	Very low	148 Å²	148	144 Å²	144	79%	0.791	78%	0.781	S	S	*	*				64.7	150.7	66.8	-74.1	-1.8	0	0	0	116
280	V	27.2	Very low	27.6	Very low	123 Å²	123	142.9 Å²	142.9	75%	0.745	77%	0.769	S	S	*	*			trans	104.7	117.5	155.7	-169.9	0	0	0	0	118
281	T	27.7	Very low	27.7	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	76%	0.764	S	S	*	*			trans	60.7	124.7	161.7	56.3	0	0	0	0	119
282	T	26	Very low	27.8	Very low	133 Å²	133	141.2 Å²	141.2	82%	0.816	75%	0.753	S	S	*	*			cis	74.9	105.7	39.3	75.3	0	0	0	0	116
283	R	29.5	Very low	27.9	Very low	236 Å²	236	134.8 Å²	134.8	89%	0.891	73%	0.734	S	S	*	*			trans	-160.5	98	155.5	-159.9	175.6	-176.6	161.4	0.7	106.9
284	S	27.5	Very low	28.1	Very low	81 Å²	81	139.9 Å²	139.9	57%	0.566	74%	0.738	S	S	*	*				71	97.3	66.1	84.4	0	0	0	0	113.2
285	D	26.7	Very low	28.4	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	73%	0.73	S	S	*	*			trans	80.9	152	136.1	-43.9	-28.7	0	0	0	121.4
286	N	29.1	Very low	28.6	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	73%	0.734	S	S	*	*			trans	81	107.9	153.9	-74.1	19.5	0	0	0	122.2
287	E	27.4	Very low	28.7	Very low	153 Å²	153	134.4 Å²	134.4	72%	0.715	73%	0.734	S	S	*	*				104	137.3	108.6	-81	177.5	139.3	0	0	122.7
288	I	28	Very low	28.9	Very low	121 Å²	121	134.6 Å²	134.6	62%	0.621	73%	0.733	S	S	*	*			trans	73.8	90.2	140.3	-65.4	166.1	0	0	0	119	L290	I288-L290 HydrophobicContact CG2-CD1 4.41Å
289	E	26.1	Very low	28.9	Very low	173 Å²	173	134.7 Å²	134.7	81%	0.808	72%	0.724	S	S	*	*				67.6	171.9	107.4	-157.4	-179.9	-142.8	0	0	120.9
290	L	29.3	Very low	29.2	Very low	117 Å²	117	135 Å²	135	61%	0.613	73%	0.725	S	S	*	*			trans	86.2	85.2	165.7	-70	110.2	0	0	0	121	I288	I288-L290 HydrophobicContact CG2-CD1 4.41Å
291	M	28.2	Very low	29.2	Very low	149 Å²	149	137.4 Å²	137.4	73%	0.734	73%	0.731	S	S	*	*				96.1	143.6	105.2	-83.7	-158.4	-169.6	0	0	123.1
292	N	31.7	Very low	29.9	Very low	133 Å²	133	136 Å²	136	71%	0.711	72%	0.724	S	S	*	*			trans	82.2	145	145.2	-76.2	-43.2	0	0	0	121.4
293	S	30.7	Very low	30.1	Very low	75 Å²	75	135.7 Å²	135.7	52%	0.524	72%	0.717	S	S	.	*			cis	-174.8	162.3	-46	47	0	0	0	0	110.9
294	K	34.5	Very low	30.1	Very low	208 Å²	208	131.1 Å²	131.1	90%	0.904	71%	0.71	S	S	*	*			trans	75.8	144.6	169.3	-48.9	162.9	-169.9	173.2	0	115.4
295	G	29.4	Very low	30.2	Very low	69 Å²	69	132 Å²	132	71%	0.711	71%	0.712	S	S	*	*			cis	150.7	157.4	-9.5	0	0	0	0	0	113.7
296	C	32	Very low	30.4	Very low	122 Å²	122	133.1 Å²	133.1	82%	0.824	71%	0.712	S	S	*	*			trans	68.6	149.3	174.7	-71.9	0	0	0	0	117.5
297	N	31	Very low	30.6	Very low	132 Å²	132	132.2 Å²	132.2	71%	0.706	72%	0.716	S	S	*	*			cis	-171.2	147.3	-28.4	-124.1	-2	0	0	0	109.7
298	M	29.5	Very low	30.8	Very low	150 Å²	150	131.1 Å²	131.1	74%	0.739	72%	0.715	S	S	*	*			trans	48.6	154.9	147.3	-47.5	-133.8	-59.6	0	0	119.8
299	D	29.6	Very low	31.1	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	72%	0.717	S	S	*	*			cis	-160	170.7	13.3	-139.7	-21.6	0	0	0	113.3
300	L	31.9	Very low	31.3	Very low	155 Å²	155	130 Å²	130	81%	0.812	71%	0.711	S	S	*	*			trans	62.3	119.7	152.8	-68.3	164.6	0	0	0	123.2
301	M	28.6	Very low	31.5	Very low	173 Å²	173	131 Å²	131	85%	0.852	72%	0.717	S	S	*	*			trans	-89.3	-167.1	155.8	-132.6	174.5	109.5	0	0	108.5
302	P	40.7	Very low	31.8	Very low	89 Å²	89	131.3 Å²	131.3	58%	0.578	72%	0.716	S	S	*	*			cis	-141.5	-162	-7.4	36.8	-12.8	0	0	0	116
303	N	31.5	Very low	31.9	Very low	127 Å²	127	131 Å²	131	68%	0.679	72%	0.715	S	S	*	*			trans	101.3	116.9	146	-73.8	-4.9	0	0	0	122.3
304	L	28.2	Very low	31.9	Very low	140 Å²	140	132.7 Å²	132.7	73%	0.733	73%	0.726	S	S	*	*				56.9	150.5	117.1	-56	174.5	0	0	0	120.1
305	T	30.8	Very low	31.9	Very low	100 Å²	100	128.4 Å²	128.4	61%	0.613	72%	0.72	S	S	*	*			cis	-155.6	152.6	11.7	-12.5	0	0	0	0	112.7
306	E	29.8	Very low	32.1	Very low	168 Å²	168	134.5 Å²	134.5	79%	0.785	73%	0.727	S	S	*	*			trans	55.2	144.1	139.3	-80.9	163.4	-165.3	0	0	126
307	S	33.9	Very low	31.8	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	73%	0.725	S	S	*	*			trans	76.1	145.4	147.3	80.9	0	0	0	0	119.1
308	N	30.7	Very low	31.9	Very low	130 Å²	130	138.5 Å²	138.5	70%	0.695	73%	0.73	S	S	*	*			cis	-157.1	169.9	-17.2	-129.7	20.1	0	0	0	112.2
309	E	34.8	Very low	31.8	Very low	144 Å²	144	138 Å²	138	67%	0.673	73%	0.73	S	S	*	*			trans	68.6	110.9	147.1	-73.7	168.7	-121.9	0	0	122.5
310	N	31.5	Very low	32	Very low	128 Å²	128	140.2 Å²	140.2	68%	0.684	74%	0.742	S	S	*	*				54.6	111.9	115	-56.5	-13.7	0	0	0	120.5
311	N	32.7	Very low	31.8	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	74%	0.739	S	S	*	*				163.1	134.3	91.7	-94.1	-35.7	0	0	0	116.1
312	H	34.7	Very low	32	Very low	155 Å²	155	138.8 Å²	138.8	72%	0.718	74%	0.743	S	S	*	*			trans	63.3	141.8	139.5	-87.7	-79.1	0	0	0	124.9
313	N	33.9	Very low	31.3	Very low	127 Å²	127	141.9 Å²	141.9	68%	0.679	75%	0.754	S	S	*	*			trans	82.8	79.5	141.7	-64	-9.3	0	0	0	121.9
314	S	30.7	Very low	31.3	Very low	110 Å²	110	144 Å²	144	77%	0.769	76%	0.764	S	S	*	*				76.1	152.8	117.4	74.3	0	0	0	0	120.1
315	P	34.2	Very low	31.4	Very low	118 Å²	118	143.8 Å²	143.8	77%	0.766	76%	0.764	S	S	*	*			trans	-101.8	160.6	-159.5	38.9	-36	0	0	0	115.3
316	K	33.8	Very low	31.2	Very low	198 Å²	198	146.7 Å²	146.7	86%	0.861	77%	0.77	S	S	*	*			trans	-158.1	140	148.6	-109.3	146.9	-171.6	172.9	0	113.2
317	F	26.4	Very low	31.2	Very low	181 Å²	181	146 Å²	146	79%	0.794	77%	0.77	S	S	*	*			trans	-13.4	141.7	162.3	-65.9	-100.3	0	0	0	118.7
318	I	32.8	Very low	31.1	Very low	157 Å²	157	146.6 Å²	146.6	81%	0.805	77%	0.771	S	S	*	*				-153.8	133.1	113.7	-98.4	149.2	0	0	0	108.5
319	N	27.4	Very low	31.1	Very low	139 Å²	139	146.3 Å²	146.3	74%	0.743	77%	0.774	S	S	*	*			trans	-79	146	169.2	-74.9	-9.5	0	0	0	109.5
320	N	32.1	Very low	30.7	Very low	160 Å²	160	144.2 Å²	144.2	86%	0.856	78%	0.776	S	S	*	*			trans	-149.9	113	147.6	-106.1	-26.6	0	0	0	110.8
321	T	28.5	Very low	30.5	Very low	123 Å²	123	142.6 Å²	142.6	76%	0.755	78%	0.775	S	S	*	*			trans	-74.6	127.5	172.7	41.7	0	0	0	0	111.1
322	L	32.2	Very low	30.3	Very low	176 Å²	176	146.6 Å²	146.6	92%	0.921	78%	0.781	S	S	*	*			trans	-137.8	113.8	148.7	-80.1	-178.7	0	0	0	109
323	N	27.3	Very low	30	Very low	153 Å²	153	144.2 Å²	144.2	82%	0.818	78%	0.779	S	S	*	*			trans	-76.3	139.1	167	-66.5	-18.5	0	0	0	109.1
324	L	31.1	Very low	29.8	Very low	171 Å²	171	146.1 Å²	146.1	90%	0.895	79%	0.788	S	S	*	*			trans	-151.2	158.3	147.5	-138.7	70	0	0	0	111.1
325	L	29.1	Very low	29.5	Very low	137 Å²	137	146.9 Å²	146.9	72%	0.717	79%	0.788	S	S	*	*			trans	-67.6	145.2	-156.6	-86.5	56.7	0	0	0	116.5
326	E	26.7	Very low	29.3	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.752	79%	0.792	S	S	*	*				27.8	132.4	126.6	-48.8	177.3	121	0	0	120.4
327	I	31.2	Very low	28.9	Very low	154 Å²	154	145.6 Å²	145.6	79%	0.79	79%	0.789	S	S	*	*				-173	143.6	106.5	-95.5	158.7	0	0	0	110
328	P	30.2	Very low	29.1	Very low	119 Å²	119	145.2 Å²	145.2	77%	0.773	79%	0.789	S	S	*	*			trans	-99.5	139.4	-172.7	36.3	-34.2	0	0	0	115.7
329	T	32.2	Very low	29	Very low	124 Å²	124	145.8 Å²	145.8	76%	0.761	79%	0.791	S	S	*	*			trans	-145	108.7	167.1	45.6	0	0	0	0	108.9
330	S	27	Very low	28.9	Very low	101 Å²	101	148.5 Å²	148.5	71%	0.706	80%	0.796	S	S	*	*				70.7	108.7	80.4	74.9	0	0	0	0	115.5
331	S	26.9	Very low	28.8	Very low	94 Å²	94	147.6 Å²	147.6	66%	0.657	79%	0.791	S	S	*	*			trans	51.1	123.7	146.9	-47.1	0	0	0	0	118.8
332	Y	28.4	Very low	28.9	Very low	221 Å²	221	147 Å²	147	87%	0.867	79%	0.792	S	S	*	*				-167.7	171	70.2	-91.6	-72.2	0	0	0	111.1
333	P	28.5	Very low	28.9	Very low	105 Å²	105	148.4 Å²	148.4	68%	0.682	79%	0.786	S	S	*	*			trans	-96.3	159.1	-157.4	37.6	-38.3	0	0	0	115.4
334	I	29.2	Very low	29.1	Very low	167 Å²	167	148.3 Å²	148.3	86%	0.856	79%	0.785	S	S	*	*			trans	-129.2	128.1	155.2	-62.7	-178.4	0	0	0	108.6
335	T	25	Very low	29.3	Very low	126 Å²	126	146.3 Å²	146.3	77%	0.773	78%	0.782	S	S	*	*			trans	-95	134.4	177.8	50.6	0	0	0	0	111.6
336	T	29.3	Very low	29.3	Very low	139 Å²	139	143.7 Å²	143.7	85%	0.853	78%	0.775	S	S	*	*			trans	-149.4	144.9	149.3	19.9	0	0	0	0	110.3
337	N	26.1	Very low	29.4	Very low	150 Å²	150	144.7 Å²	144.7	80%	0.802	78%	0.783	S	S	*	*			trans	-78.8	156.7	-177	-51.6	-68.9	0	0	0	111.9
338	H	30.8	Very low	29.3	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.796	78%	0.782	S	S	*	*				-171	144.1	122	-101.6	-71.1	0	0	0	111.6
339	M	28.8	Very low	29.2	Very low	170 Å²	170	146.9 Å²	146.9	84%	0.837	78%	0.78	S	S	*	*			trans	56.4	104.8	167.2	-60.1	172.7	179.2	0	0	116.1
340	K	27.1	Very low	29.2	Very low	196 Å²	196	148.4 Å²	148.4	85%	0.852	78%	0.778	S	S	*	*				47	86.3	70.3	-67.9	-166.4	173.5	-172.5	0	114
341	D	28.6	Very low	29.3	Very low	140 Å²	140	150.2 Å²	150.2	75%	0.749	78%	0.78	S	S	*	*				-172.3	127.9	103.2	-93.7	-3.4	0	0	0	110.3
342	S	30.9	Very low	29.5	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	78%	0.783	S	S	*	*			trans	-147.7	94.3	-179.3	51.3	0	0	0	0	111.5	L344	S342-L344 PolarHBondContact O-N 3.48Å; S342-L344 VanDerWaalsContact O-N 3.09Å
343	Y	33.6	Very low	29.5	Very low	206 Å²	206	147.7 Å²	147.7	81%	0.808	78%	0.778	S	S	*	*			trans	-76.9	94.1	178.7	-82.4	-102.6	0	0	0	111.3
344	L	31.5	Very low	29.5	Very low	151 Å²	151	150.5 Å²	150.5	79%	0.791	79%	0.786	S	S	*	*			trans	-91.2	130.4	159.4	-79.1	167.4	0	0	0	109.4	S342 S346	S342-L344 PolarHBondContact O-N 3.48Å; S342-L344 VanDerWaalsContact O-N 3.09Å; L344-S346 PolarHBondContact O-N 3.09Å; L344-S346 VanDerWaalsContact O-N 3.08Å
345	P	33.6	Very low	29.4	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	78%	0.775	S	S	*	*			trans	-64	108.3	167.5	-19.9	32.7	0	0	0	109.8	M347	P345-M347 PolarHBondContact O-N 3.19Å
346	S	30.6	Very low	29.5	Very low	82 Å²	82	148.5 Å²	148.5	57%	0.573	77%	0.774	S	S	*	*			trans	-77.5	104.5	-175.1	48	0	0	0	0	112.2	L344 F348	L344-S346 PolarHBondContact O-N 3.09Å; L344-S346 VanDerWaalsContact O-N 3.08Å; S346-F348 PolarHBondContact O-N 3.02Å; S346-F348 VanDerWaalsContact O-N 3.09Å; S346-F348 VanDerWaalsContact OG-CE2 3.3Å; S346-F348 WeakPolarHBondContact OG-CE2 3.3Å
347	M	29	Very low	29.4	Very low	183 Å²	183	147.3 Å²	147.3	90%	0.901	76%	0.763	S	S	*	*			trans	-66.8	102.1	152.2	-80.6	-165.2	-66.7	0	0	108.3	P345 I349	P345-M347 PolarHBondContact O-N 3.19Å; M347-I349 PolarHBondContact O-N 3.46Å; M347-I349 VanDerWaalsContact O-N 3.16Å
348	F	27.4	Very low	29.5	Very low	177 Å²	177	146.3 Å²	146.3	78%	0.776	76%	0.757	S	S	*	*			trans	-69.8	105.3	169	-78.6	-87.7	0	0	0	109.7	S346	S346-F348 PolarHBondContact O-N 3.02Å; S346-F348 VanDerWaalsContact O-N 3.09Å; S346-F348 VanDerWaalsContact OG-CE2 3.3Å; S346-F348 WeakPolarHBondContact OG-CE2 3.3Å
349	I	29.5	Very low	29.2	Very low	142 Å²	142	146.4 Å²	146.4	73%	0.728	76%	0.758	S	S	*	*			trans	-84.4	124.8	153.5	-62.5	178	0	0	0	105.9	M347 D351	M347-I349 PolarHBondContact O-N 3.46Å; M347-I349 VanDerWaalsContact O-N 3.16Å; I349-D351 PolarHBondContact O-N 2.81Å
350	H	30.5	Very low	28.9	Very low	155 Å²	155	143.1 Å²	143.1	72%	0.718	75%	0.751	S	S	*	*			trans	-93.7	94.2	-174.3	-156.7	-80.9	0	0	0	109.8	N352	H350-N352 PolarHBondContact CE1-OD1 2.91Å; H350-N352 PolarHBondContact ND1-OD1 2.71Å; H350-N352 PolarHBondContact O-N 2.78Å
351	D	30.5	Very low	28.8	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	74%	0.742	S	S	*	*			trans	-70.7	90	177.9	-76.7	-34.1	0	0	0	111.2	I349 V353	I349-D351 PolarHBondContact O-N 2.81Å; D351-V353 PolarHBondContact O-N 2.85Å; D351-V353 VanDerWaalsContact O-N 3.07Å
352	N	30.6	Very low	28.6	Very low	136 Å²	136	137.7 Å²	137.7	73%	0.727	74%	0.74	S	S	*	*			trans	-73.3	94.5	169.6	-86.5	15.8	0	0	0	110.3	H350	H350-N352 PolarHBondContact CE1-OD1 2.91Å; H350-N352 PolarHBondContact ND1-OD1 2.71Å; H350-N352 PolarHBondContact O-N 2.78Å
353	V	28	Very low	28.3	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	74%	0.737	S	S	*	*			trans	-118.6	81.2	167.8	-172.5	0	0	0	0	110.4	D351	D351-V353 PolarHBondContact O-N 2.85Å; D351-V353 VanDerWaalsContact O-N 3.07Å
354	L	29	Very low	28.2	Very low	163 Å²	163	136.6 Å²	136.6	85%	0.853	73%	0.734	S	S	*	*			trans	-103.7	101.3	149.3	-69.8	174.2	0	0	0	104.9
355	S	26.1	Very low	27.9	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	73%	0.734	S	S	*	*				76	135.2	77.4	73	0	0	0	0	112.8
356	E	28.2	Very low	27.8	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.762	73%	0.732	S	S	*	*			trans	88	90.4	168.6	-54.1	-114.6	131.8	0	0	118.6
357	N	27.1	Very low	27.4	Very low	115 Å²	115	139.6 Å²	139.6	62%	0.615	73%	0.733	S	S	*	*				84.5	128.2	115.7	-59.1	-30.2	0	0	0	122.4
358	N	28.3	Very low	27.4	Very low	128 Å²	128	142.2 Å²	142.2	68%	0.684	73%	0.733	S	S	*	*			trans	80.7	111.3	148.5	-59.6	-27.1	0	0	0	121.2
359	Q	24.5	Very low	27.2	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	73%	0.727	S	S	*	*				44.4	132.4	118.1	-59	172.4	5.7	0	0	118.2
360	C	22.6	Very low	27	Very low	100 Å²	100	140.5 Å²	140.5	68%	0.676	73%	0.731	S	S	*	*			cis	-167.8	153.8	36.1	-140.3	0	0	0	0	114.6
361	T	24.3	Very low	26.8	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	73%	0.734	S	S	*	*			trans	48.3	110.3	145.6	51	0	0	0	0	123.2
362	T	24.7	Very low	26.5	Very low	115 Å²	115	139.3 Å²	139.3	71%	0.706	74%	0.738	S	S	*	*				66.6	132.3	122.8	62.1	0	0	0	0	123.3
363	N	25.5	Very low	26.5	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	74%	0.744	S	S	*	*			trans	72.6	155.8	145.1	-64.7	24.1	0	0	0	117.3
364	E	30.4	Very low	26.4	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.752	74%	0.742	S	S	*	*			cis	-143.7	168.2	8.6	-147.1	142.1	-102.8	0	0	112.9
365	E	25.5	Very low	26.5	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.794	74%	0.74	S	S	*	*			trans	-78.8	145.9	176.5	-53.1	172.3	118.9	0	0	112.2
366	Q	31	Very low	26.5	Very low	169 Å²	169	142.4 Å²	142.4	79%	0.79	75%	0.745	S	S	*	*				-172.1	147.3	126.2	-106.5	150.6	89.7	0	0	114.6
367	S	23.4	Very low	26.6	Very low	86 Å²	86	141.8 Å²	141.8	60%	0.601	75%	0.747	S	S	*	*			trans	-93.2	152.6	172.8	53.8	0	0	0	0	111.7
368	W	28	Very low	26.8	Very low	237 Å²	237	143.1 Å²	143.1	90%	0.898	75%	0.749	S	S	*	*			trans	-139.7	158.4	153.7	-81.1	108.5	0	0	0	111.5
369	I	24.4	Very low	26.7	Very low	128 Å²	128	143 Å²	143	66%	0.656	75%	0.749	S	S	*	*			trans	-143.1	149	-157.4	-79.3	176.7	0	0	0	109.2
370	I	23.9	Very low	26.9	Very low	155 Å²	155	144.5 Å²	144.5	80%	0.795	75%	0.748	S	S	*	*			trans	65.8	122.2	170.2	-72.1	160.1	0	0	0	116.3
371	S	27.7	Very low	27.2	Very low	114 Å²	114	147 Å²	147	80%	0.797	75%	0.754	S	S	*	*				-170.6	102.9	117	52.4	0	0	0	0	111.9
372	D	24	Very low	27.2	Very low	156 Å²	156	146.8 Å²	146.8	83%	0.834	76%	0.757	S	S	*	*			trans	-66.2	144.3	155.7	-69.5	-67.4	0	0	0	109.7
373	N	30.2	Very low	27.5	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	76%	0.759	S	S	*	*			trans	-158.6	143.3	142	-119.8	-49.1	0	0	0	113.7
374	N	25.2	Very low	27.6	Very low	135 Å²	135	148.5 Å²	148.5	72%	0.722	77%	0.765	S	S	*	*			trans	-74	156.2	171.6	-62.9	-81	0	0	0	110.3
375	N	30.9	Very low	27.6	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	77%	0.767	S	S	*	*				-166.7	153.1	109.7	-104	-54.4	0	0	0	115.1
376	N	26.2	Very low	27.8	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	76%	0.763	S	S	*	*			trans	-71.6	152.7	176	-53.6	-80.5	0	0	0	112.1
377	N	31.9	Very low	27.6	Very low	151 Å²	151	145.7 Å²	145.7	81%	0.807	76%	0.759	S	S	*	*				174.7	119.5	127.4	-87.9	-24.7	0	0	0	109.4
378	Q	30	Very low	27.9	Very low	142 Å²	142	148.8 Å²	148.8	66%	0.664	77%	0.769	S	S	*	*				90.5	93.1	69	-84.4	-102.4	-1.9	0	0	114.2
379	N	26.3	Very low	27.8	Very low	127 Å²	127	144.4 Å²	144.4	68%	0.679	76%	0.763	S	S	*	*			trans	65.9	173.4	136.6	-69.1	-38.6	0	0	0	121
380	Y	29.2	Very low	28.2	Very low	205 Å²	205	147.8 Å²	147.8	80%	0.804	78%	0.776	S	S	*	*			trans	77.3	135.1	176	-59.8	-82.7	0	0	0	116.3
381	L	28.7	Very low	28.3	Very low	152 Å²	152	149 Å²	149	80%	0.796	78%	0.778	S	S	*	*			cis	-156.4	162.1	-12.3	-172.6	55.8	0	0	0	111.8
382	S	24.4	Very low	28.4	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	78%	0.775	S	S	*	*			trans	-77	148.5	-176.3	-31.5	0	0	0	0	117.2
383	S	31.3	Very low	28.5	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	75%	0.753	S	S	*	*			trans	-172.3	124.7	138.1	49.2	0	0	0	0	109
384	Q	26.8	Very low	28.7	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	74%	0.743	S	S	*	*				50.8	117.1	75	-67.4	-174.6	-26	0	0	111.9
385	I	31.5	Very low	29	Very low	156 Å²	156	141.9 Å²	141.9	80%	0.8	73%	0.725	S	S	*	*				-153.2	136	67	-75	145.3	0	0	0	107.3
386	Q	28.5	Very low	28.9	Very low	153 Å²	153	145.1 Å²	145.1	72%	0.715	73%	0.727	S	S	*	*			cis	85.5	107.3	48.6	-145.7	-177.9	8.5	0	0	115.3
387	N	26.5	Very low	29.2	Very low	133 Å²	133	146 Å²	146	71%	0.711	73%	0.732	S	S	*	*			trans	61.1	157.9	155	-64	27.4	0	0	0	119.5
388	D	31.3	Very low	29.1	Very low	151 Å²	151	141.7 Å²	141.7	81%	0.807	72%	0.723	S	S	*	*			cis	-142.6	176.2	22.1	-89.3	-54.2	0	0	0	113.7
389	D	25.3	Very low	29.2	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	73%	0.732	S	S	*	*			trans	-72.4	158.7	178.9	-75.2	-65	0	0	0	116.6
390	H	31.8	Very low	29.2	Very low	200 Å²	200	146 Å²	146	93%	0.926	74%	0.739	S	S	*	*			trans	-171.2	151.8	137	-89.1	-30.6	0	0	0	113.8
391	Q	27.5	Very low	29.4	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	74%	0.738	S	S	*	*			trans	-123.1	150.2	-175	-58.6	178.4	0.6	0	0	114
392	V	28.2	Very low	29.4	Very low	121 Å²	121	142.2 Å²	142.2	73%	0.733	74%	0.737	S	S	*	*			trans	-148.7	160.2	159.5	-165.5	0	0	0	0	110.9	Q478	V392-Q478 HydrophobicContact CG1-CG 4.21Å
393	Y	27	Very low	29.4	Very low	96 Å²	96	147.4 Å²	147.4	38%	0.376	74%	0.742	S	S	.	*			trans	-141.1	136.1	-144	-163.7	-67.1	0	0	0	117.1	Q478 Q479 H480 Q481	Y393-Q478 VanDerWaalsContact C-CD 3.42Å; Y393-Q478 CarbonylContact O-C 3.59Å; Y393-Q478 WeakPolarHBondContact O-CA 3.44Å; Y393-Q478 WeakPolarHBondContact O-CB 3.49Å; Y393-Q478 VanDerWaalsContact O-CD 3.3Å; Y393-Q478 PolarHBondContact O-OE1 3.03Å; Y393-Q478 VanDerWaalsContact O-OE1 3.11Å; Y393-Q479 PolarHBondContact O-N 3.26Å; Y393-H480 AromaticContact CD1-CE1 3.73Å; Y393-H480 AromaticContact CD1-ND1 3.23Å; Y393-H480 WeakPolarHBondContact CD1-ND1 3.34Å; Y393-H480 AromaticContact CD2-CE1 3.98Å; Y393-H480 AromaticContact CE1-CE1 3.67Å; Y393-H480 AromaticContact CE1-ND1 3.28Å; Y393-H480 VanDerWaalsContact CE1-ND1 3.28Å; Y393-H480 WeakPolarHBondContact CE1-ND1 3.39Å; Y393-H480 AromaticContact CE2-CE1 3.89Å; Y393-H480 AromaticContact CG-CE1 3.91Å; Y393-H480 AromaticContact CG-ND1 3.81Å; Y393-H480 AromaticContact CZ-CE1 3.76Å; Y393-H480 AromaticContact CZ-ND1 3.86Å; Y393-Q481 HydrophobicContact CE1-CG 4.01Å; Y393-Q481 VanDerWaalsContact OH-CG 3.3Å; Y393-Q481 WeakPolarHBondContact OH-CG 3.46Å; Y393-Q481 PolarHBondContact OH-NE2 3.22Å
394	F	33.3	Very low	29.3	Very low	142 Å²	142	151.5 Å²	151.5	62%	0.623	75%	0.749	S	S	*	*			trans	-50.3	168.2	-176.5	-77	-87.1	0	0	0	122.6	Q478 Q479	F394-Q478 VanDerWaalsContact CA-OE1 3.29Å; F394-Q478 VanDerWaalsContact N-OE1 3.1Å; F394-Q479 CarbonylContact O-C 3.55Å; F394-Q479 VanDerWaalsContact O-C 3.31Å; F394-Q479 WeakPolarHBondContact O-CA 3.31Å; F394-Q479 PolarHBondContact O-N 3.15Å
395	P	32.2	Very low	29.2	Very low	54 Å²	54	151.5 Å²	151.5	35%	0.351	75%	0.749	S	S	.	*				-154.5	-172	127.3	47.9	-27.7	0	0	0	116.7	Q478 Q479	P395-Q478 VanDerWaalsContact CD-CA 3.49Å; P395-Q479 VanDerWaalsContact CB-O 3.31Å; P395-Q479 WeakPolarHBondContact CB-O 3.49Å; P395-Q479 WeakPolarHBondContact CG-O 3.42Å
396	Y	29.5	Very low	29	Very low	221 Å²	221	151.8 Å²	151.8	87%	0.867	75%	0.752	S	S	*	*			trans	-88.4	165.9	151.7	-96.1	-131.2	0	0	0	112.1
397	N	32.1	Very low	28.8	Very low	152 Å²	152	149.3 Å²	149.3	81%	0.813	75%	0.747	S	S	*	*			trans	-150.4	146	130.6	-137.3	-8	0	0	0	111.2
398	G	29.2	Very low	28.8	Very low	60 Å²	60	152.2 Å²	152.2	62%	0.619	75%	0.75	S	S	*	*			trans	-141	147.3	178.8	0	0	0	0	0	110.9
399	H	33.3	Very low	28.6	Very low	183 Å²	183	153 Å²	153	85%	0.847	75%	0.746	S	S	*	*			trans	-135.1	136.2	-177.1	-101.2	-78.6	0	0	0	113.9
400	H	26.6	Very low	28.7	Very low	177 Å²	177	153.2 Å²	153.2	82%	0.819	74%	0.742	S	S	*	*			trans	-72.8	141.7	172	-104.8	-66	0	0	0	112.8
401	S	32.6	Very low	28.7	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	73%	0.733	S	S	*	*			trans	-160.2	101.2	141.2	-78.4	0	0	0	0	107.1
402	Q	28.4	Very low	28.7	Very low	166 Å²	166	148.1 Å²	148.1	78%	0.776	73%	0.728	S	S	*	*				76	114.7	87.3	-81.6	-159.5	-22	0	0	114.8
403	Y	23.9	Very low	29	Very low	213 Å²	213	150.3 Å²	150.3	84%	0.835	73%	0.734	S	S	*	*			trans	12.2	128	152.3	-60.7	-91.2	0	0	0	119.9
404	Q	29.3	Very low	29.3	Very low	192 Å²	192	156.3 Å²	156.3	90%	0.897	76%	0.757	S	S	*	*				-157.6	154.4	98.7	-106.7	172.5	24.9	0	0	112.6
405	Q	24.6	Very low	29.4	Very low	177 Å²	177	154.5 Å²	154.5	83%	0.827	76%	0.76	S	S	*	*			trans	-82.5	146.8	169.5	-61.8	162.9	-55.9	0	0	109.3
406	N	28.4	Very low	29.5	Very low	162 Å²	162	158.6 Å²	158.6	87%	0.866	78%	0.779	S	S	*	*			trans	-161.2	164.5	132.3	-110.1	-44.3	0	0	0	112.7
407	T	24.8	Very low	29.8	Very low	100 Å²	100	154.9 Å²	154.9	61%	0.613	77%	0.774	S	S	*	*			trans	-120.7	163.3	-163	-45.1	0	0	0	0	111.1
408	Y	26.4	Very low	29.9	Very low	194 Å²	194	154.4 Å²	154.4	76%	0.761	77%	0.77	S	S	*	*			trans	102.2	115	154.1	-61.5	-62.1	0	0	0	120.6
409	K	26.5	Very low	30.2	Very low	168 Å²	168	158.6 Å²	158.6	73%	0.73	78%	0.777	S	S	*	*				82.6	130.2	122.8	-74.6	-169.9	171.8	-163.4	0	122.3
410	H	27.8	Very low	29.9	Very low	148 Å²	148	156.7 Å²	156.7	69%	0.685	77%	0.773	S	S	*	*			trans	64.9	158.4	137.8	-80.6	-104	0	0	0	117.9
411	D	31.2	Very low	30.2	Very low	136 Å²	136	159.3 Å²	159.3	73%	0.727	78%	0.777	S	S	*	*			cis	-136.3	174.8	10.9	-102.7	-49.1	0	0	0	112.2
412	D	28.1	Very low	30.1	Very low	138 Å²	138	159.1 Å²	159.1	74%	0.738	78%	0.776	S	S	*	*			trans	-69.1	167.2	176.4	-58.4	-80.4	0	0	0	115.2
413	I	33.2	Very low	30.2	Very low	167 Å²	167	160.7 Å²	160.7	86%	0.856	78%	0.78	S	S	*	*			trans	-167.1	129	133.9	-97.4	148.7	0	0	0	111.4
414	Y	33.6	Very low	30.6	Very low	222 Å²	222	158.2 Å²	158.2	87%	0.871	78%	0.782	S	S	*	*			trans	-118.7	159.6	162.2	-102.2	-79.3	0	0	0	107.9
415	P	36.1	Very low	30.6	Very low	104 Å²	104	155.2 Å²	155.2	68%	0.675	78%	0.776	S	S	*	*				-155	146	109.1	36.1	-17.1	0	0	0	118.4
416	N	33.7	Very low	30.7	Very low	140 Å²	140	153.4 Å²	153.4	75%	0.749	77%	0.772	S	S	*	*			trans	50.8	133.7	134.9	-58	-21.8	0	0	0	123.4
417	N	35.6	Very low	30.6	Very low	143 Å²	143	152.9 Å²	152.9	77%	0.765	76%	0.764	S	S	*	*				-166.3	125.2	104.7	-92.7	-28.9	0	0	0	114.1
418	L	34.3	Very low	30.7	Very low	142 Å²	142	156 Å²	156	74%	0.743	77%	0.771	S	S	*	*			trans	42.2	142.7	136.3	-79.4	62.5	0	0	0	120.6
419	I	35.5	Very low	31.1	Very low	147 Å²	147	154.6 Å²	154.6	75%	0.754	77%	0.772	S	S	*	*			cis	-152.1	161.8	19.2	-113.1	151	0	0	0	111.4
420	N	28.5	Very low	31.2	Very low	144 Å²	144	154.3 Å²	154.3	77%	0.77	77%	0.771	S	S	*	*			trans	-82.1	164.3	178.7	-60	-55.4	0	0	0	115
421	Y	31	Very low	31.3	Very low	232 Å²	232	153.1 Å²	153.1	91%	0.91	77%	0.765	S	S	*	*				-158.7	169.1	114.7	-105.7	-68.7	0	0	0	111.8
422	S	32.4	Very low	31.2	Very low	107 Å²	107	154.7 Å²	154.7	75%	0.748	77%	0.769	S	S	*	*			trans	-131.3	165.6	-147	56.7	0	0	0	0	117.6
423	K	29.7	Very low	31.3	Very low	198 Å²	198	157.2 Å²	157.2	86%	0.861	78%	0.776	S	S	*	*			trans	-60.5	152.5	-178.8	-62.7	177.9	176.1	179.9	0	116.1
424	N	32.5	Very low	30.9	Very low	162 Å²	162	156.7 Å²	156.7	87%	0.866	77%	0.77	S	S	*	*			trans	-177.8	154.7	153.5	-103.8	-9.7	0	0	0	108
425	T	29.8	Very low	30.4	Very low	128 Å²	128	153.4 Å²	153.4	79%	0.785	76%	0.762	S	S	*	*			cis	-143.4	-164.4	-1.9	-73.5	0	0	0	0	108.6
426	L	26.5	Very low	30	Very low	139 Å²	139	156.1 Å²	156.1	73%	0.728	77%	0.77	S	S	*	*			trans	-107.4	161.9	-174.4	-78	157.3	0	0	0	115.3
427	Q	26.5	Very low	29.5	Very low	152 Å²	152	154.6 Å²	154.6	71%	0.71	77%	0.77	S	S	*	*			trans	84.1	140	137.7	-84.5	158.8	-26.6	0	0	124.2
428	Q	26.5	Very low	29.1	Very low	164 Å²	164	153.1 Å²	153.1	77%	0.766	77%	0.77	S	S	*	*			trans	68.9	140	153.4	-74.9	163.1	-40.2	0	0	118
429	E	34.4	Very low	28.7	Very low	165 Å²	165	151.2 Å²	151.2	77%	0.771	77%	0.769	S	S	*	*			cis	-127.6	165.5	-4.6	-87.1	132.3	170.4	0	0	109
430	K	29.5	Very low	28.2	Very low	163 Å²	163	150.5 Å²	150.5	71%	0.709	77%	0.772	S	S	*	*				54.3	137.3	61.5	-94	-177.3	160.6	-123.8	0	113.4
431	E	29.4	Very low	28.2	Very low	122 Å²	122	151.1 Å²	151.1	57%	0.57	77%	0.774	S	S	*	*			cis	-161.6	154.2	4.2	-148.8	151.7	-168.4	0	0	110.5
432	E	27.6	Very low	28.1	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	77%	0.77	S	S	*	*			trans	57.7	167.2	161.4	-74.9	154.6	-178.9	0	0	118.2
433	E	30.4	Very low	27.6	Very low	191 Å²	191	147.2 Å²	147.2	89%	0.893	77%	0.768	S	S	*	*			cis	-142.2	-175.3	18.7	-155.1	169.8	-149.6	0	0	112.1
434	E	25.4	Very low	27.5	Very low	155 Å²	155	144.4 Å²	144.4	72%	0.724	76%	0.762	S	S	*	*			trans	-112.9	165.6	-163.4	-157.1	-168.2	-124	0	0	114.4
435	Q	24.3	Very low	27.3	Very low	153 Å²	153	145.3 Å²	145.3	72%	0.715	77%	0.766	S	S	*	*			trans	70.3	122.8	163	-44.7	-177	14.7	0	0	119.3
436	I	27	Very low	27.1	Very low	162 Å²	162	148.8 Å²	148.8	83%	0.831	77%	0.766	S	S	*	*				178.3	140.4	102.7	-90.9	168.1	0	0	0	110.1
437	S	23.6	Very low	27.1	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	76%	0.764	S	S	*	*			trans	-72.4	142.5	176.2	-49.4	0	0	0	0	112.8
438	S	26.1	Very low	27.1	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	76%	0.764	S	S	*	*				179.2	122.8	124.4	-80.6	0	0	0	0	114.4
439	S	25.2	Very low	27.4	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	77%	0.77	S	S	*	*			trans	16.5	127.9	146	61.4	0	0	0	0	121.7
440	T	26.9	Very low	27.2	Very low	132 Å²	132	147.4 Å²	147.4	81%	0.81	78%	0.775	S	S	*	*			trans	72.8	109.1	140.9	-48.3	0	0	0	0	118.8
441	L	27.1	Very low	27.2	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	77%	0.773	S	S	*	*				-165.6	163.5	125.7	-107.4	170.4	0	0	0	111.4
442	L	28.8	Very low	27.2	Very low	157 Å²	157	148.3 Å²	148.3	82%	0.822	79%	0.79	S	S	*	*			trans	63.5	64.5	165	-64.2	164.4	0	0	0	118.2
443	S	23.4	Very low	27.2	Very low	100 Å²	100	148.5 Å²	148.5	70%	0.699	80%	0.796	S	S	*	*			trans	-67.9	152.7	134.7	54.6	0	0	0	0	110.1
444	N	25.8	Very low	27.1	Very low	139 Å²	139	147.4 Å²	147.4	74%	0.743	79%	0.79	S	S	*	*			trans	94.5	67.5	177.2	-52.5	-12.8	0	0	0	117
445	L	29.5	Very low	27.4	Very low	181 Å²	181	145.2 Å²	145.2	95%	0.948	79%	0.788	S	S	*	*			trans	-121.1	133	134.2	-79.7	177.8	0	0	0	109.1
446	Y	25.9	Very low	27.9	Very low	201 Å²	201	146.8 Å²	146.8	79%	0.788	79%	0.792	S	S	*	*			trans	-90.3	145.4	-169.3	-120	-125.3	0	0	0	111.5
447	N	25.5	Very low	28.1	Very low	127 Å²	127	145.2 Å²	145.2	68%	0.679	79%	0.79	S	S	*	*			trans	66.4	160.8	150.8	-67.8	9.1	0	0	0	121.1
448	N	27.2	Very low	28.4	Very low	132 Å²	132	147 Å²	147	71%	0.706	79%	0.788	S	S	*	*			trans	69.6	89.6	163.2	-57.4	-9.3	0	0	0	117.3
449	N	32.6	Very low	28.6	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	79%	0.789	S	S	*	*				-164.5	98.2	114.8	-94.1	-30.5	0	0	0	110.5
450	D	30.9	Very low	29	Very low	164 Å²	164	149.4 Å²	149.4	88%	0.877	79%	0.793	S	S	*	*			trans	-68.4	149.3	165.3	-68.4	-73	0	0	0	111.1
451	G	28.1	Very low	29.1	Very low	64 Å²	64	151 Å²	151	66%	0.66	79%	0.794	S	S	*	*			trans	143.1	47.5	166.6	0	0	0	0	0	118.4
452	Y	29.9	Very low	29.2	Very low	240 Å²	240	154.9 Å²	154.9	94%	0.941	80%	0.798	S	S	*	*	S	Bend	trans	-150.3	39.4	161.7	-101.9	-63.6	0	0	0	114.1
453	L	28.4	Very low	29.2	Very low	174 Å²	174	155 Å²	155	91%	0.911	80%	0.798	S	S	*	*			trans	-140.7	40.4	-170.3	-119.7	162.2	0	0	0	115
454	H	28	Very low	29.4	Very low	168 Å²	168	159.3 Å²	159.3	78%	0.778	81%	0.807	S	S	*	*	S	Bend	trans	-143.1	49.4	-178.7	-158.4	-70.5	0	0	0	114.4
455	T	30.3	Very low	29.5	Very low	110 Å²	110	158.6 Å²	158.6	68%	0.675	81%	0.813	S	S	*	*	S	Bend	trans	-146.6	-23.1	-178.2	-33.7	0	0	0	0	116.8
456	K	35.1	Very low	29.6	Very low	185 Å²	185	158 Å²	158	80%	0.804	81%	0.808	S	S	*	*	S	Bend	trans	-91.2	-0.1	-170	-86	-165.3	170.7	-167.7	0	117.8
457	V	32.4	Very low	29.6	Very low	130 Å²	130	156.3 Å²	156.3	79%	0.788	81%	0.813	S	S	*	*	S	Bend	trans	-92.9	-21.5	174.1	179.2	0	0	0	0	112.6
458	M	30	Very low	29.8	Very low	143 Å²	143	159.7 Å²	159.7	70%	0.704	83%	0.825	S	S	*	*	G	3₁₀ helix	trans	-78.9	-18.7	-173.4	-76	-90.6	-160.7	0	0	115.3
459	N	30.8	Very low	30.1	Very low	150 Å²	150	157.9 Å²	157.9	80%	0.802	83%	0.828	S	S	*	*	G	3₁₀ helix	trans	-90.3	3.9	-171.8	-81.1	-3.3	0	0	0	115.5
460	S	32	Very low	30	Very low	115 Å²	115	158.1 Å²	158.1	80%	0.804	83%	0.829	S	S	*	*	G	3₁₀ helix	trans	-97.6	-6	178.3	-151	0	0	0	0	114.2
461	M	29.1	Very low	30	Very low	167 Å²	167	160 Å²	160	82%	0.823	83%	0.832	S	S	*	*			trans	-114.9	82.1	178	-72	-172.3	-74.6	0	0	111.4
462	R	30.3	Very low	30.2	Very low	239 Å²	239	160 Å²	160	90%	0.902	83%	0.832	S	S	*	*			trans	-119.8	39.6	176.5	-146.2	177.9	-166.8	-178.1	4.4	114.1
463	L	28.1	Very low	30.4	Very low	159 Å²	159	154.6 Å²	154.6	83%	0.832	83%	0.829	S	S	*	*			trans	-140.3	102.5	166.6	-78.4	177.6	0	0	0	109.7
464	H	27.2	Very low	30.4	Very low	191 Å²	191	153.6 Å²	153.6	88%	0.884	83%	0.825	S	S	*	*			trans	154.7	89.5	150.6	-90.8	79.7	0	0	0	110
465	S	28.3	Very low	30.7	Very low	124 Å²	124	153.9 Å²	153.9	87%	0.867	83%	0.827	S	S	*	*			trans	-168.5	44.3	166.1	-81	0	0	0	0	113.3
466	I	31.1	Very low	30.9	Very low	167 Å²	167	157.1 Å²	157.1	86%	0.856	83%	0.834	S	S	*	*			trans	-140	84.4	165.2	-53.2	178.9	0	0	0	108.4
467	N	27.2	Very low	30.9	Very low	166 Å²	166	153.8 Å²	153.8	89%	0.888	82%	0.821	S	S	*	*			trans	-163.8	47.8	166.1	-121.5	-3	0	0	0	113.2
468	E	29.2	Very low	31.1	Very low	199 Å²	199	150.8 Å²	150.8	93%	0.93	80%	0.798	S	S	*	*			trans	-152.4	91.2	166.9	-128	170.8	-127.8	0	0	111
469	A	33.5	Very low	31.3	Very low	93 Å²	93	150.3 Å²	150.3	77%	0.769	80%	0.795	S	S	*	*			trans	-149.1	96	175.7	0	0	0	0	0	111.3
470	L	30.8	Very low	31.6	Very low	173 Å²	173	147.7 Å²	147.7	91%	0.906	78%	0.777	S	S	*	*			trans	63.5	97.5	158.1	-64.4	161.3	0	0	0	118.2
471	H	31.1	Very low	31.5	Very low	203 Å²	203	148 Å²	148	94%	0.94	77%	0.766	S	S	*	*			trans	-55.4	134.4	145.6	-70.9	-83.4	0	0	0	110.5
472	G	32.3	Very low	31.6	Very low	65 Å²	65	148.1 Å²	148.1	67%	0.67	77%	0.765	S	S	*	*			trans	-173.7	96.2	175.7	0	0	0	0	0	116.2
473	S	33.2	Very low	31.9	Very low	126 Å²	126	144.6 Å²	144.6	88%	0.881	76%	0.758	S	S	*	*			trans	54.6	117.5	158.8	48	0	0	0	0	120.3
474	N	28.4	Very low	32.1	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	76%	0.755	S	S	*	*			trans	-66.7	151.7	165.8	-52.2	-72.8	0	0	0	112.9
475	Q	34.1	Very low	32.4	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	75%	0.754	S	S	*	*				179.3	112.1	113.6	-95.7	166.9	31.8	0	0	113.9
476	Q	34.5	Very low	32.6	Very low	177 Å²	177	142 Å²	142	83%	0.827	75%	0.751	S	S	*	*				41.9	163.3	126.9	-62.8	177	0.8	0	0	123.3
477	Q	35.2	Very low	32.5	Very low	116 Å²	116	142.7 Å²	142.7	54%	0.542	75%	0.75	S	S	.	*			cis	172.3	174	-41.4	-123.7	-172.9	-8.5	0	0	110.2
478	Q	36.9	Very low	32.7	Very low	66 Å²	66	143 Å²	143	31%	0.308	75%	0.746	S	S	.	*			trans	83.7	123.8	162.6	-38.4	-47	43.8	0	0	127.3	V392 Y393 F394 P395	V392-Q478 HydrophobicContact CG1-CG 4.21Å; Y393-Q478 VanDerWaalsContact C-CD 3.42Å; Y393-Q478 CarbonylContact O-C 3.59Å; Y393-Q478 WeakPolarHBondContact O-CA 3.44Å; Y393-Q478 WeakPolarHBondContact O-CB 3.49Å; Y393-Q478 VanDerWaalsContact O-CD 3.3Å; Y393-Q478 PolarHBondContact O-OE1 3.03Å; Y393-Q478 VanDerWaalsContact O-OE1 3.11Å; F394-Q478 VanDerWaalsContact CA-OE1 3.29Å; F394-Q478 VanDerWaalsContact N-OE1 3.1Å; P395-Q478 VanDerWaalsContact CD-CA 3.49Å
479	Q	34.4	Very low	32.8	Very low	134 Å²	134	141.3 Å²	141.3	63%	0.626	74%	0.738	S	S	*	*			trans	63.6	127.1	174.3	-59.9	-170.6	71.9	0	0	122.1	Y393 F394 P395	Y393-Q479 PolarHBondContact O-N 3.26Å; F394-Q479 CarbonylContact O-C 3.55Å; F394-Q479 VanDerWaalsContact O-C 3.31Å; F394-Q479 WeakPolarHBondContact O-CA 3.31Å; F394-Q479 PolarHBondContact O-N 3.15Å; P395-Q479 VanDerWaalsContact CB-O 3.31Å; P395-Q479 WeakPolarHBondContact CB-O 3.49Å; P395-Q479 WeakPolarHBondContact CG-O 3.42Å
480	H	35.9	Very low	32.7	Very low	94 Å²	94	145.1 Å²	145.1	44%	0.435	74%	0.74	S	S	.	*			cis	-143.7	-93.2	3	-146.1	41.7	0	0	0	119.7	Y393	Y393-H480 AromaticContact CD1-CE1 3.73Å; Y393-H480 AromaticContact CD1-ND1 3.23Å; Y393-H480 WeakPolarHBondContact CD1-ND1 3.34Å; Y393-H480 AromaticContact CD2-CE1 3.98Å; Y393-H480 AromaticContact CE1-CE1 3.67Å; Y393-H480 AromaticContact CE1-ND1 3.28Å; Y393-H480 VanDerWaalsContact CE1-ND1 3.28Å; Y393-H480 WeakPolarHBondContact CE1-ND1 3.39Å; Y393-H480 AromaticContact CE2-CE1 3.89Å; Y393-H480 AromaticContact CG-CE1 3.91Å; Y393-H480 AromaticContact CG-ND1 3.81Å; Y393-H480 AromaticContact CZ-CE1 3.76Å; Y393-H480 AromaticContact CZ-ND1 3.86Å
481	Q	31	Very low	32.8	Very low	122 Å²	122	142.1 Å²	142.1	57%	0.57	72%	0.724	S	S	*	*			trans	-154.4	151.6	-152.8	-70.1	170.8	-7.4	0	0	119.4	Y393	Y393-Q481 HydrophobicContact CE1-CG 4.01Å; Y393-Q481 VanDerWaalsContact OH-CG 3.3Å; Y393-Q481 WeakPolarHBondContact OH-CG 3.46Å; Y393-Q481 PolarHBondContact OH-NE2 3.22Å
482	Q	31.4	Very low	32.6	Very low	169 Å²	169	139 Å²	139	79%	0.79	72%	0.715	S	S	*	*				178.2	149.6	116.2	-98.9	-176.1	30.6	0	0	115.6
483	H	36.6	Very low	32.9	Very low	165 Å²	165	139.8 Å²	139.8	76%	0.764	71%	0.706	S	S	*	*			trans	53	119.4	169.6	-74.4	-73.1	0	0	0	121.7
484	P	31.3	Very low	32.6	Very low	118 Å²	118	141 Å²	141	77%	0.766	70%	0.703	S	S	*	*			trans	-91.8	144.5	163.7	35.5	-31.3	0	0	0	113
485	H	34.9	Very low	33.1	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.866	70%	0.695	S	S	*	*			trans	-129.4	143.8	162.1	-108.1	30.1	0	0	0	109.2	Q487	H485-Q487 PolarHBondContact O-N 3.32Å
486	S	31	Very low	33.4	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	69%	0.687	S	S	*	*			trans	-64.3	104.1	-170.7	-54.2	0	0	0	0	111.9	H488	S486-H488 PolarHBondContact O-N 3.27Å
487	Q	29.6	Very low	33.4	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	68%	0.681	S	S	*	*			trans	-75	102.5	166.1	-72.2	-174.2	-12.8	0	0	108.8	H485 Q489	H485-Q487 PolarHBondContact O-N 3.32Å; Q487-Q489 PolarHBondContact O-N 2.9Å
488	H	32	Very low	33.8	Very low	173 Å²	173	135.2 Å²	135.2	80%	0.801	68%	0.684	S	S	*	*			trans	-59.7	108.4	159.6	-74.8	-61.3	0	0	0	108	S486 Q490	S486-H488 PolarHBondContact O-N 3.27Å; H488-Q490 PolarHBondContact O-N 3.47Å
489	Q	31.5	Very low	34	Very low	163 Å²	163	140 Å²	140	76%	0.762	71%	0.706	S	S	*	*			trans	-68.6	90.6	163.1	-74.4	-172.8	-10	0	0	107.6	Q487 L491	Q487-Q489 PolarHBondContact O-N 2.9Å; Q489-L491 VanDerWaalsContact C-N 3.32Å; Q489-L491 PolarHBondContact O-N 3.48Å
490	Q	30.7	Very low	34.3	Very low	174 Å²	174	142.3 Å²	142.3	81%	0.813	71%	0.714	S	S	*	*			trans	-58.2	101.3	162.6	-71.3	179.7	-20.1	0	0	106.9	H488 N492	H488-Q490 PolarHBondContact O-N 3.47Å; Q490-N492 PolarHBondContact O-N 3.39Å
491	L	32.6	Very low	34.4	Very low	109 Å²	109	141.8 Å²	141.8	57%	0.571	72%	0.721	S	S	*	*			trans	-64.2	90.2	164.6	-76.1	174.4	0	0	0	106.5	Q489 V493 Y580	Q489-L491 VanDerWaalsContact C-N 3.32Å; Q489-L491 PolarHBondContact O-N 3.48Å; L491-V493 PolarHBondContact O-N 3.07Å; L491-Y580 HydrophobicContact CD1-CD1 3.85Å; L491-Y580 HydrophobicContact CD1-CE1 4.32Å
492	N	27.6	Very low	35.4	Very low	139 Å²	139	140.4 Å²	140.4	74%	0.743	72%	0.718	S	S	*	*			trans	-68.5	85.7	-177.6	-169.7	24.3	0	0	0	107.7	Q490 N494	Q490-N492 PolarHBondContact O-N 3.39Å; N492-N494 PolarHBondContact O-N 2.9Å
493	V	37.5	Very low	36.5	Very low	80 Å²	80	139.7 Å²	139.7	49%	0.485	72%	0.72	S	S	.	*			trans	-55.3	109.1	-180	178.6	0	0	0	0	106.8	L491 Y495	L491-V493 PolarHBondContact O-N 3.07Å; V493-Y495 VanDerWaalsContact C-N 3.33Å; V493-Y495 WeakPolarHBondContact O-CD2 3.49Å; V493-Y495 PolarHBondContact O-N 3.33Å
494	N	28	Very low	37.8	Very low	151 Å²	151	136.6 Å²	136.6	81%	0.807	70%	0.704	S	S	*	*			trans	-66.6	95.2	-175.2	-171.4	13.1	0	0	0	108.6	N492 K496	N492-N494 PolarHBondContact O-N 2.9Å; N494-K496 PolarHBondContact O-N 3Å
495	Y	37.8	Very low	40	Very low	169 Å²	169	138.5 Å²	138.5	66%	0.663	70%	0.7	S	S	*	*			trans	-47.2	131.8	169.6	-62.1	-88.5	0	0	0	107.9	V493 G497	V493-Y495 VanDerWaalsContact C-N 3.33Å; V493-Y495 WeakPolarHBondContact O-CD2 3.49Å; V493-Y495 PolarHBondContact O-N 3.33Å; Y495-G497 WeakPolarHBondContact O-CA 3.3Å; Y495-G497 PolarHBondContact O-N 3.43Å
496	K	41.5	Very low	42.6	Very low	148 Å²	148	130.4 Å²	130.4	64%	0.643	66%	0.664	S	S	*	*	S	Bend	trans	-46.3	121	166.9	-100.1	-168	174.3	-173.7	0	106.9	N494 L498	N494-K496 PolarHBondContact O-N 3Å; K496-L498 VanDerWaalsContact C-N 3.3Å; K496-L498 PolarHBondContact O-N 2.88Å
497	G	33.2	Very low	45.7	Very low	68 Å²	68	127.8 Å²	127.8	70%	0.701	64%	0.636	S	S	*	*			trans	-64.2	77.3	-154.9	0	0	0	0	0	116.1	Y495 E499	Y495-G497 WeakPolarHBondContact O-CA 3.3Å; Y495-G497 PolarHBondContact O-N 3.43Å; G497-E499 PolarHBondContact O-N 3.42Å
498	L	45.3	Very low	48.9	Very low	114 Å²	114	119.1 Å²	119.1	60%	0.597	60%	0.596	S	S	*	*			trans	-73.4	63.4	140	-71.2	102.1	0	0	0	108.5	K496 T506	K496-L498 VanDerWaalsContact C-N 3.3Å; K496-L498 PolarHBondContact O-N 2.88Å; L498-T506 HydrophobicContact CD2-CG2 4.41Å
499	E	40	Very low	52.1	Low	167 Å²	167	110.9 Å²	110.9	78%	0.78	56%	0.558	S	S	*	*			trans	-54	146.7	142.4	-69.2	-167	145.1	0	0	107.4	G497 S501	G497-E499 PolarHBondContact O-N 3.42Å; E499-S501 PolarHBondContact O-N 2.88Å
500	K	40.4	Very low	55.3	Low	182 Å²	182	103.2 Å²	103.2	79%	0.791	52%	0.522	S	S	*	.			trans	-73.2	75.8	-178.1	-65.4	179.1	-178.7	175.8	0	110.9	D502	K500-D502 PolarHBondContact O-N 3.35Å
501	S	38.7	Very low	58.5	Low	83 Å²	83	95 Å²	95	58%	0.58	48%	0.484	S	S	*	.			trans	-67	84.9	151.3	53.1	0	0	0	0	106.9	E499 D503 K504	E499-S501 PolarHBondContact O-N 2.88Å; S501-D503 PolarHBondContact O-N 3.45Å; S501-K504 PolarHBondContact O-N 2.93Å; S501-K504 VanDerWaalsContact O-N 3.13Å
502	D	51.7	Low	61.7	Low	93 Å²	93	90.1 Å²	90.1	50%	0.497	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-7	-159.4	-111.5	-54.5	0	0	0	114.9	K500 K795	K500-D502 PolarHBondContact O-N 3.35Å; D502-K795 PolarHBondContact O-NZ 3.4Å; D502-K795 IonicContact OD1-NZ 3Å; D502-K795 PolarHBondContact OD1-NZ 3.41Å
503	D	55.8	Low	65.1	Low	155 Å²	155	83.5 Å²	83.5	83%	0.829	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-10.9	-178.9	-60.2	-47.8	0	0	0	115.4	S501 F505	S501-D503 PolarHBondContact O-N 3.45Å; D503-F505 PolarHBondContact O-N 2.82Å
504	K	63.5	Low	67.9	Low	99 Å²	99	80.6 Å²	80.6	43%	0.43	41%	0.405	S	S	.	.			trans	-88.9	108.2	-177.3	-157.8	-175.3	-171.9	-167	0	111.6	S501 T506 E740	S501-K504 PolarHBondContact O-N 2.93Å; S501-K504 VanDerWaalsContact O-N 3.13Å; K504-T506 PolarHBondContact O-N 3.21Å; K504-E740 IonicContact NZ-OE2 2.62Å
505	F	76	Confident	71.2	Confident	158 Å²	158	74.7 Å²	74.7	69%	0.693	37%	0.372	S	S	*	.			trans	-57.6	136.6	169.2	-68.2	-85.9	0	0	0	110.7	D503 K795	D503-F505 PolarHBondContact O-N 2.82Å; F505-K795 WeakPolarHBondContact CD1-O 3.37Å
506	T	90.3	Very high	74.1	Confident	17 Å²	17	66.6 Å²	66.6	10%	0.104	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136	175.2	-56.6	0	0	0	0	109.3	L498 K504 I508 D741 V743 C796 T797	L498-T506 HydrophobicContact CD2-CG2 4.41Å; K504-T506 PolarHBondContact O-N 3.21Å; T506-I508 HydrophobicContact CG2-CD1 3.84Å; T506-D741 CarbonylContact C-O 3.22Å; T506-D741 VanDerWaalsContact CA-O 3.29Å; T506-D741 WeakPolarHBondContact CA-O 3.28Å; T506-D741 WeakPolarHBondContact CG2-O 3.23Å; T506-V743 HydrophobicContact CG2-CG2 4.06Å; T506-C796 CarbonylContact O-C 3.55Å; T506-C796 VanDerWaalsContact O-CA 3.24Å; T506-C796 WeakPolarHBondContact O-CA 3.31Å; T506-C796 WeakPolarHBondContact O-CB 3.42Å; T506-T797 PolarHBondContact O-N 3.17Å
507	R	95.8	Very high	76.9	Confident	60 Å²	60	59.6 Å²	59.6	23%	0.226	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.9	176.1	-161.7	-174.4	-68.7	-109.2	28.9	110.8	F509 D741 S742 V743 T797 V799 Y838 L839	R507-F509 HydrophobicContact CB-CE2 4.22Å; R507-F509 VanDerWaalsContact CD-CE2 3.48Å; R507-F509 HydrophobicContact CG-CD2 4.39Å; R507-F509 HydrophobicContact CG-CE2 3.9Å; R507-F509 HydrophobicContact CG-CZ 4.14Å; R507-D741 PolarHBondContact N-O 3.1Å; R507-S742 CarbonylContact O-C 3.56Å; R507-S742 VanDerWaalsContact O-CA 3.3Å; R507-S742 WeakPolarHBondContact O-CA 3.32Å; R507-V743 PolarHBondContact O-N 3.38Å; R507-T797 CarbonylContact C-O 3.41Å; R507-T797 VanDerWaalsContact CA-O 3.29Å; R507-T797 WeakPolarHBondContact CA-O 3.46Å; R507-T797 HydrophobicContact CG-CG2 4.44Å; R507-T797 WeakPolarHBondContact CG-O 3.49Å; R507-V799 HydrophobicContact CG-CG2 4.22Å; R507-Y838 PolarHBondContact NH2-O 3.2Å; R507-L839 VanDerWaalsContact CD-OXT 3.31Å; R507-L839 WeakPolarHBondContact CD-OXT 3.3Å; R507-L839 PolarHBondContact NE-OXT 3.36Å; R507-L839 PolarHBondContact NH2-OXT 3.07Å
508	I	97.8	Very high	79.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.7	-176.9	-53.2	-59	0	0	0	108.4	T506 I510 V743 I745 I788 F792 C796 T797 Y798 V799	T506-I508 HydrophobicContact CG2-CD1 3.84Å; I508-I510 HydrophobicContact CG2-CG1 4.03Å; I508-V743 HydrophobicContact CD1-CB 3.84Å; I508-V743 HydrophobicContact CD1-CG2 4Å; I508-I745 HydrophobicContact CG2-CD1 3.38Å; I508-I745 HydrophobicContact CG2-CG1 4.02Å; I508-I788 HydrophobicContact CG2-CG2 4.38Å; I508-F792 HydrophobicContact CD1-CB 4.38Å; I508-F792 HydrophobicContact CD1-CD1 3.52Å; I508-F792 HydrophobicContact CD1-CE1 3.88Å; I508-F792 HydrophobicContact CD1-CG 3.96Å; I508-F792 HydrophobicContact CG1-CB 4.37Å; I508-F792 HydrophobicContact CG1-CD1 4.37Å; I508-F792 HydrophobicContact CG1-CG 4.35Å; I508-C796 HydrophobicContact CG1-CB 3.9Å; I508-T797 PolarHBondContact N-O 3.41Å; I508-Y798 HydrophobicContact CB-CD1 3.61Å; I508-Y798 HydrophobicContact CB-CE1 3.87Å; I508-Y798 HydrophobicContact CB-CG 4.41Å; I508-Y798 HydrophobicContact CG1-CD1 4.05Å; I508-Y798 HydrophobicContact CG1-CE1 3.82Å; I508-Y798 HydrophobicContact CG2-CD1 3.82Å; I508-Y798 HydrophobicContact CG2-CE1 4Å; I508-Y798 CarbonylContact O-C 3.31Å; I508-Y798 WeakPolarHBondContact O-CA 3.31Å; I508-V799 PolarHBondContact O-N 2.82Å
509	F	98.5	Very high	82.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	110.7	176.2	-67.5	-89.2	0	0	0	109	R507 I736 V743 I745 V799 I801 L834 L839	R507-F509 HydrophobicContact CB-CE2 4.22Å; R507-F509 VanDerWaalsContact CD-CE2 3.48Å; R507-F509 HydrophobicContact CG-CD2 4.39Å; R507-F509 HydrophobicContact CG-CE2 3.9Å; R507-F509 HydrophobicContact CG-CZ 4.14Å; F509-I736 HydrophobicContact CB-CD1 4.09Å; F509-I736 HydrophobicContact CB-CG2 4.47Å; F509-I736 HydrophobicContact CD1-CD1 3.77Å; F509-I736 HydrophobicContact CD1-CG1 4.5Å; F509-I736 HydrophobicContact CD2-CB 4.32Å; F509-I736 HydrophobicContact CD2-CD1 3.83Å; F509-I736 HydrophobicContact CD2-CG1 3.88Å; F509-I736 HydrophobicContact CD2-CG2 3.45Å; F509-I736 VanDerWaalsContact CD2-CG2 3.45Å; F509-I736 HydrophobicContact CE1-CD1 4.01Å; F509-I736 HydrophobicContact CE1-CG1 4.41Å; F509-I736 HydrophobicContact CE2-CB 4.45Å; F509-I736 HydrophobicContact CE2-CD1 4.07Å; F509-I736 HydrophobicContact CE2-CG1 3.77Å; F509-I736 HydrophobicContact CE2-CG2 3.88Å; F509-I736 HydrophobicContact CG-CD1 3.63Å; F509-I736 HydrophobicContact CG-CG1 4.22Å; F509-I736 HydrophobicContact CG-CG2 4.17Å; F509-I736 HydrophobicContact CZ-CD1 4.14Å; F509-I736 HydrophobicContact CZ-CG1 4.03Å; F509-V743 PolarHBondContact N-O 2.9Å; F509-I745 PolarHBondContact O-N 2.95Å; F509-V799 WeakPolarHBondContact CA-O 3.34Å; F509-V799 HydrophobicContact CD1-CB 3.99Å; F509-V799 HydrophobicContact CD1-CG1 4.29Å; F509-V799 HydrophobicContact CD1-CG2 4.49Å; F509-V799 HydrophobicContact CE1-CB 4.28Å; F509-V799 HydrophobicContact CE1-CG1 4.45Å; F509-V799 HydrophobicContact CE1-CG2 4.36Å; F509-I801 HydrophobicContact CD1-CD1 3.99Å; F509-L834 HydrophobicContact CE1-CD2 4.09Å; F509-L834 HydrophobicContact CZ-CD2 3.8Å; F509-L839 HydrophobicContact CE1-CB 4.1Å; F509-L839 HydrophobicContact CZ-CB 4.17Å
510	I	98.7	Very high	85.2	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	114.7	179.5	-54.4	176.6	0	0	0	107.7	I508 I745 V747 F785 I788 Y798 V799 V800 I801 W816	I508-I510 HydrophobicContact CG2-CG1 4.03Å; I510-I745 WeakPolarHBondContact CA-O 3.42Å; I510-V747 HydrophobicContact CG2-CB 4.3Å; I510-V747 HydrophobicContact CG2-CG2 3.67Å; I510-F785 HydrophobicContact CD1-CD1 4.49Å; I510-F785 HydrophobicContact CG2-CD1 4.24Å; I510-F785 HydrophobicContact CG2-CE1 3.65Å; I510-F785 HydrophobicContact CG2-CZ 4.19Å; I510-I788 HydrophobicContact CD1-CD1 4.24Å; I510-I788 HydrophobicContact CD1-CG2 3.91Å; I510-I788 HydrophobicContact CG2-CD1 4.4Å; I510-Y798 HydrophobicContact CD1-CD1 4.1Å; I510-V799 PolarHBondContact N-O 2.83Å; I510-V800 HydrophobicContact CB-CG2 4.37Å; I510-V800 HydrophobicContact CD1-CG2 4.39Å; I510-V800 CarbonylContact O-C 3.59Å; I510-V800 WeakPolarHBondContact O-CA 3.31Å; I510-I801 PolarHBondContact O-N 3.46Å; I510-W816 HydrophobicContact CD1-CE3 3.99Å; I510-W816 HydrophobicContact CD1-CH2 4.21Å; I510-W816 HydrophobicContact CD1-CZ3 3.43Å; I510-W816 VanDerWaalsContact CD1-CZ3 3.43Å
511	W	98.8	Very high	87.8	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.8	-176.5	-65.3	89.4	0	0	0	111.4	T516 L517 A732 T733 I736 N744 I745 L746 V747 F768 I801 L830	W511-T516 HydrophobicContact CE3-CG2 4.25Å; W511-L517 HydrophobicContact CB-CD1 4.05Å; W511-L517 HydrophobicContact CD2-CD2 3.97Å; W511-L517 HydrophobicContact CD2-CG 4.41Å; W511-L517 HydrophobicContact CE3-CD1 4.48Å; W511-L517 HydrophobicContact CE3-CD2 3.45Å; W511-L517 VanDerWaalsContact CE3-CD2 3.45Å; W511-L517 HydrophobicContact CE3-CG 3.91Å; W511-L517 HydrophobicContact CG-CD1 4.39Å; W511-L517 HydrophobicContact CH2-CD2 4.18Å; W511-L517 HydrophobicContact CZ3-CD2 3.57Å; W511-L517 HydrophobicContact CZ3-CG 4.43Å; W511-A732 HydrophobicContact CH2-CB 3.84Å; W511-A732 HydrophobicContact CZ2-CB 4.32Å; W511-T733 HydrophobicContact CH2-CG2 4.24Å; W511-T733 HydrophobicContact CZ2-CG2 3.78Å; W511-I736 HydrophobicContact CZ2-CD1 3.76Å; W511-N744 PolarHBondContact NE1-OD1 2.7Å; W511-I745 PolarHBondContact N-O 3.19Å; W511-L746 HydrophobicContact CB-CD1 4.14Å; W511-L746 WeakPolarHBondContact O-CA 3.23Å; W511-V747 PolarHBondContact O-N 3.46Å; W511-F768 HydrophobicContact CB-CZ 4.36Å; W511-F768 AromaticContact CD1-CZ 3.93Å; W511-F768 HydrophobicContact CG-CZ 4.18Å; W511-I801 WeakPolarHBondContact CA-O 3.02Å; W511-I801 HydrophobicContact CD2-CB 4.25Å; W511-I801 HydrophobicContact CD2-CD1 3.98Å; W511-I801 HydrophobicContact CE3-CB 3.88Å; W511-I801 HydrophobicContact CE3-CD1 4.06Å; W511-I801 HydrophobicContact CE3-CG2 3.7Å; W511-I801 HydrophobicContact CH2-CD1 3.91Å; W511-I801 HydrophobicContact CZ2-CD1 3.79Å; W511-I801 HydrophobicContact CZ3-CB 4.29Å; W511-I801 HydrophobicContact CZ3-CD1 4.03Å; W511-I801 HydrophobicContact CZ3-CG2 3.7Å; W511-L830 HydrophobicContact CH2-CD2 3.58Å; W511-L830 HydrophobicContact CZ3-CD2 3.94Å
512	D	98.6	Very high	90.6	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	18%	0.179	C	C	.	.			trans	-76.4	166.5	150.8	-154.4	88.8	0	0	0	111.2	D514 T516 L517 V747 K781 I801	D512-D514 PolarHBondContact OD2-N 3Å; D512-D514 VanDerWaalsContact OD2-N 3.11Å; D512-T516 HydrophobicContact CB-CG2 4.45Å; D512-L517 WeakPolarHBondContact O-CD1 3.32Å; D512-L517 WeakPolarHBondContact O-CG 3.3Å; D512-V747 WeakPolarHBondContact CA-O 3.46Å; D512-V747 VanDerWaalsContact OD1-O 3.12Å; D512-K781 WeakPolarHBondContact OD1-CE 3.37Å; D512-K781 IonicContact OD1-NZ 3.41Å; D512-K781 PolarHBondContact OD1-NZ 3.3Å; D512-I801 PolarHBondContact N-O 2.85Å
513	L	98.5	Very high	92.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.			trans	-98.9	-63.1	-180	179.5	56.3	0	0	0	112	L517 I518 L746 T748 K758 I759	L513-L517 WeakPolarHBondContact O-CB 3.34Å; L513-L517 PolarHBondContact O-N 2.91Å; L513-I518 HydrophobicContact CD1-CD1 4.02Å; L513-I518 HydrophobicContact CD1-CG1 4.04Å; L513-I518 HydrophobicContact CD1-CG2 4.25Å; L513-I518 HydrophobicContact CG-CD1 4.01Å; L513-I518 HydrophobicContact CG-CG1 4.15Å; L513-I518 WeakPolarHBondContact O-CG1 3.34Å; L513-I518 PolarHBondContact O-N 2.97Å; L513-L746 HydrophobicContact CB-CD1 4.04Å; L513-L746 HydrophobicContact CB-CD2 4.29Å; L513-L746 HydrophobicContact CB-CG 4.46Å; L513-L746 HydrophobicContact CD1-CD1 4.5Å; L513-L746 HydrophobicContact CD1-CD2 4.5Å; L513-L746 HydrophobicContact CD2-CD2 4.33Å; L513-T748 HydrophobicContact CB-CG2 4.41Å; L513-T748 HydrophobicContact CD2-CG2 4.25Å; L513-K758 HydrophobicContact CD2-CB 3.95Å; L513-K758 HydrophobicContact CD2-CD 3.59Å; L513-K758 HydrophobicContact CD2-CG 4.43Å; L513-K758 HydrophobicContact CG-CD 4.44Å; L513-I759 HydrophobicContact CD1-CD1 3.83Å; L513-I759 HydrophobicContact CD1-CG1 4.42Å
514	D	97.5	Very high	94.8	Very high	19 Å²	19	28.1 Å²	28.1	10%	0.102	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-84	138.4	-165.5	-71.2	-83.2	0	0	0	109.4	D512 T516 T750 K758	D512-D514 PolarHBondContact OD2-N 3Å; D512-D514 VanDerWaalsContact OD2-N 3.11Å; D514-T516 PolarHBondContact O-N 2.96Å; D514-T750 PolarHBondContact OD2-OG1 3.32Å; D514-K758 IonicContact OD1-NZ 3.57Å; D514-K758 PolarHBondContact OD1-NZ 3.26Å; D514-K758 IonicContact OD2-NZ 3.56Å; D514-K758 PolarHBondContact OD2-NZ 2.89Å
515	E	97.9	Very high	96.4	Very high	26 Å²	26	27.2 Å²	27.2	12%	0.121	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-8.6	-171.8	-82.1	44.9	-125	0	0	116	I518 F520 H521 T522 W725	E515-I518 VanDerWaalsContact CA-O 3.23Å; E515-I518 WeakPolarHBondContact CA-O 3.41Å; E515-I518 PolarHBondContact N-O 3.11Å; E515-F520 PolarHBondContact OE1-N 2.74Å; E515-H521 PolarHBondContact OE1-N 3.44Å; E515-H521 VanDerWaalsContact OE2-CB 3.28Å; E515-H521 WeakPolarHBondContact OE2-CB 3.39Å; E515-H521 PolarHBondContact OE2-N 3.22Å; E515-T522 HydrophobicContact CG-CG2 3.4Å; E515-T522 WeakPolarHBondContact OE1-CB 3.44Å; E515-T522 PolarHBondContact OE1-N 3.34Å; E515-T522 PolarHBondContact OE1-OG1 2.88Å; E515-W725 WeakPolarHBondContact O-CZ2 3.49Å
516	T	98.6	Very high	97.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-65.3	175.4	-68.6	0	0	0	0	112.4	W511 D512 D514 W725 I801 G802 D803 I821	W511-T516 HydrophobicContact CE3-CG2 4.25Å; D512-T516 HydrophobicContact CB-CG2 4.45Å; D514-T516 PolarHBondContact O-N 2.96Å; T516-W725 PolarHBondContact O-NE1 3.09Å; T516-I801 HydrophobicContact CG2-CG2 4.41Å; T516-G802 VanDerWaalsContact OG1-CA 3.28Å; T516-G802 WeakPolarHBondContact OG1-CA 3.47Å; T516-D803 PolarHBondContact OG1-N 2.89Å; T516-D803 PolarHBondContact OG1-OD1 3.36Å; T516-I821 HydrophobicContact CG2-CG1 4.42Å
517	L	98.6	Very high	97.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-39.6	176.8	-74.4	174.5	0	0	0	111.3	W511 D512 L513 A729 T733 L746 Y764 F768	W511-L517 HydrophobicContact CB-CD1 4.05Å; W511-L517 HydrophobicContact CD2-CD2 3.97Å; W511-L517 HydrophobicContact CD2-CG 4.41Å; W511-L517 HydrophobicContact CE3-CD1 4.48Å; W511-L517 HydrophobicContact CE3-CD2 3.45Å; W511-L517 VanDerWaalsContact CE3-CD2 3.45Å; W511-L517 HydrophobicContact CE3-CG 3.91Å; W511-L517 HydrophobicContact CG-CD1 4.39Å; W511-L517 HydrophobicContact CH2-CD2 4.18Å; W511-L517 HydrophobicContact CZ3-CD2 3.57Å; W511-L517 HydrophobicContact CZ3-CG 4.43Å; D512-L517 WeakPolarHBondContact O-CD1 3.32Å; D512-L517 WeakPolarHBondContact O-CG 3.3Å; L513-L517 WeakPolarHBondContact O-CB 3.34Å; L513-L517 PolarHBondContact O-N 2.91Å; L517-A729 HydrophobicContact CD2-CB 4.09Å; L517-T733 HydrophobicContact CD2-CG2 3.69Å; L517-L746 HydrophobicContact CD1-CD1 3.69Å; L517-Y764 HydrophobicContact CB-CE2 4.16Å; L517-Y764 HydrophobicContact CD2-CE1 4.05Å; L517-Y764 PolarHBondContact O-OH 3.1Å; L517-Y764 VanDerWaalsContact O-OH 3.12Å; L517-F768 HydrophobicContact CD1-CE2 3.95Å; L517-F768 HydrophobicContact CD1-CZ 3.75Å
518	I	98.1	Very high	97.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-120.6	141.2	-179.2	65.4	170.6	0	0	0	110.4	L513 E515 F520 L726 K758 Y762 Y764	L513-I518 HydrophobicContact CD1-CD1 4.02Å; L513-I518 HydrophobicContact CD1-CG1 4.04Å; L513-I518 HydrophobicContact CD1-CG2 4.25Å; L513-I518 HydrophobicContact CG-CD1 4.01Å; L513-I518 HydrophobicContact CG-CG1 4.15Å; L513-I518 WeakPolarHBondContact O-CG1 3.34Å; L513-I518 PolarHBondContact O-N 2.97Å; E515-I518 VanDerWaalsContact CA-O 3.23Å; E515-I518 WeakPolarHBondContact CA-O 3.41Å; E515-I518 PolarHBondContact N-O 3.11Å; I518-F520 HydrophobicContact CD1-CB 4.02Å; I518-F520 HydrophobicContact CG1-CB 4.3Å; I518-L726 HydrophobicContact CG2-CD1 4.41Å; I518-K758 HydrophobicContact CD1-CB 4.4Å; I518-K758 HydrophobicContact CD1-CD 4.05Å; I518-K758 HydrophobicContact CD1-CG 4.35Å; I518-Y762 HydrophobicContact CB-CD1 3.85Å; I518-Y762 HydrophobicContact CB-CD2 4.42Å; I518-Y762 HydrophobicContact CB-CE1 3.72Å; I518-Y762 HydrophobicContact CB-CE2 4.32Å; I518-Y762 HydrophobicContact CB-CG 4.2Å; I518-Y762 HydrophobicContact CD1-CD2 3.88Å; I518-Y762 HydrophobicContact CD1-CE2 3.58Å; I518-Y762 HydrophobicContact CD1-CG 4.47Å; I518-Y762 HydrophobicContact CG2-CD1 3.37Å; I518-Y762 HydrophobicContact CG2-CD2 3.94Å; I518-Y762 HydrophobicContact CG2-CE1 3.82Å; I518-Y762 HydrophobicContact CG2-CE2 4.33Å; I518-Y762 HydrophobicContact CG2-CG 3.43Å; I518-Y762 VanDerWaalsContact CG2-CG 3.43Å; I518-Y764 HydrophobicContact CG2-CD2 4.29Å; I518-Y764 HydrophobicContact CG2-CE2 3.72Å
519	I	98.3	Very high	97.9	Very high	6 Å²	6	23.1 Å²	23.1	3%	0.031	12%	0.117	C	C	.	.			trans	-89.6	120.1	164	-60.4	-54.3	0	0	0	107	L523 Y528 T722 W725 Y762	I519-L523 HydrophobicContact CG2-CD2 3.73Å; I519-L523 HydrophobicContact CG2-CG 3.9Å; I519-Y528 HydrophobicContact CB-CD2 4.43Å; I519-Y528 HydrophobicContact CD1-CD2 4.12Å; I519-Y528 HydrophobicContact CD1-CE2 4.21Å; I519-Y528 HydrophobicContact CG1-CD2 4.07Å; I519-Y528 HydrophobicContact CG1-CE2 3.95Å; I519-Y528 HydrophobicContact CG2-CD2 3.51Å; I519-Y528 HydrophobicContact CG2-CE2 4.11Å; I519-Y528 HydrophobicContact CG2-CG 3.8Å; I519-T722 HydrophobicContact CB-CG2 3.87Å; I519-T722 HydrophobicContact CG1-CG2 4.26Å; I519-T722 HydrophobicContact CG2-CG2 3.85Å; I519-W725 HydrophobicContact CD1-CD2 3.63Å; I519-W725 HydrophobicContact CD1-CE3 3.96Å; I519-W725 HydrophobicContact CD1-CG 4.09Å; I519-W725 HydrophobicContact CD1-CH2 4.19Å; I519-W725 HydrophobicContact CD1-CZ2 3.87Å; I519-W725 HydrophobicContact CD1-CZ3 4.22Å; I519-W725 HydrophobicContact CG1-CB 4.11Å; I519-W725 HydrophobicContact CG1-CD2 3.69Å; I519-W725 HydrophobicContact CG1-CE3 4.17Å; I519-W725 HydrophobicContact CG1-CG 3.63Å; I519-Y762 PolarHBondContact O-OH 3.01Å
520	F	98	Very high	97.8	Very high	15 Å²	15	30.9 Å²	30.9	7%	0.066	15%	0.153	C	C	.	.			trans	-147.4	-65.8	-174.9	-178.9	-117.5	0	0	0	112.9	E515 I518 T522 L523 L524 M546 E547 I550 Y762	E515-F520 PolarHBondContact OE1-N 2.74Å; I518-F520 HydrophobicContact CD1-CB 4.02Å; I518-F520 HydrophobicContact CG1-CB 4.3Å; F520-T522 VanDerWaalsContact C-N 3.25Å; F520-T522 PolarHBondContact O-N 2.87Å; F520-L523 WeakPolarHBondContact O-CB 3.44Å; F520-L523 PolarHBondContact O-N 2.8Å; F520-L523 VanDerWaalsContact O-N 3.07Å; F520-L524 HydrophobicContact CE1-CD1 4.37Å; F520-L524 HydrophobicContact CE2-CD1 4.45Å; F520-L524 HydrophobicContact CZ-CD1 4.11Å; F520-L524 PolarHBondContact O-N 2.99Å; F520-M546 HydrophobicContact CE2-CB 4.21Å; F520-M546 HydrophobicContact CE2-CG 4.47Å; F520-E547 HydrophobicContact CE2-CB 4.14Å; F520-E547 HydrophobicContact CZ-CB 3.87Å; F520-E547 HydrophobicContact CZ-CG 4.29Å; F520-I550 HydrophobicContact CD2-CD1 4.34Å; F520-I550 HydrophobicContact CE1-CD1 4.24Å; F520-I550 HydrophobicContact CE2-CD1 3.76Å; F520-I550 HydrophobicContact CZ-CD1 3.7Å; F520-Y762 WeakPolarHBondContact CD2-OH 3.48Å
521	H	95.2	Very high	97.8	Very high	105 Å²	105	36.1 Å²	36.1	49%	0.486	17%	0.172	S	C	.	.	H	α-helix	trans	-64.8	-35.2	-177.6	-177.1	67.5	0	0	0	111	E515 L523 L524 T525	E515-H521 PolarHBondContact OE1-N 3.44Å; E515-H521 VanDerWaalsContact OE2-CB 3.28Å; E515-H521 WeakPolarHBondContact OE2-CB 3.39Å; E515-H521 PolarHBondContact OE2-N 3.22Å; H521-L523 PolarHBondContact O-N 3.09Å; H521-L524 PolarHBondContact O-N 3.32Å; H521-L524 VanDerWaalsContact O-N 3.1Å; H521-T525 WeakPolarHBondContact NE2-CG2 3.5Å; H521-T525 PolarHBondContact O-N 3.3Å; H521-T525 PolarHBondContact O-OG1 2.94Å
522	T	97.5	Very high	97.7	Very high	19 Å²	19	38.6 Å²	38.6	12%	0.117	18%	0.182	C	C	.	.	H	α-helix	trans	-74.6	-7.4	176.9	59.5	0	0	0	0	114.8	E515 F520 T525 G526 Y527 Y528	E515-T522 HydrophobicContact CG-CG2 3.4Å; E515-T522 WeakPolarHBondContact OE1-CB 3.44Å; E515-T522 PolarHBondContact OE1-N 3.34Å; E515-T522 PolarHBondContact OE1-OG1 2.88Å; F520-T522 VanDerWaalsContact C-N 3.25Å; F520-T522 PolarHBondContact O-N 2.87Å; T522-T525 WeakPolarHBondContact CA-OG1 3.25Å; T522-G526 CarbonylContact O-C 3.49Å; T522-Y527 HydrophobicContact CG2-CD1 3.75Å; T522-Y527 HydrophobicContact CG2-CG 4.41Å; T522-Y527 PolarHBondContact O-N 2.83Å; T522-Y528 WeakPolarHBondContact O-CB 3.5Å; T522-Y528 PolarHBondContact O-N 2.87Å
523	L	97.8	Very high	97.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-77.4	-44.9	162.9	-57.4	179.3	0	0	0	110.7	I519 F520 H521 G526 Y528 A539 L718 L721 T722	I519-L523 HydrophobicContact CG2-CD2 3.73Å; I519-L523 HydrophobicContact CG2-CG 3.9Å; F520-L523 WeakPolarHBondContact O-CB 3.44Å; F520-L523 PolarHBondContact O-N 2.8Å; F520-L523 VanDerWaalsContact O-N 3.07Å; H521-L523 PolarHBondContact O-N 3.09Å; L523-G526 PolarHBondContact O-N 3.36Å; L523-Y528 HydrophobicContact CD2-CD1 4.44Å; L523-Y528 HydrophobicContact CD2-CG 4.47Å; L523-A539 HydrophobicContact CD2-CB 4.27Å; L523-L718 HydrophobicContact CD1-CD1 3.8Å; L523-L718 HydrophobicContact CD1-CD2 4.44Å; L523-L718 HydrophobicContact CD1-CG 4.01Å; L523-L721 HydrophobicContact CD2-CD2 3.98Å; L523-T722 HydrophobicContact CD2-CG2 4.25Å
524	L	97.4	Very high	97.7	Very high	56 Å²	56	44.3 Å²	44.3	29%	0.293	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-38.2	-177.7	-63	173	0	0	0	112	F520 H521 G526 G543 L544	F520-L524 HydrophobicContact CE1-CD1 4.37Å; F520-L524 HydrophobicContact CE2-CD1 4.45Å; F520-L524 HydrophobicContact CZ-CD1 4.11Å; F520-L524 PolarHBondContact O-N 2.99Å; H521-L524 PolarHBondContact O-N 3.32Å; H521-L524 VanDerWaalsContact O-N 3.1Å; L524-G526 VanDerWaalsContact C-N 3.3Å; L524-G543 VanDerWaalsContact CD2-C 3.49Å; L524-L544 HydrophobicContact CD2-CD2 3.88Å; L524-L544 HydrophobicContact CD2-CG 3.93Å
525	T	96.9	Very high	97.7	Very high	80 Å²	80	47.8 Å²	47.8	49%	0.491	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.2	174.2	62.7	0	0	0	0	113.7	H521 T522 Y527	H521-T525 WeakPolarHBondContact NE2-CG2 3.5Å; H521-T525 PolarHBondContact O-N 3.3Å; H521-T525 PolarHBondContact O-OG1 2.94Å; T522-T525 WeakPolarHBondContact CA-OG1 3.25Å; T525-Y527 PolarHBondContact O-N 2.7Å; T525-Y527 VanDerWaalsContact O-N 3.16Å
526	G	96.8	Very high	97.6	Very high	17 Å²	17	50.1 Å²	50.1	18%	0.175	26%	0.263	C	S	.	.	S	Bend	trans	69.9	-1.3	-174.7	0	0	0	0	0	115.3	T522 L523 L524 Y528 A529 H530	T522-G526 CarbonylContact O-C 3.49Å; L523-G526 PolarHBondContact O-N 3.36Å; L524-G526 VanDerWaalsContact C-N 3.3Å; G526-Y528 VanDerWaalsContact C-N 3.35Å; G526-Y528 PolarHBondContact O-N 3.31Å; G526-A529 WeakPolarHBondContact O-CB 3.39Å; G526-A529 PolarHBondContact O-N 3.27Å; G526-A529 VanDerWaalsContact O-N 3.1Å; G526-H530 PolarHBondContact O-N 3.3Å
527	Y	97.5	Very high	97.6	Very high	128 Å²	128	53.2 Å²	53.2	50%	0.502	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-42.6	-177.4	178.6	-101.1	0	0	0	112.8	T522 T525 A529 H530 R531	T522-Y527 HydrophobicContact CG2-CD1 3.75Å; T522-Y527 HydrophobicContact CG2-CG 4.41Å; T522-Y527 PolarHBondContact O-N 2.83Å; T525-Y527 PolarHBondContact O-N 2.7Å; T525-Y527 VanDerWaalsContact O-N 3.16Å; Y527-A529 VanDerWaalsContact C-N 3.32Å; Y527-A529 PolarHBondContact O-N 2.77Å; Y527-H530 PolarHBondContact O-N 2.89Å; Y527-R531 VanDerWaalsContact O-CB 3.26Å; Y527-R531 WeakPolarHBondContact O-CB 3.39Å; Y527-R531 PolarHBondContact O-N 3.42Å
528	Y	97.9	Very high	97.6	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-43.8	176.2	-173.9	-82.3	0	0	0	111	I519 T522 L523 G526 R531 Y532 K534 T722 D723 W725 H824	I519-Y528 HydrophobicContact CB-CD2 4.43Å; I519-Y528 HydrophobicContact CD1-CD2 4.12Å; I519-Y528 HydrophobicContact CD1-CE2 4.21Å; I519-Y528 HydrophobicContact CG1-CD2 4.07Å; I519-Y528 HydrophobicContact CG1-CE2 3.95Å; I519-Y528 HydrophobicContact CG2-CD2 3.51Å; I519-Y528 HydrophobicContact CG2-CE2 4.11Å; I519-Y528 HydrophobicContact CG2-CG 3.8Å; T522-Y528 WeakPolarHBondContact O-CB 3.5Å; T522-Y528 PolarHBondContact O-N 2.87Å; L523-Y528 HydrophobicContact CD2-CD1 4.44Å; L523-Y528 HydrophobicContact CD2-CG 4.47Å; G526-Y528 VanDerWaalsContact C-N 3.35Å; G526-Y528 PolarHBondContact O-N 3.31Å; Y528-R531 PolarHBondContact O-N 2.66Å; Y528-Y532 HydrophobicContact CD1-CD2 4.07Å; Y528-Y532 AromaticContact CD2-CD2 3.58Å; Y528-Y532 HydrophobicContact CD2-CD2 3.58Å; Y528-Y532 AromaticContact CD2-CE2 3.76Å; Y528-Y532 HydrophobicContact CD2-CE2 3.76Å; Y528-Y532 AromaticContact CE1-CD2 3.84Å; Y528-Y532 HydrophobicContact CE1-CD2 3.84Å; Y528-Y532 HydrophobicContact CE1-CG 4.08Å; Y528-Y532 AromaticContact CE2-CD2 3.34Å; Y528-Y532 HydrophobicContact CE2-CD2 3.34Å; Y528-Y532 AromaticContact CE2-CE2 3.48Å; Y528-Y532 HydrophobicContact CE2-CE2 3.48Å; Y528-Y532 VanDerWaalsContact CE2-CE2 3.48Å; Y528-Y532 HydrophobicContact CE2-CG 4.13Å; Y528-Y532 AromaticContact CG-CD2 3.92Å; Y528-Y532 HydrophobicContact CG-CD2 3.92Å; Y528-Y532 AromaticContact CZ-CD2 3.44Å; Y528-Y532 VanDerWaalsContact CZ-CD2 3.44Å; Y528-Y532 AromaticContact CZ-CG 3.77Å; Y528-Y532 WeakPolarHBondContact O-CD2 3.2Å; Y528-Y532 PolarHBondContact O-N 2.7Å; Y528-K534 HydrophobicContact CD1-CG 4.36Å; Y528-K534 HydrophobicContact CE1-CG 4.11Å; Y528-T722 HydrophobicContact CD1-CG2 4.46Å; Y528-T722 HydrophobicContact CE1-CG2 4.1Å; Y528-T722 VanDerWaalsContact OH-CA 3.31Å; Y528-T722 WeakPolarHBondContact OH-CA 3.3Å; Y528-T722 PolarHBondContact OH-O 3.34Å; Y528-T722 VanDerWaalsContact OH-O 3.05Å; Y528-D723 PolarHBondContact OH-OD2 3Å; Y528-W725 HydrophobicContact CE2-CE3 4.5Å; Y528-H824 PolarHBondContact OH-CE1 3.04Å; Y528-H824 PolarHBondContact OH-NE2 2.71Å; Y528-H824 VanDerWaalsContact OH-NE2 3.15Å
529	A	98.2	Very high	97.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-43.2	-178.9	0	0	0	0	0	112.1	G526 Y527 G533 K534 P536 A539	G526-A529 WeakPolarHBondContact O-CB 3.39Å; G526-A529 PolarHBondContact O-N 3.27Å; G526-A529 VanDerWaalsContact O-N 3.1Å; Y527-A529 VanDerWaalsContact C-N 3.32Å; Y527-A529 PolarHBondContact O-N 2.77Å; A529-G533 WeakPolarHBondContact O-CA 3.25Å; A529-G533 PolarHBondContact O-N 3.44Å; A529-K534 HydrophobicContact CB-CB 4.06Å; A529-K534 PolarHBondContact O-N 2.98Å; A529-P536 HydrophobicContact CB-CB 4.1Å; A529-P536 HydrophobicContact CB-CG 4.05Å; A529-A539 HydrophobicContact CB-CB 3.83Å
530	H	97.6	Very high	97.5	Very high	164 Å²	164	56.1 Å²	56.1	76%	0.759	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-46.4	173.7	-175.9	76.7	0	0	0	112	G526 Y527	G526-H530 PolarHBondContact O-N 3.3Å; Y527-H530 PolarHBondContact O-N 2.89Å
531	R	97.7	Very high	97.5	Very high	111 Å²	111	58.2 Å²	58.2	42%	0.419	32%	0.324	S	S	.	.	H	α-helix	trans	-69.3	-34.7	-175.5	-173.6	173	178.8	-146.4	-6.4	113.9	Y527 Y528 N822	Y527-R531 VanDerWaalsContact O-CB 3.26Å; Y527-R531 WeakPolarHBondContact O-CB 3.39Å; Y527-R531 PolarHBondContact O-N 3.42Å; Y528-R531 PolarHBondContact O-N 2.66Å; R531-N822 PolarHBondContact NH1-O 3.43Å; R531-N822 PolarHBondContact NH2-O 3.41Å
532	Y	97.9	Very high	97.7	Very high	54 Å²	54	55.3 Å²	55.3	21%	0.212	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	15.5	-176.3	-64.9	-80.4	0	0	0	113.9	Y528 K534 A823 H824	Y528-Y532 HydrophobicContact CD1-CD2 4.07Å; Y528-Y532 AromaticContact CD2-CD2 3.58Å; Y528-Y532 HydrophobicContact CD2-CD2 3.58Å; Y528-Y532 AromaticContact CD2-CE2 3.76Å; Y528-Y532 HydrophobicContact CD2-CE2 3.76Å; Y528-Y532 AromaticContact CE1-CD2 3.84Å; Y528-Y532 HydrophobicContact CE1-CD2 3.84Å; Y528-Y532 HydrophobicContact CE1-CG 4.08Å; Y528-Y532 AromaticContact CE2-CD2 3.34Å; Y528-Y532 HydrophobicContact CE2-CD2 3.34Å; Y528-Y532 AromaticContact CE2-CE2 3.48Å; Y528-Y532 HydrophobicContact CE2-CE2 3.48Å; Y528-Y532 VanDerWaalsContact CE2-CE2 3.48Å; Y528-Y532 HydrophobicContact CE2-CG 4.13Å; Y528-Y532 AromaticContact CG-CD2 3.92Å; Y528-Y532 HydrophobicContact CG-CD2 3.92Å; Y528-Y532 AromaticContact CZ-CD2 3.44Å; Y528-Y532 VanDerWaalsContact CZ-CD2 3.44Å; Y528-Y532 AromaticContact CZ-CG 3.77Å; Y528-Y532 WeakPolarHBondContact O-CD2 3.2Å; Y528-Y532 PolarHBondContact O-N 2.7Å; Y532-K534 VanDerWaalsContact C-N 3.34Å; Y532-K534 VanDerWaalsContact O-CE 3.31Å; Y532-K534 WeakPolarHBondContact O-CE 3.23Å; Y532-K534 PolarHBondContact O-N 2.88Å; Y532-A823 WeakPolarHBondContact OH-CB 3.36Å; Y532-H824 AromaticContact CD1-CE1 3.8Å; Y532-H824 AromaticContact CE1-CE1 3.4Å; Y532-H824 WeakPolarHBondContact CE1-CE1 3.41Å; Y532-H824 AromaticContact CE1-ND1 3.39Å; Y532-H824 WeakPolarHBondContact CE1-ND1 3.46Å; Y532-H824 AromaticContact CZ-CE1 3.65Å; Y532-H824 AromaticContact CZ-ND1 3.69Å
533	G	97.8	Very high	97.7	Very high	71 Å²	71	54.4 Å²	54.4	73%	0.732	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	33	173.7	0	0	0	0	0	114.6	A529	A529-G533 WeakPolarHBondContact O-CA 3.25Å; A529-G533 PolarHBondContact O-N 3.44Å
534	K	98.1	Very high	97.7	Very high	55 Å²	55	59.1 Å²	59.1	24%	0.239	33%	0.328	C	S	.	.			trans	-93.5	163.7	176.5	-43.5	-58.8	177.1	178.6	0	110.7	Y528 A529 Y532 P536 L721 D723	Y528-K534 HydrophobicContact CD1-CG 4.36Å; Y528-K534 HydrophobicContact CE1-CG 4.11Å; A529-K534 HydrophobicContact CB-CB 4.06Å; A529-K534 PolarHBondContact O-N 2.98Å; Y532-K534 VanDerWaalsContact C-N 3.34Å; Y532-K534 VanDerWaalsContact O-CE 3.31Å; Y532-K534 WeakPolarHBondContact O-CE 3.23Å; Y532-K534 PolarHBondContact O-N 2.88Å; K534-P536 VanDerWaalsContact O-CD 3.27Å; K534-P536 WeakPolarHBondContact O-CD 3.23Å; K534-L721 VanDerWaalsContact CE-O 3.23Å; K534-L721 WeakPolarHBondContact CE-O 3.41Å; K534-D723 WeakPolarHBondContact CE-OD2 3.39Å; K534-D723 IonicContact NZ-OD1 2.79Å; K534-D723 PolarHBondContact NZ-OD1 3.42Å; K534-D723 IonicContact NZ-OD2 2.66Å; K534-D723 PolarHBondContact NZ-OD2 3.4Å
535	D	97.4	Very high	97.8	Very high	92 Å²	92	63.1 Å²	63.1	49%	0.492	34%	0.339	S	S	.	.			trans	-68.9	117.1	169.7	-175.3	-24.4	0	0	0	110.3	A537 V538 A539	D535-A537 VanDerWaalsContact C-N 3.28Å; D535-A537 PolarHBondContact O-N 3.23Å; D535-A537 WeakPolarHBondContact OD1-CB 3.12Å; D535-A537 PolarHBondContact OD1-N 2.67Å; D535-V538 HydrophobicContact CB-CB 4.13Å; D535-V538 HydrophobicContact CB-CG2 3.94Å; D535-V538 PolarHBondContact O-N 2.9Å; D535-V538 PolarHBondContact OD1-N 3.44Å; D535-A539 WeakPolarHBondContact O-CB 3.47Å; D535-A539 PolarHBondContact O-N 3.18Å
536	P	97	Very high	97.8	Very high	75 Å²	75	59.3 Å²	59.3	49%	0.487	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-30.2	179.1	-21.3	34.5	0	0	0	113.6	A529 K534 G540	A529-P536 HydrophobicContact CB-CB 4.1Å; A529-P536 HydrophobicContact CB-CG 4.05Å; K534-P536 VanDerWaalsContact O-CD 3.27Å; K534-P536 WeakPolarHBondContact O-CD 3.23Å; P536-G540 PolarHBondContact O-N 2.85Å
537	A	97.6	Very high	97.9	Very high	66 Å²	66	61.5 Å²	61.5	55%	0.545	32%	0.321	S	S	.	.	H	α-helix	trans	-70.9	-39.6	179.2	0	0	0	0	0	111.3	D535 T541	D535-A537 VanDerWaalsContact C-N 3.28Å; D535-A537 PolarHBondContact O-N 3.23Å; D535-A537 WeakPolarHBondContact OD1-CB 3.12Å; D535-A537 PolarHBondContact OD1-N 2.67Å; A537-T541 VanDerWaalsContact O-CB 3.25Å; A537-T541 WeakPolarHBondContact O-CB 3.4Å; A537-T541 PolarHBondContact O-N 3.38Å; A537-T541 PolarHBondContact O-OG1 2.77Å
538	V	98	Very high	97.9	Very high	52 Å²	52	61.9 Å²	61.9	32%	0.315	33%	0.328	S	S	.	.	H	α-helix	trans	-69.4	-44.7	174.5	-178.2	0	0	0	0	110.7	D535 T541 Y542 L721	D535-V538 HydrophobicContact CB-CB 4.13Å; D535-V538 HydrophobicContact CB-CG2 3.94Å; D535-V538 PolarHBondContact O-N 2.9Å; D535-V538 PolarHBondContact OD1-N 3.44Å; V538-T541 PolarHBondContact O-N 3.11Å; V538-Y542 HydrophobicContact CG1-CD2 4.36Å; V538-Y542 HydrophobicContact CG1-CE1 4.23Å; V538-Y542 HydrophobicContact CG1-CE2 3.86Å; V538-Y542 PolarHBondContact O-N 2.72Å; V538-L721 HydrophobicContact CB-CD1 4.28Å; V538-L721 HydrophobicContact CG1-CD1 3.73Å
539	A	98	Very high	97.9	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.4	-50.8	177.8	0	0	0	0	0	112	L523 A529 D535 T541 Y542 G543 L721	L523-A539 HydrophobicContact CD2-CB 4.27Å; A529-A539 HydrophobicContact CB-CB 3.83Å; D535-A539 WeakPolarHBondContact O-CB 3.47Å; D535-A539 PolarHBondContact O-N 3.18Å; A539-T541 VanDerWaalsContact C-N 3.34Å; A539-T541 PolarHBondContact O-N 3.22Å; A539-Y542 PolarHBondContact O-N 3.07Å; A539-G543 PolarHBondContact O-N 3.22Å; A539-L721 HydrophobicContact CB-CD1 4.27Å; A539-L721 HydrophobicContact CB-CD2 4.06Å
540	G	97.8	Very high	97.9	Very high	15 Å²	15	63 Å²	63	16%	0.155	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-38.7	176.1	0	0	0	0	0	112.8	P536 Y542 G543 L544	P536-G540 PolarHBondContact O-N 2.85Å; G540-Y542 VanDerWaalsContact C-N 3.32Å; G540-Y542 PolarHBondContact O-N 3.14Å; G540-G543 PolarHBondContact O-N 2.86Å; G540-L544 WeakPolarHBondContact O-CB 3.44Å; G540-L544 WeakPolarHBondContact O-CG 3.47Å; G540-L544 PolarHBondContact O-N 3.43Å
541	T	98.1	Very high	97.9	Very high	59 Å²	59	60.1 Å²	60.1	36%	0.362	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-37.6	174.9	-62.9	0	0	0	0	112.3	A537 V538 A539 R545	A537-T541 VanDerWaalsContact O-CB 3.25Å; A537-T541 WeakPolarHBondContact O-CB 3.4Å; A537-T541 PolarHBondContact O-N 3.38Å; A537-T541 PolarHBondContact O-OG1 2.77Å; V538-T541 PolarHBondContact O-N 3.11Å; A539-T541 VanDerWaalsContact C-N 3.34Å; A539-T541 PolarHBondContact O-N 3.22Å; T541-R545 VanDerWaalsContact O-CG 3.29Å; T541-R545 WeakPolarHBondContact O-CG 2.89Å; T541-R545 PolarHBondContact O-N 2.88Å
542	Y	98.2	Very high	97.8	Very high	43 Å²	43	57.4 Å²	57.4	17%	0.169	31%	0.311	C	S	.	.	H	α-helix	trans	-73.8	-40	175.2	-68	-9.4	0	0	0	112.1	V538 A539 G540 R545 M546 L714 N717 L721	V538-Y542 HydrophobicContact CG1-CD2 4.36Å; V538-Y542 HydrophobicContact CG1-CE1 4.23Å; V538-Y542 HydrophobicContact CG1-CE2 3.86Å; V538-Y542 PolarHBondContact O-N 2.72Å; A539-Y542 PolarHBondContact O-N 3.07Å; G540-Y542 VanDerWaalsContact C-N 3.32Å; G540-Y542 PolarHBondContact O-N 3.14Å; Y542-R545 PolarHBondContact O-N 3.33Å; Y542-M546 WeakPolarHBondContact O-CB 3.24Å; Y542-M546 PolarHBondContact O-N 2.77Å; Y542-L714 HydrophobicContact CD1-CD1 3.81Å; Y542-L714 HydrophobicContact CG-CD1 4.03Å; Y542-N717 HydrophobicContact CD2-CB 4.48Å; Y542-N717 HydrophobicContact CE2-CB 3.71Å; Y542-N717 PolarHBondContact OH-ND2 3.19Å; Y542-L721 HydrophobicContact CD2-CB 4.3Å; Y542-L721 HydrophobicContact CD2-CD1 3.83Å; Y542-L721 HydrophobicContact CE2-CB 4.27Å; Y542-L721 HydrophobicContact CE2-CD1 3.91Å
543	G	98	Very high	97.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56	-53.5	173.5	0	0	0	0	0	112.2	L524 A539 G540 R545 M546 E547	L524-G543 VanDerWaalsContact CD2-C 3.49Å; A539-G543 PolarHBondContact O-N 3.22Å; G540-G543 PolarHBondContact O-N 2.86Å; G543-R545 PolarHBondContact O-N 2.94Å; G543-M546 PolarHBondContact O-N 3.28Å; G543-M546 VanDerWaalsContact O-N 3.1Å; G543-E547 WeakPolarHBondContact O-CB 3.08Å; G543-E547 PolarHBondContact O-N 2.89Å
544	L	98.3	Very high	97.8	Very high	100 Å²	100	51.5 Å²	51.5	52%	0.524	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-38.4	-178.9	-71.3	167.9	0	0	0	113	L524 G540 M546 E547 E548	L524-L544 HydrophobicContact CD2-CD2 3.88Å; L524-L544 HydrophobicContact CD2-CG 3.93Å; G540-L544 WeakPolarHBondContact O-CB 3.44Å; G540-L544 WeakPolarHBondContact O-CG 3.47Å; G540-L544 PolarHBondContact O-N 3.43Å; L544-M546 VanDerWaalsContact C-N 3.35Å; L544-E547 PolarHBondContact O-N 3.17Å; L544-E548 PolarHBondContact O-N 3.48Å
545	R	98.2	Very high	97.8	Very high	140 Å²	140	51.4 Å²	51.4	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-69.7	-32.5	175.2	-72.6	176.3	-178.2	-174.7	3.2	112.6	T541 Y542 G543 L549 L714	T541-R545 VanDerWaalsContact O-CG 3.29Å; T541-R545 WeakPolarHBondContact O-CG 2.89Å; T541-R545 PolarHBondContact O-N 2.88Å; Y542-R545 PolarHBondContact O-N 3.33Å; G543-R545 PolarHBondContact O-N 2.94Å; R545-L549 WeakPolarHBondContact O-CG 3.15Å; R545-L549 PolarHBondContact O-N 2.87Å; R545-L714 HydrophobicContact CB-CD1 4.11Å; R545-L714 HydrophobicContact CB-CD2 3.73Å
546	M	98.2	Very high	97.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-74.3	-38.2	176.1	-163.1	64	168.8	0	0	110.6	F520 Y542 G543 L544 L549 I550 L714 L718 L761 Y762	F520-M546 HydrophobicContact CE2-CB 4.21Å; F520-M546 HydrophobicContact CE2-CG 4.47Å; Y542-M546 WeakPolarHBondContact O-CB 3.24Å; Y542-M546 PolarHBondContact O-N 2.77Å; G543-M546 PolarHBondContact O-N 3.28Å; G543-M546 VanDerWaalsContact O-N 3.1Å; L544-M546 VanDerWaalsContact C-N 3.35Å; M546-L549 PolarHBondContact O-N 3.41Å; M546-I550 HydrophobicContact CG-CD1 4.15Å; M546-I550 WeakPolarHBondContact O-CD1 3.45Å; M546-I550 WeakPolarHBondContact O-CG1 3.19Å; M546-I550 PolarHBondContact O-N 3.26Å; M546-L714 HydrophobicContact CB-CD2 4.15Å; M546-L714 HydrophobicContact SD-CD2 4.01Å; M546-L718 HydrophobicContact CB-CD1 4.48Å; M546-L718 HydrophobicContact CG-CD1 4.45Å; M546-L761 HydrophobicContact CE-CB 3.68Å; M546-Y762 HydrophobicContact CE-CD1 4.24Å; M546-Y762 HydrophobicContact CE-CD2 3.46Å; M546-Y762 VanDerWaalsContact CE-CD2 3.46Å; M546-Y762 HydrophobicContact CE-CE1 4.16Å; M546-Y762 HydrophobicContact CE-CE2 3.34Å; M546-Y762 HydrophobicContact CE-CG 3.94Å; M546-Y762 HydrophobicContact CG-CE2 3.93Å
547	E	98.2	Very high	97.7	Very high	62 Å²	62	50.4 Å²	50.4	29%	0.29	26%	0.257	S	S	.	.	H	α-helix	trans	-57.8	-48.8	171.2	-175	178.1	-128.5	0	0	111.6	F520 G543 L544 L549 I550 Y551	F520-E547 HydrophobicContact CE2-CB 4.14Å; F520-E547 HydrophobicContact CZ-CB 3.87Å; F520-E547 HydrophobicContact CZ-CG 4.29Å; G543-E547 WeakPolarHBondContact O-CB 3.08Å; G543-E547 PolarHBondContact O-N 2.89Å; L544-E547 PolarHBondContact O-N 3.17Å; E547-L549 VanDerWaalsContact C-N 3.32Å; E547-L549 PolarHBondContact O-N 3.03Å; E547-I550 PolarHBondContact O-N 3.49Å; E547-Y551 HydrophobicContact CG-CD2 3.75Å; E547-Y551 HydrophobicContact CG-CE2 3.6Å; E547-Y551 WeakPolarHBondContact O-CD2 3.06Å; E547-Y551 PolarHBondContact O-N 3.05Å; E547-Y551 VanDerWaalsContact O-N 3.07Å
548	E	97.7	Very high	97.6	Very high	137 Å²	137	47.3 Å²	47.3	64%	0.64	23%	0.231	S	C	*	.	H	α-helix	trans	-55.4	-46.1	175	-173.5	-175.1	178.3	0	0	111.5	L544 N552	L544-E548 PolarHBondContact O-N 3.48Å; E548-N552 WeakPolarHBondContact O-CB 3.12Å; E548-N552 PolarHBondContact O-N 3.34Å
549	L	97.4	Very high	97.6	Very high	24 Å²	24	46.5 Å²	46.5	13%	0.126	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-38.6	177.6	-72.3	176.1	0	0	0	113.2	R545 M546 E547 L553 W711 L714 L761	R545-L549 WeakPolarHBondContact O-CG 3.15Å; R545-L549 PolarHBondContact O-N 2.87Å; M546-L549 PolarHBondContact O-N 3.41Å; E547-L549 VanDerWaalsContact C-N 3.32Å; E547-L549 PolarHBondContact O-N 3.03Å; L549-L553 VanDerWaalsContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CB 3.33Å; L549-L553 PolarHBondContact O-N 2.78Å; L549-W711 HydrophobicContact CD1-CB 3.96Å; L549-W711 HydrophobicContact CD1-CG 4.42Å; L549-L714 HydrophobicContact CD1-CD2 3.87Å; L549-L761 HydrophobicContact CB-CD1 4.05Å
550	I	98.1	Very high	97.5	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-55.1	178.5	-72.8	158.5	0	0	0	110.1	F520 M546 E547 L553 A554 P754 A757 K758 L761 Y762	F520-I550 HydrophobicContact CD2-CD1 4.34Å; F520-I550 HydrophobicContact CE1-CD1 4.24Å; F520-I550 HydrophobicContact CE2-CD1 3.76Å; F520-I550 HydrophobicContact CZ-CD1 3.7Å; M546-I550 HydrophobicContact CG-CD1 4.15Å; M546-I550 WeakPolarHBondContact O-CD1 3.45Å; M546-I550 WeakPolarHBondContact O-CG1 3.19Å; M546-I550 PolarHBondContact O-N 3.26Å; E547-I550 PolarHBondContact O-N 3.49Å; I550-L553 PolarHBondContact O-N 2.79Å; I550-A554 WeakPolarHBondContact O-CB 3.12Å; I550-A554 PolarHBondContact O-N 2.98Å; I550-P754 HydrophobicContact CG2-CB 4.47Å; I550-A757 HydrophobicContact CG2-CB 4.11Å; I550-A757 WeakPolarHBondContact O-CB 3.32Å; I550-K758 HydrophobicContact CD1-CG 3.76Å; I550-K758 HydrophobicContact CG1-CG 4.12Å; I550-K758 HydrophobicContact CG2-CG 4.2Å; I550-L761 HydrophobicContact CB-CD1 4.31Å; I550-L761 HydrophobicContact CG1-CD1 3.75Å; I550-Y762 HydrophobicContact CD1-CE2 4.5Å
551	Y	97.5	Very high	97.3	Very high	104 Å²	104	52.1 Å²	52.1	41%	0.408	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-38.9	179.8	-69.5	-66.9	0	0	0	111.9	E547 L553 A554 D555 F560 P754	E547-Y551 HydrophobicContact CG-CD2 3.75Å; E547-Y551 HydrophobicContact CG-CE2 3.6Å; E547-Y551 WeakPolarHBondContact O-CD2 3.06Å; E547-Y551 PolarHBondContact O-N 3.05Å; E547-Y551 VanDerWaalsContact O-N 3.07Å; Y551-L553 VanDerWaalsContact C-N 3.31Å; Y551-L553 PolarHBondContact O-N 3.36Å; Y551-A554 PolarHBondContact O-N 3.41Å; Y551-D555 WeakPolarHBondContact O-CB 3.31Å; Y551-D555 PolarHBondContact O-N 3.29Å; Y551-F560 HydrophobicContact CD1-CD1 4.21Å; Y551-F560 AromaticContact CD1-CE1 3.85Å; Y551-F560 HydrophobicContact CD1-CE1 3.85Å; Y551-F560 AromaticContact CE1-CE1 3.93Å; Y551-F560 HydrophobicContact CE1-CE1 3.93Å; Y551-F560 HydrophobicContact CE1-CZ 4.4Å; Y551-P754 HydrophobicContact CE1-CG 4.41Å
552	N	97.1	Very high	97.1	Very high	55 Å²	55	53.3 Å²	53.3	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-36.6	177.9	-167.4	-106.6	0	0	0	112.7	E548 T556 K707	E548-N552 WeakPolarHBondContact O-CB 3.12Å; E548-N552 PolarHBondContact O-N 3.34Å; N552-T556 WeakPolarHBondContact O-CB 3.49Å; N552-T556 PolarHBondContact O-N 2.88Å; N552-T556 VanDerWaalsContact O-N 3.1Å; N552-T556 PolarHBondContact O-OG1 3.17Å; N552-K707 PolarHBondContact OD1-NZ 2.87Å
553	L	97.7	Very high	96.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.9	-47.5	173.3	-171	165.6	0	0	0	110.9	L549 I550 Y551 D555 T556 Y557 L558 V699 L702 L703 A757 L760 L761	L549-L553 VanDerWaalsContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CB 3.33Å; L549-L553 PolarHBondContact O-N 2.78Å; I550-L553 PolarHBondContact O-N 2.79Å; Y551-L553 VanDerWaalsContact C-N 3.31Å; Y551-L553 PolarHBondContact O-N 3.36Å; L553-D555 VanDerWaalsContact C-N 3.34Å; L553-D555 PolarHBondContact O-N 2.81Å; L553-T556 PolarHBondContact O-N 2.78Å; L553-Y557 HydrophobicContact CG-CD2 4.27Å; L553-Y557 PolarHBondContact O-N 2.98Å; L553-L558 HydrophobicContact CD2-CD1 3.77Å; L553-L558 HydrophobicContact CD2-CG 4.03Å; L553-V699 HydrophobicContact CD1-CG1 4.27Å; L553-L702 HydrophobicContact CD1-CD2 4.13Å; L553-L702 HydrophobicContact CD2-CD2 3.89Å; L553-L702 HydrophobicContact CG-CD2 3.97Å; L553-L703 HydrophobicContact CD1-CD2 4.29Å; L553-A757 HydrophobicContact CB-CB 4.5Å; L553-A757 HydrophobicContact CD2-CB 3.99Å; L553-L760 HydrophobicContact CD2-CD1 4.35Å; L553-L761 HydrophobicContact CB-CD1 4.45Å; L553-L761 HydrophobicContact CD1-CD1 4.04Å; L553-L761 HydrophobicContact CD1-CD2 3.82Å; L553-L761 HydrophobicContact CD1-CG 3.75Å
554	A	98	Very high	96.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.3	-45.1	-179.8	0	0	0	0	0	112	I550 Y551 L558 F559 F560 I753 A757	I550-A554 WeakPolarHBondContact O-CB 3.12Å; I550-A554 PolarHBondContact O-N 2.98Å; Y551-A554 PolarHBondContact O-N 3.41Å; A554-L558 CarbonylContact O-C 3.54Å; A554-L558 VanDerWaalsContact O-C 3.22Å; A554-L558 VanDerWaalsContact O-CA 3.3Å; A554-L558 WeakPolarHBondContact O-CA 3.22Å; A554-L558 WeakPolarHBondContact O-CB 3.39Å; A554-L558 PolarHBondContact O-N 2.98Å; A554-F559 PolarHBondContact O-N 3.36Å; A554-F560 VanDerWaalsContact C-CB 3.49Å; A554-F560 HydrophobicContact CB-CB 3.74Å; A554-F560 HydrophobicContact CB-CD1 4.4Å; A554-F560 HydrophobicContact CB-CG 4.11Å; A554-F560 WeakPolarHBondContact O-CB 3.4Å; A554-F560 PolarHBondContact O-N 2.97Å; A554-F560 VanDerWaalsContact O-N 3.09Å; A554-I753 HydrophobicContact CB-CG2 4.26Å; A554-A757 HydrophobicContact CB-CB 4.16Å
555	D	97.2	Very high	96.3	Very high	54 Å²	54	58.4 Å²	58.4	29%	0.289	27%	0.274	S	S	.	.	H	α-helix	trans	-69	-51.7	177.2	-76.1	-25.1	0	0	0	112.9	Y551 L553 Y557 F560 N561	Y551-D555 WeakPolarHBondContact O-CB 3.31Å; Y551-D555 PolarHBondContact O-N 3.29Å; L553-D555 VanDerWaalsContact C-N 3.34Å; L553-D555 PolarHBondContact O-N 2.81Å; D555-Y557 VanDerWaalsContact C-N 3.32Å; D555-Y557 PolarHBondContact O-N 2.67Å; D555-F560 WeakPolarHBondContact OD1-CB 3.4Å; D555-F560 WeakPolarHBondContact OD1-CD1 3.35Å; D555-N561 WeakPolarHBondContact CB-ND2 3.47Å; D555-N561 PolarHBondContact OD1-N 3.14Å; D555-N561 VanDerWaalsContact OD1-N 3.16Å; D555-N561 PolarHBondContact OD1-ND2 3.44Å; D555-N561 PolarHBondContact OD2-ND2 2.53Å
556	T	96.2	Very high	96	Very high	76 Å²	76	52.8 Å²	52.8	47%	0.466	26%	0.256	S	S	.	.	H	α-helix	trans	-69.7	-30.2	-170.9	-51.7	0	0	0	0	112.3	N552 L553	N552-T556 WeakPolarHBondContact O-CB 3.49Å; N552-T556 PolarHBondContact O-N 2.88Å; N552-T556 VanDerWaalsContact O-N 3.1Å; N552-T556 PolarHBondContact O-OG1 3.17Å; L553-T556 PolarHBondContact O-N 2.78Å
557	Y	95.7	Very high	95.6	Very high	70 Å²	70	53 Å²	53	28%	0.275	26%	0.257	S	S	.	.	H	α-helix	trans	-128.1	-22.1	-168.8	-57.3	-67.1	0	0	0	115.6	L553 D555 I691 L702	L553-Y557 HydrophobicContact CG-CD2 4.27Å; L553-Y557 PolarHBondContact O-N 2.98Å; D555-Y557 VanDerWaalsContact C-N 3.32Å; D555-Y557 PolarHBondContact O-N 2.67Å; Y557-I691 WeakPolarHBondContact O-CD1 3.48Å; Y557-L702 HydrophobicContact CD1-CD1 3.61Å; Y557-L702 HydrophobicContact CD1-CG 4.25Å; Y557-L702 HydrophobicContact CD2-CD1 3.99Å; Y557-L702 HydrophobicContact CD2-CD2 4.18Å; Y557-L702 HydrophobicContact CD2-CG 3.71Å; Y557-L702 HydrophobicContact CE1-CD1 4.11Å; Y557-L702 HydrophobicContact CE2-CD1 4.46Å; Y557-L702 HydrophobicContact CE2-CG 4.1Å; Y557-L702 VanDerWaalsContact CE2-O 3.31Å; Y557-L702 WeakPolarHBondContact CE2-O 3.31Å; Y557-L702 HydrophobicContact CG-CD1 3.54Å; Y557-L702 HydrophobicContact CG-CD2 4.27Å; Y557-L702 HydrophobicContact CG-CG 3.81Å; Y557-L702 PolarHBondContact OH-O 3.47Å
558	L	97	Very high	95.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-115	13.7	-176.3	-49.6	178.4	0	0	0	112.8	L553 A554 F560 I688 I691 I753 L756 A757	L553-L558 HydrophobicContact CD2-CD1 3.77Å; L553-L558 HydrophobicContact CD2-CG 4.03Å; A554-L558 CarbonylContact O-C 3.54Å; A554-L558 VanDerWaalsContact O-C 3.22Å; A554-L558 VanDerWaalsContact O-CA 3.3Å; A554-L558 WeakPolarHBondContact O-CA 3.22Å; A554-L558 WeakPolarHBondContact O-CB 3.39Å; A554-L558 PolarHBondContact O-N 2.98Å; L558-F560 VanDerWaalsContact C-N 3.3Å; L558-F560 PolarHBondContact O-N 3.04Å; L558-I688 HydrophobicContact CB-CG1 4.38Å; L558-I688 HydrophobicContact CD2-CG1 4.48Å; L558-I688 HydrophobicContact CD2-CG2 4.43Å; L558-I691 HydrophobicContact CD2-CB 4.4Å; L558-I691 HydrophobicContact CD2-CG2 3.85Å; L558-I753 HydrophobicContact CB-CG2 3.52Å; L558-I753 HydrophobicContact CD1-CG2 4.28Å; L558-L756 HydrophobicContact CD1-CB 4.03Å; L558-A757 HydrophobicContact CD1-CB 4.44Å
559	F	96.4	Very high	95.4	Very high	36 Å²	36	46.5 Å²	46.5	16%	0.158	23%	0.227	C	C	.	.			trans	60.1	28.9	175.4	-42.3	-77	0	0	0	114.9	A554 N561 E562 L563 R684 R687 I688	A554-F559 PolarHBondContact O-N 3.36Å; F559-N561 PolarHBondContact O-N 1.81Å; F559-E562 HydrophobicContact CB-CB 4.44Å; F559-E562 WeakPolarHBondContact O-CA 3.46Å; F559-E562 WeakPolarHBondContact O-CB 3.48Å; F559-E562 PolarHBondContact O-N 3.35Å; F559-L563 HydrophobicContact CB-CD1 3.95Å; F559-L563 HydrophobicContact CB-CG 4.16Å; F559-L563 WeakPolarHBondContact O-CG 3.45Å; F559-L563 PolarHBondContact O-N 2.68Å; F559-R684 HydrophobicContact CD2-CB 4.21Å; F559-R684 HydrophobicContact CD2-CG 4.25Å; F559-R684 HydrophobicContact CG-CG 4.45Å; F559-R687 HydrophobicContact CE2-CB 4.02Å; F559-R687 HydrophobicContact CE2-CG 3.86Å; F559-R687 HydrophobicContact CZ-CB 4.4Å; F559-R687 HydrophobicContact CZ-CG 3.86Å; F559-I688 HydrophobicContact CD2-CD1 4.17Å; F559-I688 HydrophobicContact CD2-CG1 4.03Å; F559-I688 HydrophobicContact CE2-CG1 4.31Å
560	F	96.6	Very high	95.4	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.044	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-48.7	-170.6	-178.1	-118.4	0	0	0	114.2	Y551 A554 D555 L558 E562 L563 E564 I753 P754	Y551-F560 HydrophobicContact CD1-CD1 4.21Å; Y551-F560 AromaticContact CD1-CE1 3.85Å; Y551-F560 HydrophobicContact CD1-CE1 3.85Å; Y551-F560 AromaticContact CE1-CE1 3.93Å; Y551-F560 HydrophobicContact CE1-CE1 3.93Å; Y551-F560 HydrophobicContact CE1-CZ 4.4Å; A554-F560 VanDerWaalsContact C-CB 3.49Å; A554-F560 HydrophobicContact CB-CB 3.74Å; A554-F560 HydrophobicContact CB-CD1 4.4Å; A554-F560 HydrophobicContact CB-CG 4.11Å; A554-F560 WeakPolarHBondContact O-CB 3.4Å; A554-F560 PolarHBondContact O-N 2.97Å; A554-F560 VanDerWaalsContact O-N 3.09Å; D555-F560 WeakPolarHBondContact OD1-CB 3.4Å; D555-F560 WeakPolarHBondContact OD1-CD1 3.35Å; L558-F560 VanDerWaalsContact C-N 3.3Å; L558-F560 PolarHBondContact O-N 3.04Å; F560-E562 PolarHBondContact O-N 3.13Å; F560-L563 PolarHBondContact O-N 3.24Å; F560-E564 HydrophobicContact CD2-CB 4.34Å; F560-E564 HydrophobicContact CE1-CG 4.47Å; F560-E564 HydrophobicContact CE2-CB 3.86Å; F560-E564 HydrophobicContact CE2-CG 3.98Å; F560-E564 HydrophobicContact CZ-CB 4Å; F560-E564 HydrophobicContact CZ-CG 3.72Å; F560-E564 PolarHBondContact O-N 3.39Å; F560-I753 HydrophobicContact CB-CG2 3.89Å; F560-I753 HydrophobicContact CD2-CB 3.95Å; F560-I753 HydrophobicContact CD2-CG2 4.01Å; F560-I753 HydrophobicContact CG-CG2 4.34Å; F560-P754 HydrophobicContact CD2-CG 3.97Å; F560-P754 HydrophobicContact CE1-CG 4.32Å; F560-P754 HydrophobicContact CE2-CG 3.54Å; F560-P754 HydrophobicContact CZ-CG 3.75Å
561	N	94.4	Very high	95.3	Very high	123 Å²	123	46.2 Å²	46.2	66%	0.658	23%	0.225	S	C	*	.	H	α-helix	trans	-46.7	-24.8	167.7	-82	-65.1	0	0	0	116	D555 F559	D555-N561 WeakPolarHBondContact CB-ND2 3.47Å; D555-N561 PolarHBondContact OD1-N 3.14Å; D555-N561 VanDerWaalsContact OD1-N 3.16Å; D555-N561 PolarHBondContact OD1-ND2 3.44Å; D555-N561 PolarHBondContact OD2-ND2 2.53Å; F559-N561 PolarHBondContact O-N 1.81Å
562	E	92.6	Very high	95	Very high	83 Å²	83	43.1 Å²	43.1	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-99.6	-10.2	178	-60.4	-166.4	-104	0	0	113.7	F559 F560 R684	F559-E562 HydrophobicContact CB-CB 4.44Å; F559-E562 WeakPolarHBondContact O-CA 3.46Å; F559-E562 WeakPolarHBondContact O-CB 3.48Å; F559-E562 PolarHBondContact O-N 3.35Å; F560-E562 PolarHBondContact O-N 3.13Å; E562-R684 IonicContact OE1-CZ 3.97Å; E562-R684 IonicContact OE1-NH1 2.8Å; E562-R684 PolarHBondContact OE1-NH1 2.92Å; E562-R684 IonicContact OE1-NH2 3.21Å; E562-R684 PolarHBondContact OE1-NH2 2.76Å; E562-R684 IonicContact OE2-CZ 2.53Å; E562-R684 IonicContact OE2-NE 2.83Å; E562-R684 IonicContact OE2-NH1 2.63Å; E562-R684 IonicContact OE2-NH2 3.84Å; E562-R684 PolarHBondContact OE2-NH2 2.88Å
563	L	94	Very high	94.7	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-123.7	-16.7	-167.2	-65.5	-176.8	0	0	0	115.1	F559 F560 E565 C566 D567 L681 R684 Y685 I688 I753	F559-L563 HydrophobicContact CB-CD1 3.95Å; F559-L563 HydrophobicContact CB-CG 4.16Å; F559-L563 WeakPolarHBondContact O-CG 3.45Å; F559-L563 PolarHBondContact O-N 2.68Å; F560-L563 PolarHBondContact O-N 3.24Å; L563-E565 PolarHBondContact O-N 2.92Å; L563-C566 CarbonylContact O-C 3.53Å; L563-C566 VanDerWaalsContact O-C 3.23Å; L563-C566 WeakPolarHBondContact O-CA 3.46Å; L563-C566 PolarHBondContact O-N 2.9Å; L563-C566 PolarHBondContact O-SG 2.92Å; L563-C566 VanDerWaalsContact O-SG 3.36Å; L563-D567 PolarHBondContact O-N 2.74Å; L563-L681 HydrophobicContact CD2-CD1 3.49Å; L563-L681 VanDerWaalsContact CD2-CD1 3.49Å; L563-R684 HydrophobicContact CD1-CB 4.33Å; L563-R684 HydrophobicContact CD2-CB 4.45Å; L563-Y685 HydrophobicContact CD1-CD2 4.34Å; L563-Y685 HydrophobicContact CD1-CE2 3.8Å; L563-Y685 HydrophobicContact CD2-CE2 4.02Å; L563-Y685 HydrophobicContact CG-CE2 4.44Å; L563-I688 HydrophobicContact CD1-CD1 3.55Å; L563-I753 HydrophobicContact CD1-CD1 4.26Å; L563-I753 HydrophobicContact CD1-CG1 4.32Å
564	E	93.4	Very high	94.1	Very high	72 Å²	72	44.7 Å²	44.7	34%	0.336	22%	0.224	S	C	.	.	S	Bend	trans	-45.8	-54.2	-176	-177.6	169.1	-152	0	0	113.3	F560 C566 D567 Q751	F560-E564 HydrophobicContact CD2-CB 4.34Å; F560-E564 HydrophobicContact CE1-CG 4.47Å; F560-E564 HydrophobicContact CE2-CB 3.86Å; F560-E564 HydrophobicContact CE2-CG 3.98Å; F560-E564 HydrophobicContact CZ-CB 4Å; F560-E564 HydrophobicContact CZ-CG 3.72Å; F560-E564 PolarHBondContact O-N 3.39Å; E564-C566 PolarHBondContact O-N 2.91Å; E564-D567 WeakPolarHBondContact O-CB 3.24Å; E564-D567 PolarHBondContact O-N 2.69Å; E564-Q751 PolarHBondContact O-OE1 3.42Å
565	E	91.7	Very high	92.7	Very high	176 Å²	176	48.7 Å²	48.7	82%	0.822	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-39	178.5	-65.6	-65.7	169.5	0	0	112.6	L563 D567 K778	L563-E565 PolarHBondContact O-N 2.92Å; E565-D567 PolarHBondContact O-N 3.2Å; E565-K778 PolarHBondContact O-NZ 3.21Å
566	C	90	Very high	91	Very high	22 Å²	22	49.8 Å²	49.8	15%	0.149	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	24.2	-179.3	62.6	0	0	0	0	114.4	L563 E564 Q568 W677	L563-C566 CarbonylContact O-C 3.53Å; L563-C566 VanDerWaalsContact O-C 3.23Å; L563-C566 WeakPolarHBondContact O-CA 3.46Å; L563-C566 PolarHBondContact O-N 2.9Å; L563-C566 PolarHBondContact O-SG 2.92Å; L563-C566 VanDerWaalsContact O-SG 3.36Å; E564-C566 PolarHBondContact O-N 2.91Å; C566-Q568 PolarHBondContact O-NE2 2.74Å; C566-W677 HydrophobicContact CB-CH2 4.05Å; C566-W677 HydrophobicContact CB-CZ2 3.98Å
567	D	91.4	Very high	89.2	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.027	26%	0.255	C	S	.	.			trans	-51.3	149.4	175.6	-174.8	46.7	0	0	0	113.2	L563 E564 E565 Q751 F752 K778	L563-D567 PolarHBondContact O-N 2.74Å; E564-D567 WeakPolarHBondContact O-CB 3.24Å; E564-D567 PolarHBondContact O-N 2.69Å; E565-D567 PolarHBondContact O-N 3.2Å; D567-Q751 HydrophobicContact CB-CG 4.41Å; D567-Q751 VanDerWaalsContact OD2-CA 3.3Å; D567-Q751 WeakPolarHBondContact OD2-CA 3.16Å; D567-Q751 WeakPolarHBondContact OD2-CB 3.43Å; D567-Q751 WeakPolarHBondContact OD2-CG 3.43Å; D567-F752 VanDerWaalsContact OD1-CB 3.22Å; D567-F752 WeakPolarHBondContact OD1-CB 3.22Å; D567-F752 PolarHBondContact OD1-N 2.81Å; D567-F752 PolarHBondContact OD2-N 3.49Å; D567-K778 VanDerWaalsContact N-NZ 3.16Å; D567-K778 WeakPolarHBondContact O-CE 3.27Å; D567-K778 PolarHBondContact O-NZ 2.77Å
568	Q	94.9	Very high	87.6	Confident	46 Å²	46	46.5 Å²	46.5	22%	0.215	25%	0.247	C	C	.	.			trans	-126.2	154.9	-165.4	-61.5	-66.8	-47.9	0	0	111.8	C566 I574 Y685 F752	C566-Q568 PolarHBondContact O-NE2 2.74Å; Q568-I574 HydrophobicContact CG-CD1 3.58Å; Q568-I574 HydrophobicContact CG-CG1 4.13Å; Q568-Y685 HydrophobicContact CB-CE1 3.89Å; Q568-Y685 HydrophobicContact CG-CE1 3.74Å; Q568-Y685 HydrophobicContact CG-CE2 4.08Å; Q568-Y685 VanDerWaalsContact CG-CZ 3.49Å; Q568-Y685 WeakPolarHBondContact CG-OH 3.42Å; Q568-F752 VanDerWaalsContact O-CB 3.24Å; Q568-F752 WeakPolarHBondContact O-CB 3.42Å
569	V	96.8	Very high	86.2	Confident	15 Å²	15	50.6 Å²	50.6	9%	0.091	27%	0.269	C	S	.	.	S	Bend	trans	-72.8	-37.8	176.8	175.2	0	0	0	0	111.5	Y774 S775 V779	V569-Y774 HydrophobicContact CG1-CD1 4.48Å; V569-Y774 CarbonylContact O-C 3.53Å; V569-Y774 WeakPolarHBondContact O-CA 3.47Å; V569-S775 PolarHBondContact O-N 3.49Å; V569-V779 HydrophobicContact CG1-CG2 4.16Å; V569-V779 HydrophobicContact CG2-CB 4.32Å; V569-V779 HydrophobicContact CG2-CG1 3.66Å; V569-V779 HydrophobicContact CG2-CG2 3.65Å
570	H	97.1	Very high	84.8	Confident	16 Å²	16	53.3 Å²	53.3	7%	0.074	28%	0.279	C	S	.	.	S	Bend	trans	-147.1	152.9	-173.8	-172.5	-99	0	0	0	113.3	D572 D573 E771 I773 Y774 R791	H570-D572 VanDerWaalsContact CE1-CB 3.48Å; H570-D572 WeakPolarHBondContact CE1-CB 3.34Å; H570-D572 IonicContact CE1-OD1 3.54Å; H570-D572 IonicContact CE1-OD2 3.49Å; H570-D572 PolarHBondContact CE1-OD2 2.87Å; H570-D572 WeakPolarHBondContact ND1-CB 3.3Å; H570-D572 PolarHBondContact ND1-N 3.17Å; H570-D572 VanDerWaalsContact ND1-N 3.14Å; H570-D572 IonicContact ND1-OD2 2.77Å; H570-D572 PolarHBondContact O-N 2.95Å; H570-D573 WeakPolarHBondContact CB-OD2 3.47Å; H570-D573 PolarHBondContact N-OD2 2.8Å; H570-D573 PolarHBondContact O-N 2.63Å; H570-E771 WeakPolarHBondContact NE2-CA 3.33Å; H570-E771 CovalentContact NE2-O 1.81Å; H570-E771 PolarHBondContact NE2-O 3.33Å; H570-I773 PolarHBondContact CD2-O 3.06Å; H570-Y774 HydrophobicContact CB-CD1 4.23Å; H570-Y774 HydrophobicContact CB-CE1 4.39Å; H570-Y774 AromaticContact CD2-CD1 3.66Å; H570-Y774 AromaticContact CD2-CE1 3.43Å; H570-Y774 VanDerWaalsContact CD2-CE1 3.43Å; H570-Y774 WeakPolarHBondContact CD2-CE1 3.44Å; H570-Y774 AromaticContact CD2-CZ 3.78Å; H570-Y774 AromaticContact NE2-CZ 3.89Å; H570-R791 PolarHBondContact NE2-NH1 2.79Å
571	I	95.4	Very high	83.3	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-17	-178.7	-167.6	57.6	0	0	0	114.8	Y685 I688 R689 F752 I770 E771	I571-Y685 HydrophobicContact CD1-CD1 4.09Å; I571-Y685 WeakPolarHBondContact CD1-O 3.4Å; I571-I688 HydrophobicContact CD1-CG2 4.32Å; I571-R689 HydrophobicContact CD1-CB 4.24Å; I571-R689 HydrophobicContact CG1-CB 4.23Å; I571-R689 HydrophobicContact CG1-CG 4.3Å; I571-R689 PolarHBondContact O-NH2 3.42Å; I571-R689 VanDerWaalsContact O-NH2 3.17Å; I571-F752 HydrophobicContact CB-CE1 4.34Å; I571-F752 HydrophobicContact CB-CZ 3.8Å; I571-F752 HydrophobicContact CD1-CE1 4.01Å; I571-F752 HydrophobicContact CD1-CZ 4.22Å; I571-F752 HydrophobicContact CG1-CZ 4.48Å; I571-I770 HydrophobicContact CB-CD1 4.4Å; I571-I770 HydrophobicContact CB-CG1 4.11Å; I571-I770 HydrophobicContact CD1-CD1 3.64Å; I571-I770 HydrophobicContact CD1-CG1 4.29Å; I571-I770 HydrophobicContact CG1-CD1 3.74Å; I571-I770 HydrophobicContact CG1-CG1 3.92Å; I571-I770 HydrophobicContact CG2-CG1 4.36Å; I571-E771 HydrophobicContact CG2-CG 4.45Å
572	D	91.4	Very high	81.7	Confident	39 Å²	39	59.4 Å²	59.4	21%	0.209	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-6.3	-177.9	-65.8	-26.8	0	0	0	114.6	H570 I574 R575 R689	H570-D572 VanDerWaalsContact CE1-CB 3.48Å; H570-D572 WeakPolarHBondContact CE1-CB 3.34Å; H570-D572 IonicContact CE1-OD1 3.54Å; H570-D572 IonicContact CE1-OD2 3.49Å; H570-D572 PolarHBondContact CE1-OD2 2.87Å; H570-D572 WeakPolarHBondContact ND1-CB 3.3Å; H570-D572 PolarHBondContact ND1-N 3.17Å; H570-D572 VanDerWaalsContact ND1-N 3.14Å; H570-D572 IonicContact ND1-OD2 2.77Å; H570-D572 PolarHBondContact O-N 2.95Å; D572-I574 PolarHBondContact O-N 2.83Å; D572-I574 VanDerWaalsContact O-N 3.1Å; D572-R575 HydrophobicContact CB-CG 4.36Å; D572-R575 WeakPolarHBondContact O-CG 3.47Å; D572-R575 PolarHBondContact O-N 2.84Å; D572-R575 IonicContact OD1-CZ 2.7Å; D572-R575 IonicContact OD1-NE 2.67Å; D572-R575 PolarHBondContact OD1-NE 2.94Å; D572-R575 IonicContact OD1-NH2 2.87Å; D572-R575 PolarHBondContact OD1-NH2 3.49Å; D572-R575 IonicContact OD2-CZ 3.44Å; D572-R575 IonicContact OD2-NE 2.77Å; D572-R575 IonicContact OD2-NH2 3.18Å; D572-R575 PolarHBondContact OD2-NH2 3.44Å; D572-R689 IonicContact OD1-CZ 2.7Å; D572-R689 VanDerWaalsContact OD1-CZ 3.23Å; D572-R689 IonicContact OD1-NH1 3.53Å; D572-R689 PolarHBondContact OD1-NH1 3.13Å; D572-R689 IonicContact OD1-NH2 2.77Å; D572-R689 PolarHBondContact OD1-NH2 2.85Å
573	D	91.8	Very high	80.3	Confident	62 Å²	62	56.4 Å²	56.4	33%	0.332	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.5	-171.2	-78	-39.2	0	0	0	114.4	H570 R787	H570-D573 WeakPolarHBondContact CB-OD2 3.47Å; H570-D573 PolarHBondContact N-OD2 2.8Å; H570-D573 PolarHBondContact O-N 2.63Å; D573-R787 VanDerWaalsContact CG-NH1 3.35Å; D573-R787 IonicContact OD1-CZ 3.79Å; D573-R787 VanDerWaalsContact OD1-CZ 3.3Å; D573-R787 IonicContact OD1-NH1 2.85Å; D573-R787 PolarHBondContact OD1-NH1 3.07Å; D573-R787 IonicContact OD1-NH2 3.79Å; D573-R787 PolarHBondContact OD1-NH2 3Å; D573-R787 IonicContact OD2-CZ 3.78Å; D573-R787 IonicContact OD2-NH1 2.7Å; D573-R787 PolarHBondContact OD2-NH1 3.22Å; D573-R787 IonicContact OD2-NH2 3.3Å
574	I	83.7	Confident	78.4	Confident	25 Å²	25	63.8 Å²	63.8	13%	0.128	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	9.7	-177.3	-48.4	148.5	0	0	0	112.6	Q568 D572 G576 L681 Y685	Q568-I574 HydrophobicContact CG-CD1 3.58Å; Q568-I574 HydrophobicContact CG-CG1 4.13Å; D572-I574 PolarHBondContact O-N 2.83Å; D572-I574 VanDerWaalsContact O-N 3.1Å; I574-G576 PolarHBondContact O-N 2.84Å; I574-L681 HydrophobicContact CD1-CD1 4.38Å; I574-L681 HydrophobicContact CD1-CD2 3.88Å; I574-L681 HydrophobicContact CD1-CG 3.71Å; I574-L681 HydrophobicContact CG1-CD2 4.08Å; I574-L681 HydrophobicContact CG1-CG 4.34Å; I574-L681 HydrophobicContact CG2-CB 4.27Å; I574-L681 HydrophobicContact CG2-CD2 4.02Å; I574-L681 HydrophobicContact CG2-CG 4.04Å; I574-Y685 HydrophobicContact CD1-CD1 3.96Å; I574-Y685 HydrophobicContact CD1-CD2 3.23Å; I574-Y685 HydrophobicContact CD1-CE1 4.28Å; I574-Y685 HydrophobicContact CD1-CE2 3.59Å; I574-Y685 HydrophobicContact CD1-CG 3.44Å; I574-Y685 VanDerWaalsContact CD1-CG 3.44Å
575	R	69.2	Low	76.2	Confident	85 Å²	85	67.8 Å²	67.8	32%	0.321	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-59.6	-13.6	-173.1	-81.8	-173.4	-175.1	-153.8	17.2	116.4	D572 D577	D572-R575 HydrophobicContact CB-CG 4.36Å; D572-R575 WeakPolarHBondContact O-CG 3.47Å; D572-R575 PolarHBondContact O-N 2.84Å; D572-R575 IonicContact OD1-CZ 2.7Å; D572-R575 IonicContact OD1-NE 2.67Å; D572-R575 PolarHBondContact OD1-NE 2.94Å; D572-R575 IonicContact OD1-NH2 2.87Å; D572-R575 PolarHBondContact OD1-NH2 3.49Å; D572-R575 IonicContact OD2-CZ 3.44Å; D572-R575 IonicContact OD2-NE 2.77Å; D572-R575 IonicContact OD2-NH2 3.18Å; D572-R575 PolarHBondContact OD2-NH2 3.44Å; R575-D577 PolarHBondContact O-N 3.4Å
576	G	61.2	Low	74.1	Confident	76 Å²	76	63.3 Å²	63.3	78%	0.784	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.8	-36	-168.2	0	0	0	0	0	116.4	I574	I574-G576 PolarHBondContact O-N 2.84Å
577	D	58.1	Low	71.9	Confident	57 Å²	57	71.3 Å²	71.3	31%	0.305	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-108.6	4.8	-170.6	-75.8	-59	0	0	0	114.6	R575 N579 M678	R575-D577 PolarHBondContact O-N 3.4Å; D577-N579 PolarHBondContact O-N 3.36Å; D577-M678 WeakPolarHBondContact OD2-CE 3.31Å
578	D	62	Low	69.9	Low	21 Å²	21	73.9 Å²	73.9	11%	0.112	38%	0.378	C	S	.	.			trans	-76.6	118.9	179.6	-164.7	-20.8	0	0	0	110.9	Y580 F683 R686	D578-Y580 WeakPolarHBondContact O-CD2 3.43Å; D578-Y580 PolarHBondContact O-N 2.66Å; D578-Y580 PolarHBondContact OD1-N 3.28Å; D578-F683 WeakPolarHBondContact OD1-CE1 3.44Å; D578-R686 IonicContact OD1-CZ 3.87Å; D578-R686 IonicContact OD1-NE 2.72Å; D578-R686 PolarHBondContact OD1-NE 3.32Å; D578-R686 IonicContact OD1-NH2 3.69Å; D578-R686 PolarHBondContact OD1-NH2 2.8Å; D578-R686 WeakPolarHBondContact OD2-CD 3.39Å; D578-R686 IonicContact OD2-CZ 2.78Å; D578-R686 IonicContact OD2-NE 2.98Å; D578-R686 PolarHBondContact OD2-NE 2.69Å; D578-R686 IonicContact OD2-NH2 3.67Å
579	N	68.7	Low	67.1	Low	85 Å²	85	75.5 Å²	75.5	46%	0.455	39%	0.388	S	S	.	.			trans	-80.4	4.5	177.8	73.2	-7.2	0	0	0	113.5	D577 Q581 F683	D577-N579 PolarHBondContact O-N 3.36Å; N579-Q581 PolarHBondContact ND2-OE1 3.44Å; N579-Q581 VanDerWaalsContact ND2-OE1 3.14Å; N579-Q581 PolarHBondContact O-N 2.97Å; N579-Q581 WeakPolarHBondContact OD1-CB 3.21Å; N579-Q581 PolarHBondContact OD1-N 2.85Å; N579-Q581 VanDerWaalsContact OD1-N 3.07Å; N579-F683 VanDerWaalsContact OD1-CE1 3.22Å; N579-F683 WeakPolarHBondContact OD1-CE1 3.4Å; N579-F683 WeakPolarHBondContact OD1-CZ 3.46Å
580	Y	65.3	Low	64.7	Low	94 Å²	94	80.4 Å²	80.4	37%	0.369	42%	0.42	S	S	.	.			trans	58.4	21.1	-178	-71.1	-87.5	0	0	0	115.1	L491 D578	L491-Y580 HydrophobicContact CD1-CD1 3.85Å; L491-Y580 HydrophobicContact CD1-CE1 4.32Å; D578-Y580 WeakPolarHBondContact O-CD2 3.43Å; D578-Y580 PolarHBondContact O-N 2.66Å; D578-Y580 PolarHBondContact OD1-N 3.28Å
581	Q	66.4	Low	62	Low	124 Å²	124	88.6 Å²	88.6	58%	0.579	46%	0.459	S	S	*	.			trans	-65.4	143.7	176.9	-174.5	170.2	0.5	0	0	112.2	N579 L583 R686	N579-Q581 PolarHBondContact ND2-OE1 3.44Å; N579-Q581 VanDerWaalsContact ND2-OE1 3.14Å; N579-Q581 PolarHBondContact O-N 2.97Å; N579-Q581 WeakPolarHBondContact OD1-CB 3.21Å; N579-Q581 PolarHBondContact OD1-N 2.85Å; N579-Q581 VanDerWaalsContact OD1-N 3.07Å; Q581-L583 PolarHBondContact O-N 3.32Å; Q581-R686 PolarHBondContact O-NH1 2.88Å; Q581-R686 PolarHBondContact O-NH2 2.93Å
582	D	60.5	Low	59.4	Low	137 Å²	137	91.5 Å²	91.5	73%	0.733	48%	0.483	S	S	*	.			trans	-60.6	119.1	-179.2	-74.5	-47.9	0	0	0	112.6	M584	D582-M584 VanDerWaalsContact C-N 3.27Å; D582-M584 PolarHBondContact O-N 2.62Å
583	L	63.1	Low	56.9	Low	20 Å²	20	95.8 Å²	95.8	11%	0.105	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-79.3	-4.9	-176.7	-70.3	168	0	0	0	114	Q581 N585 F586 F683 R686 R687	Q581-L583 PolarHBondContact O-N 3.32Å; L583-N585 PolarHBondContact O-N 3.02Å; L583-N585 VanDerWaalsContact O-N 3.1Å; L583-F586 HydrophobicContact CB-CB 4.48Å; L583-F586 HydrophobicContact CD2-CB 3.81Å; L583-F586 HydrophobicContact CD2-CD2 4.49Å; L583-F586 HydrophobicContact CD2-CG 4.08Å; L583-F586 WeakPolarHBondContact O-CB 3.29Å; L583-F586 PolarHBondContact O-N 2.9Å; L583-F683 HydrophobicContact CD2-CB 3.99Å; L583-F683 HydrophobicContact CD2-CD1 4.44Å; L583-F683 HydrophobicContact CD2-CG 4.14Å; L583-R686 HydrophobicContact CD1-CB 4.28Å; L583-R686 HydrophobicContact CD1-CG 3.93Å; L583-R687 HydrophobicContact CD1-CB 4.06Å
584	M	54.3	Low	54.1	Low	158 Å²	158	95 Å²	95	78%	0.778	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.2	-178.6	-64.4	-63.3	172.6	0	0	113.6	D582	D582-M584 VanDerWaalsContact C-N 3.27Å; D582-M584 PolarHBondContact O-N 2.62Å
585	N	46.6	Very low	51.7	Low	155 Å²	155	100 Å²	100	83%	0.829	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-108.6	6	175.5	-66.4	-31.2	0	0	0	113.2	L583 R587	L583-N585 PolarHBondContact O-N 3.02Å; L583-N585 VanDerWaalsContact O-N 3.1Å; N585-R587 VanDerWaalsContact C-N 3.33Å; N585-R587 PolarHBondContact O-N 2.85Å
586	F	47.5	Very low	50.2	Low	83 Å²	83	101.7 Å²	101.7	36%	0.364	55%	0.547	S	S	.	.			trans	-76.1	88.1	177.1	-169.2	-90.9	0	0	0	109.8	L583 S588 F683	L583-F586 HydrophobicContact CB-CB 4.48Å; L583-F586 HydrophobicContact CD2-CB 3.81Å; L583-F586 HydrophobicContact CD2-CD2 4.49Å; L583-F586 HydrophobicContact CD2-CG 4.08Å; L583-F586 WeakPolarHBondContact O-CB 3.29Å; L583-F586 PolarHBondContact O-N 2.9Å; F586-S588 PolarHBondContact O-N 2.72Å; F586-F683 HydrophobicContact CD2-CD2 4.21Å; F586-F683 AromaticContact CE2-CD2 3.84Å; F586-F683 HydrophobicContact CE2-CD2 3.84Å; F586-F683 HydrophobicContact CE2-CE2 4.27Å; F586-F683 HydrophobicContact CZ-CD2 4.38Å
587	R	44.4	Very low	49.1	Very low	189 Å²	189	101 Å²	101	71%	0.713	53%	0.53	S	S	*	.			trans	-69.1	116.6	172.4	-177.9	173.4	166.3	143.3	-2.8	108.9	N585 D589	N585-R587 VanDerWaalsContact C-N 3.33Å; N585-R587 PolarHBondContact O-N 2.85Å; R587-D589 WeakPolarHBondContact CD-OD1 3.38Å; R587-D589 IonicContact CZ-OD1 2.72Å; R587-D589 IonicContact NE-OD1 3.76Å; R587-D589 PolarHBondContact NE-OD1 2.67Å; R587-D589 IonicContact NE-OD2 2.77Å; R587-D589 IonicContact NH2-OD1 3.11Å; R587-D589 PolarHBondContact O-N 3.27Å
588	S	48.7	Very low	47.9	Very low	60 Å²	60	101.9 Å²	101.9	42%	0.42	54%	0.54	S	S	.	.			trans	-70.9	80.4	169.1	-58.9	0	0	0	0	109.6	F586 P590	F586-S588 PolarHBondContact O-N 2.72Å; S588-P590 VanDerWaalsContact O-CD 3.28Å; S588-P590 WeakPolarHBondContact O-CD 3.42Å
589	D	36.2	Very low	46.6	Very low	80 Å²	80	105.1 Å²	105.1	43%	0.428	56%	0.561	S	S	.	*			trans	-71.5	115.7	178.1	-83.2	-46.3	0	0	0	111	R587 E591 A592	R587-D589 WeakPolarHBondContact CD-OD1 3.38Å; R587-D589 IonicContact CZ-OD1 2.72Å; R587-D589 IonicContact NE-OD1 3.76Å; R587-D589 PolarHBondContact NE-OD1 2.67Å; R587-D589 IonicContact NE-OD2 2.77Å; R587-D589 IonicContact NH2-OD1 3.11Å; R587-D589 PolarHBondContact O-N 3.27Å; D589-E591 PolarHBondContact O-N 3.09Å; D589-A592 PolarHBondContact O-N 2.89Å
590	P	47.1	Very low	45.1	Very low	117 Å²	117	106.1 Å²	106.1	76%	0.76	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-64.8	-22	-177.7	-21.8	34.5	0	0	0	113.5	S588	S588-P590 VanDerWaalsContact O-CD 3.28Å; S588-P590 WeakPolarHBondContact O-CD 3.42Å
591	E	40.3	Very low	43.7	Very low	189 Å²	189	107 Å²	107	88%	0.883	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-89.7	0.6	-174.4	-58.9	-176.6	156.9	0	0	113.2	D589 Y593	D589-E591 PolarHBondContact O-N 3.09Å; E591-Y593 PolarHBondContact O-N 3.11Å
592	A	40.5	Very low	42.2	Very low	66 Å²	66	108.7 Å²	108.7	55%	0.545	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-74.8	-4.3	177.7	0	0	0	0	0	114.2	D589	D589-A592 PolarHBondContact O-N 2.89Å
593	Y	39.1	Very low	41	Very low	128 Å²	128	106.3 Å²	106.3	50%	0.502	58%	0.583	S	S	.	*			trans	-100.4	74.7	174.8	-104.6	-73.9	0	0	0	111.7	E591 D595	E591-Y593 PolarHBondContact O-N 3.11Å; Y593-D595 PolarHBondContact O-N 3.09Å
594	G	32.8	Very low	39.6	Very low	47 Å²	47	112.3 Å²	112.3	49%	0.485	61%	0.613	S	S	.	*			trans	-76.3	100.1	168.7	0	0	0	0	0	112	N596	G594-N596 PolarHBondContact O-N 3.41Å; G594-N596 PolarHBondContact O-ND2 2.83Å
595	D	34.4	Very low	38.6	Very low	130 Å²	130	111.1 Å²	111.1	70%	0.695	61%	0.609	S	S	*	*	S	Bend	trans	46.6	-12.7	159.6	-71.1	-31.8	0	0	0	122	Y593 S597 S598	Y593-D595 PolarHBondContact O-N 3.09Å; D595-S597 VanDerWaalsContact C-N 3.33Å; D595-S597 PolarHBondContact O-N 2.92Å; D595-S598 PolarHBondContact O-OG 2.96Å
596	N	37.2	Very low	37.8	Very low	119 Å²	119	110.9 Å²	110.9	64%	0.636	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-8	-169.9	-68.9	-70.6	0	0	0	114.7	G594 S598 T599	G594-N596 PolarHBondContact O-N 3.41Å; G594-N596 PolarHBondContact O-ND2 2.83Å; N596-S598 PolarHBondContact O-N 3.46Å; N596-T599 PolarHBondContact O-N 2.87Å; N596-T599 VanDerWaalsContact O-N 3.15Å
597	S	37.4	Very low	36.8	Very low	63 Å²	63	113.4 Å²	113.4	44%	0.441	64%	0.635	S	S	.	*	H	α-helix	trans	-62.1	-32.2	-176.5	-150.3	0	0	0	0	112.7	D595 T599 T601	D595-S597 VanDerWaalsContact C-N 3.33Å; D595-S597 PolarHBondContact O-N 2.92Å; S597-T599 PolarHBondContact O-N 3.16Å; S597-T601 PolarHBondContact O-OG1 3.39Å
598	S	34.3	Very low	36.3	Very low	74 Å²	74	108.9 Å²	108.9	52%	0.517	63%	0.632	S	S	.	*	H	α-helix	trans	-62.6	-22.2	177.1	59.1	0	0	0	0	114.8	D595 N596	D595-S598 PolarHBondContact O-OG 2.96Å; N596-S598 PolarHBondContact O-N 3.46Å
599	T	33.6	Very low	35.3	Very low	90 Å²	90	111.9 Å²	111.9	55%	0.552	65%	0.653	S	S	*	*	H	α-helix	trans	-93.4	-30.3	-173.2	-55.9	0	0	0	0	112.6	N596 S597 Q602	N596-T599 PolarHBondContact O-N 2.87Å; N596-T599 VanDerWaalsContact O-N 3.15Å; S597-T599 PolarHBondContact O-N 3.16Å; T599-Q602 PolarHBondContact O-N 2.94Å
600	I	38.1	Very low	35.3	Very low	106 Å²	106	113.8 Å²	113.8	54%	0.544	67%	0.672	S	S	.	*	H	α-helix	trans	-68.9	-39.8	-176.9	-60.6	177.2	0	0	0	110.7	Q602 S603	I600-Q602 PolarHBondContact O-N 2.87Å; I600-S603 PolarHBondContact O-N 3.12Å; I600-S603 VanDerWaalsContact O-N 3.08Å; I600-S603 PolarHBondContact O-OG 3.49Å
601	T	35.9	Very low	34.6	Very low	112 Å²	112	114.6 Å²	114.6	69%	0.687	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-22.3	-179.1	-27.2	0	0	0	0	113.3	S597	S597-T601 PolarHBondContact O-OG1 3.39Å
602	Q	33.5	Very low	34.5	Very low	160 Å²	160	111.2 Å²	111.2	75%	0.748	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-15.3	175.6	-63.5	-169.4	5.6	0	0	113.5	T599 I600 I604	T599-Q602 PolarHBondContact O-N 2.94Å; I600-Q602 PolarHBondContact O-N 2.87Å; Q602-I604 VanDerWaalsContact C-N 3.33Å; Q602-I604 PolarHBondContact O-N 3.2Å
603	S	35.4	Very low	34.4	Very low	86 Å²	86	112.8 Å²	112.8	60%	0.601	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	3.3	-172	65.1	0	0	0	0	115.7	I600	I600-S603 PolarHBondContact O-N 3.12Å; I600-S603 VanDerWaalsContact O-N 3.08Å; I600-S603 PolarHBondContact O-OG 3.49Å
604	I	35.2	Very low	34.3	Very low	147 Å²	147	112.1 Å²	112.1	75%	0.754	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-8.8	-175.5	-65.4	177.9	0	0	0	112.5	Q602	Q602-I604 VanDerWaalsContact C-N 3.33Å; Q602-I604 PolarHBondContact O-N 3.2Å
605	I	32	Very low	34.5	Very low	133 Å²	133	115.1 Å²	115.1	68%	0.682	71%	0.707	S	S	*	*	S	Bend	trans	-122.4	148.4	177	-49.5	-179.3	0	0	0	108.4
606	L	29.5	Very low	34.6	Very low	150 Å²	150	114.9 Å²	114.9	79%	0.785	71%	0.711	S	S	*	*			trans	79.9	58.6	-177.3	-54.7	169.6	0	0	0	116.7	S608	L606-S608 VanDerWaalsContact C-N 3.26Å; L606-S608 PolarHBondContact O-N 2.79Å
607	S	26.7	Very low	34.6	Very low	136 Å²	136	114.8 Å²	114.8	95%	0.951	71%	0.714	S	S	*	*			trans	-87.6	55.2	152.8	49.4	0	0	0	0	111.9
608	S	34.3	Very low	34.5	Very low	94 Å²	94	118.7 Å²	118.7	66%	0.657	73%	0.729	S	S	*	*			trans	-138.5	112.2	179.2	45.4	0	0	0	0	112.4	L606	L606-S608 VanDerWaalsContact C-N 3.26Å; L606-S608 PolarHBondContact O-N 2.79Å
609	S	28.8	Very low	34.5	Very low	122 Å²	122	120.4 Å²	120.4	85%	0.853	74%	0.737	S	S	*	*			trans	-85.3	139.9	-177.5	49.9	0	0	0	0	113.1
610	S	35.3	Very low	34.7	Very low	120 Å²	120	121.3 Å²	121.3	84%	0.839	74%	0.742	S	S	*	*			trans	-155.4	153.6	152.4	56.2	0	0	0	0	110.6
611	T	32.8	Very low	34.6	Very low	135 Å²	135	122.4 Å²	122.4	83%	0.828	75%	0.754	S	S	*	*			trans	-130.6	123.1	-162.4	51.7	0	0	0	0	113.2
612	S	37.6	Very low	34.7	Very low	118 Å²	118	122.3 Å²	122.3	83%	0.825	75%	0.753	S	S	*	*			trans	175.1	154.2	156	45.9	0	0	0	0	111
613	S	38.4	Very low	34.9	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	76%	0.758	S	S	*	*			cis	179.3	135.2	-40.7	46.3	0	0	0	0	108.8
614	S	38.1	Very low	34.9	Very low	113 Å²	113	123.4 Å²	123.4	79%	0.79	76%	0.762	S	S	*	*			trans	64.9	114	155.4	-51.6	0	0	0	0	120.3
615	S	36.5	Very low	35.3	Very low	111 Å²	111	122 Å²	122	78%	0.776	76%	0.763	S	S	*	*				-172.2	118.6	108	-79.6	0	0	0	0	114.8
616	T	36.5	Very low	35.7	Very low	125 Å²	125	120.7 Å²	120.7	77%	0.767	76%	0.761	S	S	*	*			trans	-0.2	148.1	132.1	10.6	0	0	0	0	118.8
617	T	36.3	Very low	36.3	Very low	116 Å²	116	119.6 Å²	119.6	71%	0.712	76%	0.761	S	S	*	*			cis	-145.5	-160.9	14.8	-28.3	0	0	0	0	108.6
618	I	36.2	Very low	36.9	Very low	145 Å²	145	118 Å²	118	74%	0.744	75%	0.749	S	S	*	*			cis	-143.5	129.4	16.6	-61.2	177.3	0	0	0	106.2
619	T	35	Very low	37.1	Very low	111 Å²	111	118 Å²	118	68%	0.681	75%	0.75	S	S	*	*				44.2	142.9	99.2	7.5	0	0	0	0	116.5
620	T	36	Very low	37.7	Very low	109 Å²	109	119.5 Å²	119.5	67%	0.669	75%	0.747	S	S	*	*			cis	-161.5	131.7	28.9	6.9	0	0	0	0	113.3
621	T	37.7	Very low	37.9	Very low	129 Å²	129	121.1 Å²	121.1	79%	0.791	74%	0.742	S	S	*	*			trans	60.3	164.9	144.4	60	0	0	0	0	119.5
622	V	37.3	Very low	38.1	Very low	110 Å²	110	120.5 Å²	120.5	67%	0.667	74%	0.738	S	S	*	*			cis	-154.9	145.7	32.8	176.6	0	0	0	0	113
623	H	38.2	Very low	38.1	Very low	185 Å²	185	119.7 Å²	119.7	86%	0.856	73%	0.732	S	S	*	*			trans	61.9	130.2	160	-68.5	-36.9	0	0	0	124.9
624	A	34.2	Very low	38.2	Very low	83 Å²	83	120 Å²	120	69%	0.686	73%	0.734	S	S	*	*			trans	-111.5	-178.4	147.4	0	0	0	0	0	108.9
625	P	45.2	Very low	38.5	Very low	118 Å²	118	120.5 Å²	120.5	77%	0.766	74%	0.735	S	S	*	*				-142.1	-147.2	84.3	27	-0.9	0	0	0	111.7
626	T	39.7	Very low	38.7	Very low	105 Å²	105	122.6 Å²	122.6	64%	0.644	74%	0.736	S	S	*	*			cis	-167.1	140.5	12.4	-21.4	0	0	0	0	111.6
627	T	41	Very low	38.7	Very low	128 Å²	128	124.3 Å²	124.3	79%	0.785	74%	0.74	S	S	*	*			trans	56.4	158.8	150.1	44.4	0	0	0	0	120.5
628	S	39.2	Very low	38.9	Very low	101 Å²	101	122.3 Å²	122.3	71%	0.706	74%	0.743	S	S	*	*			cis	-176.4	164.9	-4	40.8	0	0	0	0	109.6
629	S	40.3	Very low	39.1	Very low	95 Å²	95	120.9 Å²	120.9	66%	0.664	75%	0.745	S	S	*	*			cis	175.3	133.3	-39.6	55.4	0	0	0	0	110.8
630	L	41	Very low	39.2	Very low	154 Å²	154	123.7 Å²	123.7	81%	0.806	75%	0.753	S	S	*	*			trans	67.6	155.8	166.9	-78.6	67.8	0	0	0	116.9
631	E	38.3	Very low	39.5	Very low	154 Å²	154	126.1 Å²	126.1	72%	0.72	76%	0.761	S	S	*	*			cis	-136.6	-143.4	-4.2	-137.3	-179.7	-124.6	0	0	110.8
632	T	37	Very low	40	Very low	122 Å²	122	124.8 Å²	124.8	75%	0.748	76%	0.757	S	S	*	*			cis	-153.1	178.7	10.6	-27.1	0	0	0	0	110.9
633	S	37.2	Very low	40.8	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	76%	0.762	S	S	*	*			trans	-98.5	-176.4	176.8	65	0	0	0	0	113.1
634	S	40.8	Very low	41.8	Very low	106 Å²	106	122 Å²	122	74%	0.741	76%	0.757	S	S	*	*			cis	-168.8	171.7	6.1	12.8	0	0	0	0	110.5
635	P	44.3	Very low	42.8	Very low	124 Å²	124	123.1 Å²	123.1	81%	0.805	76%	0.758	S	S	*	*			trans	-105.3	167.8	-165.5	40.4	-36.9	0	0	0	117.8
636	I	41.3	Very low	42.7	Very low	154 Å²	154	125.1 Å²	125.1	79%	0.79	76%	0.76	S	S	*	*			trans	-142.6	133	168.7	-62.9	-176.5	0	0	0	113
637	N	37.4	Very low	42.9	Very low	161 Å²	161	124.7 Å²	124.7	86%	0.861	76%	0.762	S	S	*	*			trans	6.3	144.5	157.2	-49.3	-22.9	0	0	0	123.4
638	G	39.1	Very low	42.9	Very low	74 Å²	74	123.4 Å²	123.4	76%	0.763	76%	0.758	S	S	*	*			trans	166.6	116.9	148.4	0	0	0	0	0	119.2
639	S	41.8	Very low	42.8	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	76%	0.764	S	S	*	*			trans	8	126.5	151.6	-53	0	0	0	0	120.8
640	M	37.3	Very low	42.8	Very low	171 Å²	171	126.3 Å²	126.3	84%	0.842	77%	0.765	S	S	*	*				82.8	141	63	-76.2	-103.5	79.8	0	0	116.5
641	L	41.1	Very low	42.7	Very low	159 Å²	159	124.1 Å²	124.1	83%	0.832	76%	0.762	S	S	*	*			trans	76.9	139.6	176.1	-53.2	169.4	0	0	0	116.8
642	S	47.6	Very low	42.8	Very low	102 Å²	102	121.5 Å²	121.5	71%	0.713	77%	0.767	S	S	*	*			cis	-167.7	152.9	-24.9	41.3	0	0	0	0	110.9
643	P	54.8	Low	42.9	Very low	117 Å²	117	120.6 Å²	120.6	76%	0.76	77%	0.772	S	S	*	*			trans	-96	-169.8	-173.3	42.2	-39	0	0	0	113.6
644	P	58.8	Low	43.4	Very low	118 Å²	118	121.3 Å²	121.3	77%	0.766	77%	0.774	S	S	*	*				-151.9	-157.3	86.8	50.5	-30.1	0	0	0	113.5
645	P	54.7	Low	43.1	Very low	107 Å²	107	124.4 Å²	124.4	70%	0.695	78%	0.782	S	S	*	*				-142.8	-154.2	-122.2	33.5	-4	0	0	0	117.2
646	I	43.6	Very low	42.6	Very low	160 Å²	160	123.6 Å²	123.6	82%	0.821	78%	0.775	S	S	*	*			trans	68.5	147.8	163.5	25.5	-178.2	0	0	0	119.1
647	S	44.7	Very low	42.5	Very low	96 Å²	96	123.5 Å²	123.5	67%	0.671	78%	0.776	S	S	*	*			cis	-157.4	157.2	7.5	49.5	0	0	0	0	115.5
648	S	40.7	Very low	42.3	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	77%	0.772	S	S	*	*			trans	63.7	142.4	152.4	54	0	0	0	0	120.4
649	L	38.1	Very low	42.2	Very low	159 Å²	159	127.5 Å²	127.5	83%	0.832	78%	0.775	S	S	*	*			cis	-151.7	170.1	-2.1	-144.1	73.8	0	0	0	112.4
650	S	40.3	Very low	41.9	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	77%	0.769	S	S	*	*			trans	-38.2	160.1	172.3	48.9	0	0	0	0	118.7
651	S	37.9	Very low	41.9	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	77%	0.773	S	S	*	*			cis	-164.4	148.9	2.5	38.5	0	0	0	0	109.4
652	A	40.3	Very low	41.8	Very low	99 Å²	99	126.7 Å²	126.7	82%	0.818	77%	0.774	S	S	*	*			cis	91.8	97.8	19.1	0	0	0	0	0	117
653	A	39.9	Very low	41.4	Very low	104 Å²	104	127.1 Å²	127.1	86%	0.86	77%	0.774	S	S	*	*			trans	-164.6	102.1	156.7	0	0	0	0	0	113
654	P	46.1	Very low	40.8	Very low	114 Å²	114	127 Å²	127	74%	0.74	77%	0.771	S	S	*	*			trans	-123.8	155.4	174.3	39.1	-27.8	0	0	0	114.6
655	L	36.1	Very low	39.8	Very low	171 Å²	171	132.5 Å²	132.5	90%	0.895	78%	0.777	S	S	*	*			trans	-143.8	110.3	158.6	-71.6	177.7	0	0	0	109.1
656	T	33.8	Very low	39.1	Very low	107 Å²	107	133.1 Å²	133.1	66%	0.656	78%	0.778	S	S	*	*				71.4	134.5	74	-23.2	0	0	0	0	116.1
657	N	37.7	Very low	38.8	Very low	152 Å²	152	131.8 Å²	131.8	81%	0.813	77%	0.773	S	S	*	*			trans	75.2	139.5	167.6	-59.1	-26	0	0	0	116.4
658	M	34	Very low	38.5	Very low	157 Å²	157	132.4 Å²	132.4	77%	0.773	77%	0.773	S	S	*	*			cis	-137	155.2	2.5	-71	-173.1	55.6	0	0	113.7
659	I	37.3	Very low	38.7	Very low	162 Å²	162	133.2 Å²	133.2	83%	0.831	78%	0.775	S	S	*	*			trans	0.6	125.8	142.5	-49.1	172.7	0	0	0	116.9
660	G	35.5	Very low	39	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	76%	0.763	S	S	*	*			trans	176.6	85	167	0	0	0	0	0	117.3
661	E	36.9	Very low	39.6	Very low	195 Å²	195	131.8 Å²	131.8	91%	0.911	76%	0.764	S	S	*	*			trans	60.7	167.6	153	-56	-170.3	154.3	0	0	120.7
662	I	38.7	Very low	40.6	Very low	166 Å²	166	133.5 Å²	133.5	85%	0.851	76%	0.76	S	S	*	*			trans	-116.7	124.7	-172.1	-59.9	168.7	0	0	0	110.3
663	P	39.5	Very low	42	Very low	112 Å²	112	130.3 Å²	130.3	73%	0.727	74%	0.737	S	S	*	*			trans	-103.8	118.5	153.1	-7.5	27.5	0	0	0	111.8
664	T	42.5	Very low	43.8	Very low	113 Å²	113	128.2 Å²	128.2	69%	0.693	72%	0.715	S	S	*	*			trans	18.5	126	143.1	53.7	0	0	0	0	119.8	V666	T664-V666 PolarHBondContact O-N 3.32Å
665	R	37.7	Very low	45.5	Very low	235 Å²	235	127 Å²	127	89%	0.887	70%	0.701	S	S	*	*			trans	-37.4	91.9	159.5	-179.9	-172.7	-178.2	173.6	1.7	112.9
666	V	39.7	Very low	47.7	Very low	120 Å²	120	121.9 Å²	121.9	73%	0.727	67%	0.673	S	S	*	*			trans	-70.8	127.1	167.1	179.1	0	0	0	0	107.7	T664 T668	T664-V666 PolarHBondContact O-N 3.32Å; V666-T668 PolarHBondContact O-N 2.81Å; V666-T668 VanDerWaalsContact O-N 3.08Å
667	N	38.1	Very low	50.2	Low	132 Å²	132	121.6 Å²	121.6	71%	0.706	66%	0.659	S	S	*	*			trans	-67.9	106.6	167.2	-69.2	-32	0	0	0	107.4	P669	N667-P669 VanDerWaalsContact O-CD 3.3Å; N667-P669 WeakPolarHBondContact O-CD 3.29Å; N667-P669 VanDerWaalsContact O-N 3.17Å
668	T	37.5	Very low	52.6	Low	109 Å²	109	117.6 Å²	117.6	67%	0.669	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-54.7	120.7	167.1	49.7	0	0	0	0	107.9	V666 T670	V666-T668 PolarHBondContact O-N 2.81Å; V666-T668 VanDerWaalsContact O-N 3.08Å; T668-T670 PolarHBondContact O-N 3.29Å
669	P	45.7	Very low	55.2	Low	118 Å²	118	113.1 Å²	113.1	77%	0.766	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-52.7	118.8	168.2	-22.8	33.8	0	0	0	106.7	N667 L671	N667-P669 VanDerWaalsContact O-CD 3.3Å; N667-P669 WeakPolarHBondContact O-CD 3.29Å; N667-P669 VanDerWaalsContact O-N 3.17Å; P669-L671 PolarHBondContact O-N 3.3Å; P669-L671 VanDerWaalsContact O-N 3.09Å
670	T	44.9	Very low	57.6	Low	94 Å²	94	108.8 Å²	108.8	58%	0.577	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.7	-156.3	47.5	0	0	0	0	109.9	T668 H672 G673	T668-T670 PolarHBondContact O-N 3.29Å; T670-H672 PolarHBondContact O-N 3Å; T670-G673 WeakPolarHBondContact O-CA 3.4Å; T670-G673 PolarHBondContact O-N 3.15Å
671	L	52.1	Low	60.3	Low	133 Å²	133	106 Å²	106	70%	0.696	56%	0.556	S	S	*	*	H	α-helix	trans	-56.1	-25.9	174.5	-148.9	85.2	0	0	0	111.7	P669 G673 S674 M675	P669-L671 PolarHBondContact O-N 3.3Å; P669-L671 VanDerWaalsContact O-N 3.09Å; L671-G673 VanDerWaalsContact C-N 3.31Å; L671-G673 PolarHBondContact O-N 3.23Å; L671-S674 PolarHBondContact O-OG 3.24Å; L671-M675 WeakPolarHBondContact O-CG 3.3Å; L671-M675 PolarHBondContact O-N 3.16Å
672	H	58.1	Low	62.9	Low	143 Å²	143	97 Å²	97	66%	0.662	52%	0.515	S	S	*	.	H	α-helix	trans	-58.9	-36.5	169.9	-169.7	64.4	0	0	0	113.3	T670 E676	T670-H672 PolarHBondContact O-N 3Å; H672-E676 VanDerWaalsContact O-CB 3.3Å; H672-E676 WeakPolarHBondContact O-CB 3.27Å; H672-E676 PolarHBondContact O-N 2.67Å
673	G	70.4	Confident	65.4	Low	33 Å²	33	89.9 Å²	89.9	34%	0.34	48%	0.478	S	S	.	.	H	α-helix	trans	-70.9	-39.9	179.9	0	0	0	0	0	113.5	T670 L671 E676 W677	T670-G673 WeakPolarHBondContact O-CA 3.4Å; T670-G673 PolarHBondContact O-N 3.15Å; L671-G673 VanDerWaalsContact C-N 3.31Å; L671-G673 PolarHBondContact O-N 3.23Å; G673-E676 PolarHBondContact O-N 2.96Å; G673-W677 WeakPolarHBondContact O-CB 3.45Å; G673-W677 PolarHBondContact O-N 2.87Å
674	S	77	Confident	68	Low	59 Å²	59	86 Å²	86	41%	0.413	45%	0.449	S	S	.	.	H	α-helix	trans	-68.4	-40.8	173.6	53.7	0	0	0	0	111.7	L671 W677 M678	L671-S674 PolarHBondContact O-OG 3.24Å; S674-W677 PolarHBondContact O-N 2.96Å; S674-M678 WeakPolarHBondContact O-CG 3.24Å; S674-M678 PolarHBondContact O-N 2.92Å
675	M	81.7	Confident	70.4	Confident	90 Å²	90	80.8 Å²	80.8	44%	0.443	42%	0.416	S	S	.	.	H	α-helix	trans	-63	-39.2	173.3	-73.2	-177.3	141.1	0	0	113.3	L671 M678 R679	L671-M675 WeakPolarHBondContact O-CG 3.3Å; L671-M675 PolarHBondContact O-N 3.16Å; M675-M678 HydrophobicContact CG-CE 4.36Å; M675-R679 WeakPolarHBondContact O-CB 3.25Å; M675-R679 PolarHBondContact O-N 2.85Å; M675-R679 VanDerWaalsContact O-N 3.07Å
676	E	83.6	Confident	73.1	Confident	62 Å²	62	71.3 Å²	71.3	29%	0.29	38%	0.381	S	S	.	.	H	α-helix	trans	-71.5	-35	175.7	-179.2	56.6	-160	0	0	112.2	H672 G673 R679 K680	H672-E676 VanDerWaalsContact O-CB 3.3Å; H672-E676 WeakPolarHBondContact O-CB 3.27Å; H672-E676 PolarHBondContact O-N 2.67Å; G673-E676 PolarHBondContact O-N 2.96Å; E676-R679 PolarHBondContact O-N 2.98Å; E676-R679 IonicContact OE2-CZ 4Å; E676-R679 IonicContact OE2-NH1 2.71Å; E676-R679 PolarHBondContact OE2-NH1 2.83Å; E676-K680 WeakPolarHBondContact O-CG 3.46Å; E676-K680 PolarHBondContact O-N 2.85Å; E676-K680 WeakPolarHBondContact OE1-CE 3.41Å
677	W	85.8	Confident	75.7	Confident	101 Å²	101	69.8 Å²	69.8	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-46	172.4	-179.7	88.6	0	0	0	111.9	C566 G673 S674 R679 K680 L681	C566-W677 HydrophobicContact CB-CH2 4.05Å; C566-W677 HydrophobicContact CB-CZ2 3.98Å; G673-W677 WeakPolarHBondContact O-CB 3.45Å; G673-W677 PolarHBondContact O-N 2.87Å; S674-W677 PolarHBondContact O-N 2.96Å; W677-R679 VanDerWaalsContact C-N 3.31Å; W677-R679 PolarHBondContact O-N 3.43Å; W677-K680 PolarHBondContact O-N 2.86Å; W677-L681 HydrophobicContact CH2-CD2 3.72Å; W677-L681 HydrophobicContact CZ2-CD2 4.33Å; W677-L681 HydrophobicContact CZ3-CD2 3.87Å; W677-L681 WeakPolarHBondContact O-CB 3.31Å; W677-L681 PolarHBondContact O-N 2.7Å
678	M	88	Confident	78.5	Confident	68 Å²	68	63.5 Å²	63.5	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-37.8	175.8	-69.3	-174.1	-54.7	0	0	112.1	D577 S674 M675 L681 G682	D577-M678 WeakPolarHBondContact OD2-CE 3.31Å; S674-M678 WeakPolarHBondContact O-CG 3.24Å; S674-M678 PolarHBondContact O-N 2.92Å; M675-M678 HydrophobicContact CG-CE 4.36Å; M678-L681 WeakPolarHBondContact O-CB 3.47Å; M678-L681 PolarHBondContact O-N 2.81Å; M678-G682 PolarHBondContact O-N 2.82Å
679	R	88	Confident	81.3	Confident	63 Å²	63	60.3 Å²	60.3	24%	0.238	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-48.3	172.3	-178.5	176.8	-59.5	102.7	19.7	112.7	M675 E676 W677 L681 G682 F683	M675-R679 WeakPolarHBondContact O-CB 3.25Å; M675-R679 PolarHBondContact O-N 2.85Å; M675-R679 VanDerWaalsContact O-N 3.07Å; E676-R679 PolarHBondContact O-N 2.98Å; E676-R679 IonicContact OE2-CZ 4Å; E676-R679 IonicContact OE2-NH1 2.71Å; E676-R679 PolarHBondContact OE2-NH1 2.83Å; W677-R679 VanDerWaalsContact C-N 3.31Å; W677-R679 PolarHBondContact O-N 3.43Å; R679-L681 VanDerWaalsContact C-N 3.3Å; R679-L681 PolarHBondContact O-N 3.15Å; R679-G682 PolarHBondContact O-N 2.88Å; R679-F683 HydrophobicContact CG-CD2 4.31Å; R679-F683 HydrophobicContact CG-CE1 4.07Å; R679-F683 HydrophobicContact CG-CE2 3.72Å; R679-F683 HydrophobicContact CG-CZ 3.59Å; R679-F683 VanDerWaalsContact O-CG 3.31Å; R679-F683 WeakPolarHBondContact O-CG 3.35Å; R679-F683 PolarHBondContact O-N 2.85Å
680	K	88.9	Confident	83.7	Confident	71 Å²	71	57.7 Å²	57.7	31%	0.309	28%	0.282	S	S	.	.	H	α-helix	trans	-61.2	-38.5	175.4	-72.8	175.2	-177.9	-178.3	0	111.9	E676 W677 F683 R684	E676-K680 WeakPolarHBondContact O-CG 3.46Å; E676-K680 PolarHBondContact O-N 2.85Å; E676-K680 WeakPolarHBondContact OE1-CE 3.41Å; W677-K680 PolarHBondContact O-N 2.86Å; K680-F683 PolarHBondContact O-N 2.91Å; K680-R684 WeakPolarHBondContact O-CG 3.32Å; K680-R684 PolarHBondContact O-N 3.11Å
681	L	91.4	Very high	86.2	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-46.8	175.4	-173.1	68.2	0	0	0	111.2	L563 I574 W677 M678 R679 F683 R684 Y685	L563-L681 HydrophobicContact CD2-CD1 3.49Å; L563-L681 VanDerWaalsContact CD2-CD1 3.49Å; I574-L681 HydrophobicContact CD1-CD1 4.38Å; I574-L681 HydrophobicContact CD1-CD2 3.88Å; I574-L681 HydrophobicContact CD1-CG 3.71Å; I574-L681 HydrophobicContact CG1-CD2 4.08Å; I574-L681 HydrophobicContact CG1-CG 4.34Å; I574-L681 HydrophobicContact CG2-CB 4.27Å; I574-L681 HydrophobicContact CG2-CD2 4.02Å; I574-L681 HydrophobicContact CG2-CG 4.04Å; W677-L681 HydrophobicContact CH2-CD2 3.72Å; W677-L681 HydrophobicContact CZ2-CD2 4.33Å; W677-L681 HydrophobicContact CZ3-CD2 3.87Å; W677-L681 WeakPolarHBondContact O-CB 3.31Å; W677-L681 PolarHBondContact O-N 2.7Å; M678-L681 WeakPolarHBondContact O-CB 3.47Å; M678-L681 PolarHBondContact O-N 2.81Å; R679-L681 VanDerWaalsContact C-N 3.3Å; R679-L681 PolarHBondContact O-N 3.15Å; L681-F683 PolarHBondContact O-N 2.96Å; L681-R684 PolarHBondContact O-N 2.8Å; L681-R684 VanDerWaalsContact O-N 3.17Å; L681-Y685 HydrophobicContact CD1-CD2 4.17Å; L681-Y685 HydrophobicContact CD1-CE2 3.92Å; L681-Y685 HydrophobicContact CG-CD2 4.42Å; L681-Y685 PolarHBondContact O-N 2.85Å
682	G	91.4	Very high	88.3	Confident	5 Å²	5	47.8 Å²	47.8	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-46.5	174.3	0	0	0	0	0	112.8	M678 R679 R684 Y685 R686	M678-G682 PolarHBondContact O-N 2.82Å; R679-G682 PolarHBondContact O-N 2.88Å; G682-R684 VanDerWaalsContact C-N 3.3Å; G682-R684 PolarHBondContact O-N 2.8Å; G682-Y685 PolarHBondContact O-N 2.86Å; G682-R686 PolarHBondContact O-N 2.93Å
683	F	90.8	Very high	90.1	Very high	16 Å²	16	43.7 Å²	43.7	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-40.7	174	-68.2	-16.3	0	0	0	112.7	D578 N579 L583 F586 R679 K680 L681 R687	D578-F683 WeakPolarHBondContact OD1-CE1 3.44Å; N579-F683 VanDerWaalsContact OD1-CE1 3.22Å; N579-F683 WeakPolarHBondContact OD1-CE1 3.4Å; N579-F683 WeakPolarHBondContact OD1-CZ 3.46Å; L583-F683 HydrophobicContact CD2-CB 3.99Å; L583-F683 HydrophobicContact CD2-CD1 4.44Å; L583-F683 HydrophobicContact CD2-CG 4.14Å; F586-F683 HydrophobicContact CD2-CD2 4.21Å; F586-F683 AromaticContact CE2-CD2 3.84Å; F586-F683 HydrophobicContact CE2-CD2 3.84Å; F586-F683 HydrophobicContact CE2-CE2 4.27Å; F586-F683 HydrophobicContact CZ-CD2 4.38Å; R679-F683 HydrophobicContact CG-CD2 4.31Å; R679-F683 HydrophobicContact CG-CE1 4.07Å; R679-F683 HydrophobicContact CG-CE2 3.72Å; R679-F683 HydrophobicContact CG-CZ 3.59Å; R679-F683 VanDerWaalsContact O-CG 3.31Å; R679-F683 WeakPolarHBondContact O-CG 3.35Å; R679-F683 PolarHBondContact O-N 2.85Å; K680-F683 PolarHBondContact O-N 2.91Å; L681-F683 PolarHBondContact O-N 2.96Å; F683-R687 VanDerWaalsContact O-CB 3.32Å; F683-R687 WeakPolarHBondContact O-CB 3.35Å; F683-R687 PolarHBondContact O-N 2.94Å
684	R	93.7	Very high	91.3	Very high	30 Å²	30	50.3 Å²	50.3	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-48.5	176.5	-72.3	174.4	-172.3	-69.9	0.7	111.7	F559 E562 L563 K680 L681 G682 R686 R687 I688	F559-R684 HydrophobicContact CD2-CB 4.21Å; F559-R684 HydrophobicContact CD2-CG 4.25Å; F559-R684 HydrophobicContact CG-CG 4.45Å; E562-R684 IonicContact OE1-CZ 3.97Å; E562-R684 IonicContact OE1-NH1 2.8Å; E562-R684 PolarHBondContact OE1-NH1 2.92Å; E562-R684 IonicContact OE1-NH2 3.21Å; E562-R684 PolarHBondContact OE1-NH2 2.76Å; E562-R684 IonicContact OE2-CZ 2.53Å; E562-R684 IonicContact OE2-NE 2.83Å; E562-R684 IonicContact OE2-NH1 2.63Å; E562-R684 IonicContact OE2-NH2 3.84Å; E562-R684 PolarHBondContact OE2-NH2 2.88Å; L563-R684 HydrophobicContact CD1-CB 4.33Å; L563-R684 HydrophobicContact CD2-CB 4.45Å; K680-R684 WeakPolarHBondContact O-CG 3.32Å; K680-R684 PolarHBondContact O-N 3.11Å; L681-R684 PolarHBondContact O-N 2.8Å; L681-R684 VanDerWaalsContact O-N 3.17Å; G682-R684 VanDerWaalsContact C-N 3.3Å; G682-R684 PolarHBondContact O-N 2.8Å; R684-R686 PolarHBondContact O-N 3.29Å; R684-R687 CarbonylContact O-C 3.23Å; R684-R687 WeakPolarHBondContact O-CB 3.39Å; R684-R687 PolarHBondContact O-N 3.1Å; R684-R687 VanDerWaalsContact O-N 3.09Å; R684-I688 WeakPolarHBondContact O-CD1 3.48Å; R684-I688 VanDerWaalsContact O-CG1 3.31Å; R684-I688 WeakPolarHBondContact O-CG1 3.49Å; R684-I688 PolarHBondContact O-N 3.36Å
685	Y	94.9	Very high	92.2	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-66.8	-34.1	178.9	-84.5	-102.2	0	0	0	112.7	L563 Q568 I571 I574 L681 G682 I688 R689 F752 I753	L563-Y685 HydrophobicContact CD1-CD2 4.34Å; L563-Y685 HydrophobicContact CD1-CE2 3.8Å; L563-Y685 HydrophobicContact CD2-CE2 4.02Å; L563-Y685 HydrophobicContact CG-CE2 4.44Å; Q568-Y685 HydrophobicContact CB-CE1 3.89Å; Q568-Y685 HydrophobicContact CG-CE1 3.74Å; Q568-Y685 HydrophobicContact CG-CE2 4.08Å; Q568-Y685 VanDerWaalsContact CG-CZ 3.49Å; Q568-Y685 WeakPolarHBondContact CG-OH 3.42Å; I571-Y685 HydrophobicContact CD1-CD1 4.09Å; I571-Y685 WeakPolarHBondContact CD1-O 3.4Å; I574-Y685 HydrophobicContact CD1-CD1 3.96Å; I574-Y685 HydrophobicContact CD1-CD2 3.23Å; I574-Y685 HydrophobicContact CD1-CE1 4.28Å; I574-Y685 HydrophobicContact CD1-CE2 3.59Å; I574-Y685 HydrophobicContact CD1-CG 3.44Å; I574-Y685 VanDerWaalsContact CD1-CG 3.44Å; L681-Y685 HydrophobicContact CD1-CD2 4.17Å; L681-Y685 HydrophobicContact CD1-CE2 3.92Å; L681-Y685 HydrophobicContact CG-CD2 4.42Å; L681-Y685 PolarHBondContact O-N 2.85Å; G682-Y685 PolarHBondContact O-N 2.86Å; Y685-I688 HydrophobicContact CD2-CD1 4.45Å; Y685-I688 HydrophobicContact CG-CD1 4.42Å; Y685-I688 PolarHBondContact O-N 3.18Å; Y685-R689 PolarHBondContact O-N 3.18Å; Y685-R689 VanDerWaalsContact O-N 3.12Å; Y685-F752 HydrophobicContact CD1-CE1 4.49Å; Y685-F752 AromaticContact CE1-CD1 3.89Å; Y685-F752 HydrophobicContact CE1-CD1 3.89Å; Y685-F752 HydrophobicContact CE1-CE1 4.22Å; Y685-I753 HydrophobicContact CE1-CD1 4.21Å
686	R	93.4	Very high	92.8	Very high	36 Å²	36	44.3 Å²	44.3	14%	0.136	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-45.4	167	176	159.1	54.1	104.7	-9.6	111.6	D578 Q581 L583 G682 R684 I688 R689 E690	D578-R686 IonicContact OD1-CZ 3.87Å; D578-R686 IonicContact OD1-NE 2.72Å; D578-R686 PolarHBondContact OD1-NE 3.32Å; D578-R686 IonicContact OD1-NH2 3.69Å; D578-R686 PolarHBondContact OD1-NH2 2.8Å; D578-R686 WeakPolarHBondContact OD2-CD 3.39Å; D578-R686 IonicContact OD2-CZ 2.78Å; D578-R686 IonicContact OD2-NE 2.98Å; D578-R686 PolarHBondContact OD2-NE 2.69Å; D578-R686 IonicContact OD2-NH2 3.67Å; Q581-R686 PolarHBondContact O-NH1 2.88Å; Q581-R686 PolarHBondContact O-NH2 2.93Å; L583-R686 HydrophobicContact CD1-CB 4.28Å; L583-R686 HydrophobicContact CD1-CG 3.93Å; G682-R686 PolarHBondContact O-N 2.93Å; R684-R686 PolarHBondContact O-N 3.29Å; R686-I688 VanDerWaalsContact C-N 3.33Å; R686-I688 PolarHBondContact O-N 2.91Å; R686-R689 VanDerWaalsContact O-CB 3.31Å; R686-R689 WeakPolarHBondContact O-CB 3.46Å; R686-R689 PolarHBondContact O-N 3.44Å; R686-R689 VanDerWaalsContact O-N 3.11Å; R686-E690 PolarHBondContact O-N 3.18Å; R686-E690 VanDerWaalsContact O-N 3.09Å
687	R	94.9	Very high	93.2	Very high	89 Å²	89	49 Å²	49	34%	0.336	20%	0.204	S	C	.	.	H	α-helix	trans	-63.1	-37.8	178.7	-172.5	54.5	-174.2	154.8	6.3	112.7	F559 L583 F683 R684 R689 E690 I691	F559-R687 HydrophobicContact CE2-CB 4.02Å; F559-R687 HydrophobicContact CE2-CG 3.86Å; F559-R687 HydrophobicContact CZ-CB 4.4Å; F559-R687 HydrophobicContact CZ-CG 3.86Å; L583-R687 HydrophobicContact CD1-CB 4.06Å; F683-R687 VanDerWaalsContact O-CB 3.32Å; F683-R687 WeakPolarHBondContact O-CB 3.35Å; F683-R687 PolarHBondContact O-N 2.94Å; R684-R687 CarbonylContact O-C 3.23Å; R684-R687 WeakPolarHBondContact O-CB 3.39Å; R684-R687 PolarHBondContact O-N 3.1Å; R684-R687 VanDerWaalsContact O-N 3.09Å; R687-R689 VanDerWaalsContact C-N 3.33Å; R687-R689 PolarHBondContact O-N 3.35Å; R687-E690 WeakPolarHBondContact CD-OE2 3.26Å; R687-E690 IonicContact CZ-OE2 2.79Å; R687-E690 IonicContact NE-OE2 3.02Å; R687-E690 IonicContact NH1-OE2 3.73Å; R687-E690 PolarHBondContact NH1-OE2 3.25Å; R687-E690 WeakPolarHBondContact O-CB 3.41Å; R687-E690 PolarHBondContact O-N 3.33Å; R687-I691 HydrophobicContact CG-CD1 3.98Å; R687-I691 WeakPolarHBondContact O-CG1 3.44Å; R687-I691 PolarHBondContact O-N 2.94Å
688	I	96.7	Very high	93.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-42.6	172.5	-73.6	153.6	0	0	0	110.9	L558 F559 L563 I571 R684 Y685 R686 E690 I691 Y692 I753 L756 I770	L558-I688 HydrophobicContact CB-CG1 4.38Å; L558-I688 HydrophobicContact CD2-CG1 4.48Å; L558-I688 HydrophobicContact CD2-CG2 4.43Å; F559-I688 HydrophobicContact CD2-CD1 4.17Å; F559-I688 HydrophobicContact CD2-CG1 4.03Å; F559-I688 HydrophobicContact CE2-CG1 4.31Å; L563-I688 HydrophobicContact CD1-CD1 3.55Å; I571-I688 HydrophobicContact CD1-CG2 4.32Å; R684-I688 WeakPolarHBondContact O-CD1 3.48Å; R684-I688 VanDerWaalsContact O-CG1 3.31Å; R684-I688 WeakPolarHBondContact O-CG1 3.49Å; R684-I688 PolarHBondContact O-N 3.36Å; Y685-I688 HydrophobicContact CD2-CD1 4.45Å; Y685-I688 HydrophobicContact CG-CD1 4.42Å; Y685-I688 PolarHBondContact O-N 3.18Å; R686-I688 VanDerWaalsContact C-N 3.33Å; R686-I688 PolarHBondContact O-N 2.91Å; I688-E690 PolarHBondContact O-N 3.5Å; I688-I691 PolarHBondContact O-N 3.09Å; I688-Y692 WeakPolarHBondContact O-CB 3.45Å; I688-Y692 PolarHBondContact O-N 3.27Å; I688-I753 HydrophobicContact CD1-CD1 3.46Å; I688-I753 VanDerWaalsContact CD1-CD1 3.46Å; I688-I753 HydrophobicContact CG1-CD1 4.3Å; I688-I753 HydrophobicContact CG2-CD1 4.25Å; I688-L756 HydrophobicContact CG2-CD1 3.43Å; I688-L756 VanDerWaalsContact CG2-CD1 3.43Å; I688-I770 HydrophobicContact CG2-CD1 4.27Å
689	R	96.8	Very high	93.8	Very high	41 Å²	41	45.2 Å²	45.2	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-42.1	174.8	-162.5	-161.4	-53.5	-97.2	-6	112.6	I571 D572 Y685 R686 R687 N693 I770 E771	I571-R689 HydrophobicContact CD1-CB 4.24Å; I571-R689 HydrophobicContact CG1-CB 4.23Å; I571-R689 HydrophobicContact CG1-CG 4.3Å; I571-R689 PolarHBondContact O-NH2 3.42Å; I571-R689 VanDerWaalsContact O-NH2 3.17Å; D572-R689 IonicContact OD1-CZ 2.7Å; D572-R689 VanDerWaalsContact OD1-CZ 3.23Å; D572-R689 IonicContact OD1-NH1 3.53Å; D572-R689 PolarHBondContact OD1-NH1 3.13Å; D572-R689 IonicContact OD1-NH2 2.77Å; D572-R689 PolarHBondContact OD1-NH2 2.85Å; Y685-R689 PolarHBondContact O-N 3.18Å; Y685-R689 VanDerWaalsContact O-N 3.12Å; R686-R689 VanDerWaalsContact O-CB 3.31Å; R686-R689 WeakPolarHBondContact O-CB 3.46Å; R686-R689 PolarHBondContact O-N 3.44Å; R686-R689 VanDerWaalsContact O-N 3.11Å; R687-R689 VanDerWaalsContact C-N 3.33Å; R687-R689 PolarHBondContact O-N 3.35Å; R689-N693 WeakPolarHBondContact O-CB 3.39Å; R689-N693 PolarHBondContact O-N 2.72Å; R689-N693 PolarHBondContact O-ND2 3.41Å; R689-I770 HydrophobicContact CB-CD1 4.48Å; R689-I770 HydrophobicContact CG-CG2 3.71Å; R689-E771 WeakPolarHBondContact CD-OE1 3.49Å; R689-E771 IonicContact CZ-OE1 3.59Å; R689-E771 IonicContact NE-OE1 2.66Å; R689-E771 IonicContact NH1-OE1 3.55Å; R689-E771 PolarHBondContact NH1-OE1 2.89Å
690	E	95.6	Very high	94.1	Very high	64 Å²	64	44 Å²	44	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-49.1	175.3	-66	169.4	-173.1	0	0	111.2	R686 R687 I688 N693 Y694	R686-E690 PolarHBondContact O-N 3.18Å; R686-E690 VanDerWaalsContact O-N 3.09Å; R687-E690 WeakPolarHBondContact CD-OE2 3.26Å; R687-E690 IonicContact CZ-OE2 2.79Å; R687-E690 IonicContact NE-OE2 3.02Å; R687-E690 IonicContact NH1-OE2 3.73Å; R687-E690 PolarHBondContact NH1-OE2 3.25Å; R687-E690 WeakPolarHBondContact O-CB 3.41Å; R687-E690 PolarHBondContact O-N 3.33Å; I688-E690 PolarHBondContact O-N 3.5Å; E690-N693 PolarHBondContact O-N 3.38Å; E690-Y694 VanDerWaalsContact O-CB 3.28Å; E690-Y694 WeakPolarHBondContact O-CB 3.45Å; E690-Y694 PolarHBondContact O-N 3.01Å
691	I	96.2	Very high	94.3	Very high	19 Å²	19	44.3 Å²	44.3	10%	0.097	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-43.4	-178.9	-68.9	171.4	0	0	0	111.1	Y557 L558 R687 I688 S695 L702	Y557-I691 WeakPolarHBondContact O-CD1 3.48Å; L558-I691 HydrophobicContact CD2-CB 4.4Å; L558-I691 HydrophobicContact CD2-CG2 3.85Å; R687-I691 HydrophobicContact CG-CD1 3.98Å; R687-I691 WeakPolarHBondContact O-CG1 3.44Å; R687-I691 PolarHBondContact O-N 2.94Å; I688-I691 PolarHBondContact O-N 3.09Å; I691-S695 VanDerWaalsContact O-CB 3.31Å; I691-S695 WeakPolarHBondContact O-CB 3.5Å; I691-S695 PolarHBondContact O-N 3.33Å; I691-S695 PolarHBondContact O-OG 3.18Å; I691-L702 HydrophobicContact CG2-CD1 3.95Å; I691-L702 HydrophobicContact CG2-CD2 4.28Å
692	Y	97.7	Very high	94.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-52.5	174.4	-177.6	-85.2	0	0	0	111.1	I688 Y694 S695 R696 L756 I759 L760 F768 I770 I773	I688-Y692 WeakPolarHBondContact O-CB 3.45Å; I688-Y692 PolarHBondContact O-N 3.27Å; Y692-Y694 PolarHBondContact O-N 3.34Å; Y692-S695 PolarHBondContact O-N 2.87Å; Y692-R696 HydrophobicContact CD1-CB 4.29Å; Y692-R696 HydrophobicContact CE1-CB 4.07Å; Y692-R696 WeakPolarHBondContact O-CB 3.4Å; Y692-R696 WeakPolarHBondContact O-CG 3.44Å; Y692-R696 PolarHBondContact O-N 2.98Å; Y692-L756 HydrophobicContact CD2-CB 4.32Å; Y692-L756 HydrophobicContact CD2-CD2 4.01Å; Y692-L756 HydrophobicContact CE2-CD2 4.03Å; Y692-I759 HydrophobicContact CE2-CG2 3.96Å; Y692-I759 VanDerWaalsContact OH-CG2 3.27Å; Y692-I759 WeakPolarHBondContact OH-CG2 3.29Å; Y692-L760 HydrophobicContact CD2-CD1 4.18Å; Y692-L760 HydrophobicContact CD2-CD2 3.87Å; Y692-L760 HydrophobicContact CD2-CG 3.99Å; Y692-L760 HydrophobicContact CE2-CD2 3.92Å; Y692-L760 HydrophobicContact CE2-CG 4.09Å; Y692-F768 PolarHBondContact OH-O 3.01Å; Y692-I770 HydrophobicContact CD1-CB 3.65Å; Y692-I770 HydrophobicContact CD1-CD1 4.45Å; Y692-I770 HydrophobicContact CD1-CG1 4.49Å; Y692-I770 HydrophobicContact CD1-CG2 4.1Å; Y692-I770 HydrophobicContact CE1-CB 3.86Å; Y692-I770 HydrophobicContact CG-CB 4.12Å; Y692-I770 HydrophobicContact CG-CD1 4.1Å; Y692-I770 HydrophobicContact CG-CG1 4.5Å; Y692-I773 HydrophobicContact CE2-CD1 4.33Å
693	N	96.2	Very high	94.5	Very high	57 Å²	57	45.1 Å²	45.1	31%	0.305	21%	0.205	S	C	.	.	H	α-helix	trans	-67.3	-24.2	-176.8	-79.8	-43.9	0	0	0	113.9	R689 E690 R696	R689-N693 WeakPolarHBondContact O-CB 3.39Å; R689-N693 PolarHBondContact O-N 2.72Å; R689-N693 PolarHBondContact O-ND2 3.41Å; E690-N693 PolarHBondContact O-N 3.38Å; N693-R696 WeakPolarHBondContact OD1-CD 3.38Å; N693-R696 PolarHBondContact OD1-NH1 2.86Å
694	Y	94.8	Very high	94.6	Very high	172 Å²	172	45.8 Å²	45.8	68%	0.675	22%	0.216	S	C	*	.	H	α-helix	trans	-76	-45.2	169.7	-177.8	-105	0	0	0	112.8	E690 Y692 V701	E690-Y694 VanDerWaalsContact O-CB 3.28Å; E690-Y694 WeakPolarHBondContact O-CB 3.45Å; E690-Y694 PolarHBondContact O-N 3.01Å; Y692-Y694 PolarHBondContact O-N 3.34Å; Y694-V701 HydrophobicContact CE1-CG1 3.84Å
695	S	95	Very high	94.4	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-88.1	-18.8	-172.2	62	0	0	0	0	115.4	I691 Y692 Y697 N698 V699	I691-S695 VanDerWaalsContact O-CB 3.31Å; I691-S695 WeakPolarHBondContact O-CB 3.5Å; I691-S695 PolarHBondContact O-N 3.33Å; I691-S695 PolarHBondContact O-OG 3.18Å; Y692-S695 PolarHBondContact O-N 2.87Å; S695-Y697 PolarHBondContact O-N 3.47Å; S695-N698 CarbonylContact O-C 3.18Å; S695-N698 PolarHBondContact O-N 3.34Å; S695-V699 WeakPolarHBondContact O-CG2 3.3Å; S695-V699 PolarHBondContact O-N 3.41Å; S695-V699 VanDerWaalsContact O-N 3.15Å
696	R	94.6	Very high	94.4	Very high	22 Å²	22	56.5 Å²	56.5	8%	0.083	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.8	-175.7	65.4	-174.1	-69.7	-176.4	-0.8	116.4	Y692 N693 L760 G765 N766 F768	Y692-R696 HydrophobicContact CD1-CB 4.29Å; Y692-R696 HydrophobicContact CE1-CB 4.07Å; Y692-R696 WeakPolarHBondContact O-CB 3.4Å; Y692-R696 WeakPolarHBondContact O-CG 3.44Å; Y692-R696 PolarHBondContact O-N 2.98Å; N693-R696 WeakPolarHBondContact OD1-CD 3.38Å; N693-R696 PolarHBondContact OD1-NH1 2.86Å; R696-L760 HydrophobicContact CB-CD2 4.13Å; R696-G765 PolarHBondContact NE-O 3.26Å; R696-G765 PolarHBondContact NH2-O 3.24Å; R696-G765 CarbonylContact O-C 3.55Å; R696-N766 PolarHBondContact NH2-O 3.34Å; R696-F768 PolarHBondContact NH2-O 3.09Å
697	Y	92.2	Very high	94.5	Very high	159 Å²	159	58.2 Å²	58.2	62%	0.624	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-15.8	175.3	-58.9	-69.3	0	0	0	113.4	S695	S695-Y697 PolarHBondContact O-N 3.47Å
698	N	92.4	Very high	94.5	Very high	83 Å²	83	54.2 Å²	54.2	44%	0.444	26%	0.261	S	S	.	.			trans	-157	75.6	-176.8	-168.2	-8.9	0	0	0	111.8	S695 S700 V701	S695-N698 CarbonylContact O-C 3.18Å; S695-N698 PolarHBondContact O-N 3.34Å; N698-S700 PolarHBondContact O-N 2.92Å; N698-S700 WeakPolarHBondContact OD1-CB 3.06Å; N698-V701 HydrophobicContact CB-CG2 4.24Å; N698-V701 WeakPolarHBondContact O-CB 3.26Å; N698-V701 PolarHBondContact O-N 3.41Å; N698-V701 VanDerWaalsContact O-N 3.12Å
699	V	94.7	Very high	94.5	Very high	8 Å²	8	58.2 Å²	58.2	5%	0.048	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.5	-178.4	-178.1	0	0	0	0	112.4	L553 S695 V701 L702 L703 W711 L760 L761	L553-V699 HydrophobicContact CD1-CG1 4.27Å; S695-V699 WeakPolarHBondContact O-CG2 3.3Å; S695-V699 PolarHBondContact O-N 3.41Å; S695-V699 VanDerWaalsContact O-N 3.15Å; V699-V701 PolarHBondContact O-N 2.92Å; V699-L702 WeakPolarHBondContact O-CA 3.28Å; V699-L702 WeakPolarHBondContact O-CB 3.45Å; V699-L702 PolarHBondContact O-N 3.25Å; V699-L703 HydrophobicContact CG1-CD1 4.29Å; V699-L703 HydrophobicContact CG1-CG 4.29Å; V699-L703 PolarHBondContact O-N 3.49Å; V699-W711 HydrophobicContact CB-CH2 3.79Å; V699-W711 HydrophobicContact CB-CZ2 4.29Å; V699-W711 HydrophobicContact CB-CZ3 4.17Å; V699-W711 HydrophobicContact CG1-CH2 4.3Å; V699-W711 HydrophobicContact CG1-CZ2 4.44Å; V699-L760 HydrophobicContact CG1-CB 4.31Å; V699-L760 HydrophobicContact CG2-CB 3.85Å; V699-L760 HydrophobicContact CG2-CD2 4.02Å; V699-L760 HydrophobicContact CG2-CG 4.5Å; V699-L761 HydrophobicContact CG1-CD2 4.33Å
700	S	94.6	Very high	94.5	Very high	36 Å²	36	62.1 Å²	62.1	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-29.5	172.5	-53.5	0	0	0	0	113.4	N698 L702 G704	N698-S700 PolarHBondContact O-N 2.92Å; N698-S700 WeakPolarHBondContact OD1-CB 3.06Å; S700-L702 VanDerWaalsContact C-N 3.3Å; S700-G704 PolarHBondContact O-N 2.95Å
701	V	92.2	Very high	94.6	Very high	78 Å²	78	60 Å²	60	47%	0.473	29%	0.292	S	S	.	.	H	α-helix	trans	-68.6	-32.6	174.5	178.1	0	0	0	0	111.2	Y694 N698 V699	Y694-V701 HydrophobicContact CE1-CG1 3.84Å; N698-V701 HydrophobicContact CB-CG2 4.24Å; N698-V701 WeakPolarHBondContact O-CB 3.26Å; N698-V701 PolarHBondContact O-N 3.41Å; N698-V701 VanDerWaalsContact O-N 3.12Å; V699-V701 PolarHBondContact O-N 2.92Å
702	L	92.8	Very high	94.6	Very high	23 Å²	23	62.1 Å²	62.1	12%	0.12	30%	0.302	C	S	.	.	H	α-helix	trans	-77.5	-44.2	177.5	-165.6	65.6	0	0	0	111.3	L553 Y557 I691 V699 S700 L760	L553-L702 HydrophobicContact CD1-CD2 4.13Å; L553-L702 HydrophobicContact CD2-CD2 3.89Å; L553-L702 HydrophobicContact CG-CD2 3.97Å; Y557-L702 HydrophobicContact CD1-CD1 3.61Å; Y557-L702 HydrophobicContact CD1-CG 4.25Å; Y557-L702 HydrophobicContact CD2-CD1 3.99Å; Y557-L702 HydrophobicContact CD2-CD2 4.18Å; Y557-L702 HydrophobicContact CD2-CG 3.71Å; Y557-L702 HydrophobicContact CE1-CD1 4.11Å; Y557-L702 HydrophobicContact CE2-CD1 4.46Å; Y557-L702 HydrophobicContact CE2-CG 4.1Å; Y557-L702 VanDerWaalsContact CE2-O 3.31Å; Y557-L702 WeakPolarHBondContact CE2-O 3.31Å; Y557-L702 HydrophobicContact CG-CD1 3.54Å; Y557-L702 HydrophobicContact CG-CD2 4.27Å; Y557-L702 HydrophobicContact CG-CG 3.81Å; Y557-L702 PolarHBondContact OH-O 3.47Å; I691-L702 HydrophobicContact CG2-CD1 3.95Å; I691-L702 HydrophobicContact CG2-CD2 4.28Å; V699-L702 WeakPolarHBondContact O-CA 3.28Å; V699-L702 WeakPolarHBondContact O-CB 3.45Å; V699-L702 PolarHBondContact O-N 3.25Å; S700-L702 VanDerWaalsContact C-N 3.3Å; L702-L760 HydrophobicContact CD2-CD1 4.4Å
703	L	94.7	Very high	94.6	Very high	9 Å²	9	66.7 Å²	66.7	5%	0.047	33%	0.327	C	S	.	.	H	α-helix	trans	-72.9	-32.7	-179.7	-68.5	176.1	0	0	0	113.9	L553 V699 K707 A708 W711 L761	L553-L703 HydrophobicContact CD1-CD2 4.29Å; V699-L703 HydrophobicContact CG1-CD1 4.29Å; V699-L703 HydrophobicContact CG1-CG 4.29Å; V699-L703 PolarHBondContact O-N 3.49Å; L703-K707 HydrophobicContact CB-CB 4.18Å; L703-A708 HydrophobicContact CB-CB 4.37Å; L703-W711 HydrophobicContact CD1-CB 3.65Å; L703-W711 HydrophobicContact CD1-CD2 3.58Å; L703-W711 HydrophobicContact CD1-CE3 3.6Å; L703-W711 HydrophobicContact CD1-CG 3.6Å; L703-W711 HydrophobicContact CD1-CZ3 4.48Å; L703-L761 HydrophobicContact CD1-CD2 3.93Å; L703-L761 HydrophobicContact CD2-CD2 4.3Å
704	G	92.6	Very high	94.7	Very high	30 Å²	30	64.6 Å²	64.6	31%	0.309	32%	0.316	S	S	.	.			trans	70.4	168.4	-173.3	0	0	0	0	0	114.2	S700 K707 A708	S700-G704 PolarHBondContact O-N 2.95Å; G704-K707 PolarHBondContact O-N 2.75Å; G704-A708 WeakPolarHBondContact O-CB 3.24Å; G704-A708 PolarHBondContact O-N 2.98Å
705	Y	90.3	Very high	94.9	Very high	194 Å²	194	58.1 Å²	58.1	76%	0.761	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	138.3	171.8	-175.4	-88.5	0	0	0	110.1
706	P	94.3	Very high	95	Very high	66 Å²	66	62 Å²	62	43%	0.429	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.5	-5.4	4.7	35.9	-36.6	0	0	0	115.2	A708 N709 Q710	P706-A708 VanDerWaalsContact C-N 3.26Å; P706-A708 PolarHBondContact O-N 3.04Å; P706-N709 PolarHBondContact O-N 2.95Å; P706-Q710 PolarHBondContact O-N 3.33Å
707	K	94.8	Very high	95.2	Very high	72 Å²	72	64.2 Å²	64.2	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-52.7	-40.9	-175.3	-74.7	-173.6	175	-179.3	0	112.9	N552 L703 G704 N709 Q710 W711	N552-K707 PolarHBondContact OD1-NZ 2.87Å; L703-K707 HydrophobicContact CB-CB 4.18Å; G704-K707 PolarHBondContact O-N 2.75Å; K707-N709 VanDerWaalsContact C-N 3.33Å; K707-N709 PolarHBondContact O-N 3.01Å; K707-Q710 WeakPolarHBondContact O-CB 3.08Å; K707-Q710 PolarHBondContact O-N 3.17Å; K707-Q710 VanDerWaalsContact O-N 3.14Å; K707-W711 WeakPolarHBondContact O-CB 3.38Å; K707-W711 PolarHBondContact O-N 3.42Å
708	A	96.4	Very high	95.5	Very high	5 Å²	5	56.8 Å²	56.8	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-55.5	-42.7	177.6	0	0	0	0	0	113.2	L703 G704 P706 W711 I712	L703-A708 HydrophobicContact CB-CB 4.37Å; G704-A708 WeakPolarHBondContact O-CB 3.24Å; G704-A708 PolarHBondContact O-N 2.98Å; P706-A708 VanDerWaalsContact C-N 3.26Å; P706-A708 PolarHBondContact O-N 3.04Å; A708-W711 PolarHBondContact O-N 2.95Å; A708-I712 WeakPolarHBondContact O-CD1 3.28Å; A708-I712 VanDerWaalsContact O-CG1 3.24Å; A708-I712 WeakPolarHBondContact O-CG1 3.46Å; A708-I712 PolarHBondContact O-N 3.31Å
709	N	96.3	Very high	95.8	Very high	84 Å²	84	53.5 Å²	53.5	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-70.3	-35.9	178.4	-72.4	29.1	0	0	0	111.8	P706 K707 N713	P706-N709 PolarHBondContact O-N 2.95Å; K707-N709 VanDerWaalsContact C-N 3.33Å; K707-N709 PolarHBondContact O-N 3.01Å; N709-N713 WeakPolarHBondContact O-CB 3.39Å; N709-N713 VanDerWaalsContact O-CG 3.22Å; N709-N713 PolarHBondContact O-N 2.7Å; N709-N713 VanDerWaalsContact O-N 3.08Å; N709-N713 PolarHBondContact O-ND2 2.77Å
710	Q	96.3	Very high	95.9	Very high	123 Å²	123	58 Å²	58	58%	0.575	30%	0.302	S	S	*	.	H	α-helix	trans	-65.5	-43.4	175.7	-64.3	172.6	-22.9	0	0	110.9	P706 K707 L714	P706-Q710 PolarHBondContact O-N 3.33Å; K707-Q710 WeakPolarHBondContact O-CB 3.08Å; K707-Q710 PolarHBondContact O-N 3.17Å; K707-Q710 VanDerWaalsContact O-N 3.14Å; Q710-L714 WeakPolarHBondContact O-CB 3.48Å; Q710-L714 PolarHBondContact O-N 3.46Å
711	W	97.8	Very high	96.1	Very high	20 Å²	20	57.3 Å²	57.3	8%	0.076	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-48.7	174	163.2	60.7	0	0	0	112.8	L549 V699 L703 K707 A708 N713 L714 K715 L761	L549-W711 HydrophobicContact CD1-CB 3.96Å; L549-W711 HydrophobicContact CD1-CG 4.42Å; V699-W711 HydrophobicContact CB-CH2 3.79Å; V699-W711 HydrophobicContact CB-CZ2 4.29Å; V699-W711 HydrophobicContact CB-CZ3 4.17Å; V699-W711 HydrophobicContact CG1-CH2 4.3Å; V699-W711 HydrophobicContact CG1-CZ2 4.44Å; L703-W711 HydrophobicContact CD1-CB 3.65Å; L703-W711 HydrophobicContact CD1-CD2 3.58Å; L703-W711 HydrophobicContact CD1-CE3 3.6Å; L703-W711 HydrophobicContact CD1-CG 3.6Å; L703-W711 HydrophobicContact CD1-CZ3 4.48Å; K707-W711 WeakPolarHBondContact O-CB 3.38Å; K707-W711 PolarHBondContact O-N 3.42Å; A708-W711 PolarHBondContact O-N 2.95Å; W711-N713 VanDerWaalsContact C-N 3.33Å; W711-N713 PolarHBondContact O-N 3.43Å; W711-L714 PolarHBondContact O-N 2.75Å; W711-K715 HydrophobicContact CZ2-CD 4.3Å; W711-K715 WeakPolarHBondContact O-CB 3.45Å; W711-K715 PolarHBondContact O-N 3.28Å; W711-L761 HydrophobicContact CD2-CD2 4.33Å; W711-L761 HydrophobicContact CG-CD2 4.1Å; W711-L761 WeakPolarHBondContact CZ2-O 3.21Å; W711-L761 PolarHBondContact NE1-O 3.1Å
712	I	97	Very high	96.4	Very high	62 Å²	62	53.7 Å²	53.7	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-58.5	-46.1	178	-70.7	163	0	0	0	110.6	A708 L714 K715 N716	A708-I712 WeakPolarHBondContact O-CD1 3.28Å; A708-I712 VanDerWaalsContact O-CG1 3.24Å; A708-I712 WeakPolarHBondContact O-CG1 3.46Å; A708-I712 PolarHBondContact O-N 3.31Å; I712-L714 PolarHBondContact O-N 2.78Å; I712-K715 PolarHBondContact O-N 2.92Å; I712-N716 WeakPolarHBondContact O-CB 3.34Å; I712-N716 PolarHBondContact O-N 3.04Å; I712-N716 PolarHBondContact O-ND2 3.37Å; I712-N716 PolarHBondContact O-OD1 3.04Å
713	N	97.8	Very high	96.7	Very high	97 Å²	97	55.6 Å²	55.6	52%	0.519	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-40.9	177.4	-70.6	-12.7	0	0	0	112	N709 W711 N717	N709-N713 WeakPolarHBondContact O-CB 3.39Å; N709-N713 VanDerWaalsContact O-CG 3.22Å; N709-N713 PolarHBondContact O-N 2.7Å; N709-N713 VanDerWaalsContact O-N 3.08Å; N709-N713 PolarHBondContact O-ND2 2.77Å; W711-N713 VanDerWaalsContact C-N 3.33Å; W711-N713 PolarHBondContact O-N 3.43Å; N713-N717 VanDerWaalsContact O-CB 3.31Å; N713-N717 WeakPolarHBondContact O-CB 3.48Å; N713-N717 PolarHBondContact O-N 3.2Å; N713-N717 PolarHBondContact O-OD1 3.19Å
714	L	98.2	Very high	96.8	Very high	13 Å²	13	59.7 Å²	59.7	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-47.5	175.5	-178.7	66.9	0	0	0	111.7	Y542 R545 M546 L549 Q710 W711 I712 N716 N717 L718	Y542-L714 HydrophobicContact CD1-CD1 3.81Å; Y542-L714 HydrophobicContact CG-CD1 4.03Å; R545-L714 HydrophobicContact CB-CD1 4.11Å; R545-L714 HydrophobicContact CB-CD2 3.73Å; M546-L714 HydrophobicContact CB-CD2 4.15Å; M546-L714 HydrophobicContact SD-CD2 4.01Å; L549-L714 HydrophobicContact CD1-CD2 3.87Å; Q710-L714 WeakPolarHBondContact O-CB 3.48Å; Q710-L714 PolarHBondContact O-N 3.46Å; W711-L714 PolarHBondContact O-N 2.75Å; I712-L714 PolarHBondContact O-N 2.78Å; L714-N716 VanDerWaalsContact C-N 3.34Å; L714-N716 PolarHBondContact O-N 2.97Å; L714-N717 PolarHBondContact O-N 2.93Å; L714-L718 VanDerWaalsContact O-CB 3.27Å; L714-L718 WeakPolarHBondContact O-CB 3.5Å; L714-L718 PolarHBondContact O-N 2.98Å
715	K	98.2	Very high	97.1	Very high	36 Å²	36	58.5 Å²	58.5	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-58.3	-45.4	179.1	-174.1	-172.6	-170.6	-65.8	0	111.5	W711 I712 L718 D719 L726 Y762	W711-K715 HydrophobicContact CZ2-CD 4.3Å; W711-K715 WeakPolarHBondContact O-CB 3.45Å; W711-K715 PolarHBondContact O-N 3.28Å; I712-K715 PolarHBondContact O-N 2.92Å; K715-L718 PolarHBondContact O-N 2.89Å; K715-D719 PolarHBondContact O-N 2.83Å; K715-L726 HydrophobicContact CG-CD2 4.09Å; K715-L726 VanDerWaalsContact NZ-CD2 3.35Å; K715-Y762 WeakPolarHBondContact CE-O 3.37Å; K715-Y762 PolarHBondContact NZ-O 3.41Å
716	N	97.9	Very high	97.5	Very high	81 Å²	81	49.4 Å²	49.4	43%	0.433	25%	0.252	S	S	.	.	H	α-helix	trans	-66.9	-44.1	178.7	-66.1	-8.4	0	0	0	111.4	I712 L714 L718 D719 I720	I712-N716 WeakPolarHBondContact O-CB 3.34Å; I712-N716 PolarHBondContact O-N 3.04Å; I712-N716 PolarHBondContact O-ND2 3.37Å; I712-N716 PolarHBondContact O-OD1 3.04Å; L714-N716 VanDerWaalsContact C-N 3.34Å; L714-N716 PolarHBondContact O-N 2.97Å; N716-L718 VanDerWaalsContact C-N 3.3Å; N716-L718 PolarHBondContact O-N 2.95Å; N716-D719 PolarHBondContact O-N 2.79Å; N716-I720 VanDerWaalsContact O-CG1 3.31Å; N716-I720 WeakPolarHBondContact O-CG1 3.39Å; N716-I720 PolarHBondContact O-N 3.16Å
717	N	98.3	Very high	97.6	Very high	70 Å²	70	49 Å²	49	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-66	-32.2	177.1	-71.9	0.4	0	0	0	112.7	Y542 N713 L714 L721	Y542-N717 HydrophobicContact CD2-CB 4.48Å; Y542-N717 HydrophobicContact CE2-CB 3.71Å; Y542-N717 PolarHBondContact OH-ND2 3.19Å; N713-N717 VanDerWaalsContact O-CB 3.31Å; N713-N717 WeakPolarHBondContact O-CB 3.48Å; N713-N717 PolarHBondContact O-N 3.2Å; N713-N717 PolarHBondContact O-OD1 3.19Å; L714-N717 PolarHBondContact O-N 2.93Å; N717-L721 WeakPolarHBondContact O-CB 3.42Å; N717-L721 PolarHBondContact O-N 2.6Å
718	L	97.7	Very high	97.8	Very high	2 Å²	2	47 Å²	47	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-69.8	-46.6	175.3	-168.6	160.1	0	0	0	110.7	L523 M546 L714 K715 N716 I720 L721 T722 Y762	L523-L718 HydrophobicContact CD1-CD1 3.8Å; L523-L718 HydrophobicContact CD1-CD2 4.44Å; L523-L718 HydrophobicContact CD1-CG 4.01Å; M546-L718 HydrophobicContact CB-CD1 4.48Å; M546-L718 HydrophobicContact CG-CD1 4.45Å; L714-L718 VanDerWaalsContact O-CB 3.27Å; L714-L718 WeakPolarHBondContact O-CB 3.5Å; L714-L718 PolarHBondContact O-N 2.98Å; K715-L718 PolarHBondContact O-N 2.89Å; N716-L718 VanDerWaalsContact C-N 3.3Å; N716-L718 PolarHBondContact O-N 2.95Å; L718-I720 VanDerWaalsContact C-N 3.32Å; L718-I720 PolarHBondContact O-N 2.67Å; L718-L721 PolarHBondContact O-N 2.81Å; L718-T722 HydrophobicContact CD2-CG2 4.04Å; L718-T722 WeakPolarHBondContact O-CG2 3.39Å; L718-T722 PolarHBondContact O-N 2.76Å; L718-T722 PolarHBondContact O-OG1 3.48Å; L718-Y762 HydrophobicContact CD1-CE1 4.4Å; L718-Y762 HydrophobicContact CD2-CE1 4.17Å
719	D	98.3	Very high	97.9	Very high	15 Å²	15	46.8 Å²	46.8	8%	0.08	24%	0.241	C	C	.	.	H	α-helix	trans	-60.2	-39.3	175.1	-171.2	64.2	0	0	0	112.1	K715 N716 T722 D723 H724 L726 S727	K715-D719 PolarHBondContact O-N 2.83Å; N716-D719 PolarHBondContact O-N 2.79Å; D719-T722 CarbonylContact O-C 3.59Å; D719-T722 PolarHBondContact O-N 3.28Å; D719-T722 PolarHBondContact O-OG1 3.28Å; D719-D723 PolarHBondContact O-N 2.77Å; D719-H724 WeakPolarHBondContact O-CA 3.36Å; D719-H724 PolarHBondContact O-N 3.37Å; D719-H724 WeakPolarHBondContact OD1-CA 3.34Å; D719-H724 IonicContact OD2-CE1 2.67Å; D719-H724 IonicContact OD2-CG 3.76Å; D719-H724 IonicContact OD2-ND1 3.7Å; D719-H724 PolarHBondContact OD2-ND1 3.11Å; D719-L726 VanDerWaalsContact OD1-CB 3.32Å; D719-L726 WeakPolarHBondContact OD1-CB 3.27Å; D719-L726 PolarHBondContact OD1-N 3.1Å; D719-S727 VanDerWaalsContact CG-OG 3.29Å; D719-S727 PolarHBondContact OD1-N 2.93Å; D719-S727 PolarHBondContact OD1-OG 3.39Å; D719-S727 PolarHBondContact OD2-OG 2.91Å
720	I	98.2	Very high	97.9	Very high	103 Å²	103	44.6 Å²	44.6	53%	0.528	23%	0.229	S	C	.	.	H	α-helix	trans	-66.1	-43	173.8	-67	164.6	0	0	0	111.4	N716 L718 T722 D723	N716-I720 VanDerWaalsContact O-CG1 3.31Å; N716-I720 WeakPolarHBondContact O-CG1 3.39Å; N716-I720 PolarHBondContact O-N 3.16Å; L718-I720 VanDerWaalsContact C-N 3.32Å; L718-I720 PolarHBondContact O-N 2.67Å; I720-T722 VanDerWaalsContact C-N 3.27Å; I720-T722 PolarHBondContact O-N 2.88Å; I720-D723 PolarHBondContact O-N 2.85Å
721	L	98.2	Very high	98	Very high	21 Å²	21	43.4 Å²	43.4	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-29.8	177.9	-178.3	144.6	0	0	0	112.3	L523 K534 V538 A539 Y542 N717 L718	L523-L721 HydrophobicContact CD2-CD2 3.98Å; K534-L721 VanDerWaalsContact CE-O 3.23Å; K534-L721 WeakPolarHBondContact CE-O 3.41Å; V538-L721 HydrophobicContact CB-CD1 4.28Å; V538-L721 HydrophobicContact CG1-CD1 3.73Å; A539-L721 HydrophobicContact CB-CD1 4.27Å; A539-L721 HydrophobicContact CB-CD2 4.06Å; Y542-L721 HydrophobicContact CD2-CB 4.3Å; Y542-L721 HydrophobicContact CD2-CD1 3.83Å; Y542-L721 HydrophobicContact CE2-CB 4.27Å; Y542-L721 HydrophobicContact CE2-CD1 3.91Å; N717-L721 WeakPolarHBondContact O-CB 3.42Å; N717-L721 PolarHBondContact O-N 2.6Å; L718-L721 PolarHBondContact O-N 2.81Å
722	T	98.3	Very high	98	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	20.1	179.7	62.2	0	0	0	0	113.8	I519 L523 Y528 L718 D719 I720 H724 W725 H824	I519-T722 HydrophobicContact CB-CG2 3.87Å; I519-T722 HydrophobicContact CG1-CG2 4.26Å; I519-T722 HydrophobicContact CG2-CG2 3.85Å; L523-T722 HydrophobicContact CD2-CG2 4.25Å; Y528-T722 HydrophobicContact CD1-CG2 4.46Å; Y528-T722 HydrophobicContact CE1-CG2 4.1Å; Y528-T722 VanDerWaalsContact OH-CA 3.31Å; Y528-T722 WeakPolarHBondContact OH-CA 3.3Å; Y528-T722 PolarHBondContact OH-O 3.34Å; Y528-T722 VanDerWaalsContact OH-O 3.05Å; L718-T722 HydrophobicContact CD2-CG2 4.04Å; L718-T722 WeakPolarHBondContact O-CG2 3.39Å; L718-T722 PolarHBondContact O-N 2.76Å; L718-T722 PolarHBondContact O-OG1 3.48Å; D719-T722 CarbonylContact O-C 3.59Å; D719-T722 PolarHBondContact O-N 3.28Å; D719-T722 PolarHBondContact O-OG1 3.28Å; I720-T722 VanDerWaalsContact C-N 3.27Å; I720-T722 PolarHBondContact O-N 2.88Å; T722-H724 VanDerWaalsContact C-N 3.26Å; T722-H724 PolarHBondContact O-N 2.89Å; T722-W725 WeakPolarHBondContact O-CB 3.39Å; T722-W725 PolarHBondContact O-N 3.37Å; T722-W725 VanDerWaalsContact O-N 3.16Å; T722-H824 PolarHBondContact O-NE2 3.01Å
723	D	98.1	Very high	98.1	Very high	64 Å²	64	39.5 Å²	39.5	34%	0.342	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	43.2	176.9	-50.9	-73.9	0	0	0	112.9	Y528 K534 D719 I720 W725	Y528-D723 PolarHBondContact OH-OD2 3Å; K534-D723 WeakPolarHBondContact CE-OD2 3.39Å; K534-D723 IonicContact NZ-OD1 2.79Å; K534-D723 PolarHBondContact NZ-OD1 3.42Å; K534-D723 IonicContact NZ-OD2 2.66Å; K534-D723 PolarHBondContact NZ-OD2 3.4Å; D719-D723 PolarHBondContact O-N 2.77Å; I720-D723 PolarHBondContact O-N 2.85Å; D723-W725 VanDerWaalsContact C-N 3.33Å; D723-W725 PolarHBondContact O-N 3.03Å
724	H	98.1	Very high	98	Very high	94 Å²	94	38.5 Å²	38.5	44%	0.435	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	25.9	179.3	-57.9	-62.7	0	0	0	115.6	D719 T722 L726 S727 M728	D719-H724 WeakPolarHBondContact O-CA 3.36Å; D719-H724 PolarHBondContact O-N 3.37Å; D719-H724 WeakPolarHBondContact OD1-CA 3.34Å; D719-H724 IonicContact OD2-CE1 2.67Å; D719-H724 IonicContact OD2-CG 3.76Å; D719-H724 IonicContact OD2-ND1 3.7Å; D719-H724 PolarHBondContact OD2-ND1 3.11Å; T722-H724 VanDerWaalsContact C-N 3.26Å; T722-H724 PolarHBondContact O-N 2.89Å; H724-L726 VanDerWaalsContact C-N 3.34Å; H724-L726 PolarHBondContact O-N 2.68Å; H724-S727 PolarHBondContact O-N 3.25Å; H724-M728 WeakPolarHBondContact O-CB 3.37Å; H724-M728 VanDerWaalsContact O-CG 3.31Å; H724-M728 WeakPolarHBondContact O-CG 3.36Å; H724-M728 PolarHBondContact O-N 3.41Å
725	W	98.6	Very high	97.9	Very high	5 Å²	5	39.6 Å²	39.6	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-51.6	-50.1	175.8	-172.9	-70.2	0	0	0	112.7	E515 T516 I519 Y528 T722 D723 M728 A729 I821 H824 L827	E515-W725 WeakPolarHBondContact O-CZ2 3.49Å; T516-W725 PolarHBondContact O-NE1 3.09Å; I519-W725 HydrophobicContact CD1-CD2 3.63Å; I519-W725 HydrophobicContact CD1-CE3 3.96Å; I519-W725 HydrophobicContact CD1-CG 4.09Å; I519-W725 HydrophobicContact CD1-CH2 4.19Å; I519-W725 HydrophobicContact CD1-CZ2 3.87Å; I519-W725 HydrophobicContact CD1-CZ3 4.22Å; I519-W725 HydrophobicContact CG1-CB 4.11Å; I519-W725 HydrophobicContact CG1-CD2 3.69Å; I519-W725 HydrophobicContact CG1-CE3 4.17Å; I519-W725 HydrophobicContact CG1-CG 3.63Å; Y528-W725 HydrophobicContact CE2-CE3 4.5Å; T722-W725 WeakPolarHBondContact O-CB 3.39Å; T722-W725 PolarHBondContact O-N 3.37Å; T722-W725 VanDerWaalsContact O-N 3.16Å; D723-W725 VanDerWaalsContact C-N 3.33Å; D723-W725 PolarHBondContact O-N 3.03Å; W725-M728 PolarHBondContact O-N 2.65Å; W725-A729 WeakPolarHBondContact O-CB 3.49Å; W725-A729 PolarHBondContact O-N 3.44Å; W725-I821 HydrophobicContact CH2-CG2 3.85Å; W725-I821 HydrophobicContact CZ2-CG2 3.52Å; W725-H824 AromaticContact CE3-CD2 3.85Å; W725-H824 AromaticContact CE3-CE1 3.64Å; W725-H824 AromaticContact CE3-CG 3.97Å; W725-H824 AromaticContact CE3-ND1 3.86Å; W725-H824 AromaticContact CE3-NE2 3.62Å; W725-H824 AromaticContact CZ3-CE1 3.98Å; W725-H824 AromaticContact CZ3-ND1 3.89Å; W725-L827 HydrophobicContact CD2-CD1 3.75Å; W725-L827 HydrophobicContact CE3-CD1 4.39Å; W725-L827 HydrophobicContact CG-CD1 4Å; W725-L827 HydrophobicContact CZ2-CD1 3.93Å
726	L	97.8	Very high	97.9	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-45.2	-178.2	169.2	64.7	0	0	0	110.3	I518 K715 D719 H724 M728 A729 M730 Y762 Y764	I518-L726 HydrophobicContact CG2-CD1 4.41Å; K715-L726 HydrophobicContact CG-CD2 4.09Å; K715-L726 VanDerWaalsContact NZ-CD2 3.35Å; D719-L726 VanDerWaalsContact OD1-CB 3.32Å; D719-L726 WeakPolarHBondContact OD1-CB 3.27Å; D719-L726 PolarHBondContact OD1-N 3.1Å; H724-L726 VanDerWaalsContact C-N 3.34Å; H724-L726 PolarHBondContact O-N 2.68Å; L726-M728 VanDerWaalsContact C-N 3.35Å; L726-M728 PolarHBondContact O-N 2.93Å; L726-A729 PolarHBondContact O-N 3.18Å; L726-M730 HydrophobicContact CD1-CG 4.03Å; L726-M730 HydrophobicContact CD1-SD 4.11Å; L726-M730 HydrophobicContact CG-CG 4.49Å; L726-M730 HydrophobicContact CG-SD 4.19Å; L726-M730 VanDerWaalsContact O-CB 3.31Å; L726-M730 WeakPolarHBondContact O-CB 3.49Å; L726-M730 VanDerWaalsContact O-CG 3.27Å; L726-M730 WeakPolarHBondContact O-CG 3.28Å; L726-M730 PolarHBondContact O-N 2.97Å; L726-Y762 HydrophobicContact CD1-CD1 3.97Å; L726-Y762 HydrophobicContact CD2-CD1 3.82Å; L726-Y762 HydrophobicContact CG-CD1 4.47Å; L726-Y764 HydrophobicContact CD1-CD2 4.36Å; L726-Y764 HydrophobicContact CD1-CE2 3.41Å; L726-Y764 VanDerWaalsContact CD1-CE2 3.41Å
727	S	97.9	Very high	97.7	Very high	58 Å²	58	36.6 Å²	36.6	41%	0.406	19%	0.185	S	C	.	.	H	α-helix	trans	-59.9	-40.4	174.4	-70.1	0	0	0	0	112.9	D719 H724 K731	D719-S727 VanDerWaalsContact CG-OG 3.29Å; D719-S727 PolarHBondContact OD1-N 2.93Å; D719-S727 PolarHBondContact OD1-OG 3.39Å; D719-S727 PolarHBondContact OD2-OG 2.91Å; H724-S727 PolarHBondContact O-N 3.25Å; S727-K731 WeakPolarHBondContact O-CB 3.4Å; S727-K731 PolarHBondContact O-N 3.38Å; S727-K731 VanDerWaalsContact O-N 3.07Å
728	M	98	Very high	97.6	Very high	30 Å²	30	38.5 Å²	38.5	15%	0.148	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-41.4	177.2	-74.8	172	43.8	0	0	113	H724 W725 L726 A732 H824 L827 N828 N831	H724-M728 WeakPolarHBondContact O-CB 3.37Å; H724-M728 VanDerWaalsContact O-CG 3.31Å; H724-M728 WeakPolarHBondContact O-CG 3.36Å; H724-M728 PolarHBondContact O-N 3.41Å; W725-M728 PolarHBondContact O-N 2.65Å; L726-M728 VanDerWaalsContact C-N 3.35Å; L726-M728 PolarHBondContact O-N 2.93Å; M728-A732 PolarHBondContact O-N 3.21Å; M728-H824 HydrophobicContact CE-CB 3.96Å; M728-H824 VanDerWaalsContact CE-O 3.24Å; M728-H824 WeakPolarHBondContact CE-O 3.49Å; M728-L827 HydrophobicContact CB-CD1 4.5Å; M728-L827 HydrophobicContact CE-CB 3.71Å; M728-N828 HydrophobicContact CE-CB 4.43Å; M728-N828 VanDerWaalsContact CE-ND2 3.28Å; M728-N828 WeakPolarHBondContact CE-ND2 3.23Å; M728-N831 PolarHBondContact O-ND2 3.08Å
729	A	98.4	Very high	97.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-41.7	176.7	0	0	0	0	0	111.7	L517 W725 L726 K731 A732 T733 Y764 L827	L517-A729 HydrophobicContact CD2-CB 4.09Å; W725-A729 WeakPolarHBondContact O-CB 3.49Å; W725-A729 PolarHBondContact O-N 3.44Å; L726-A729 PolarHBondContact O-N 3.18Å; A729-K731 PolarHBondContact O-N 3.01Å; A729-A732 PolarHBondContact O-N 3.33Å; A729-T733 PolarHBondContact O-N 3.44Å; A729-T733 VanDerWaalsContact O-N 3.08Å; A729-Y764 WeakPolarHBondContact CB-OH 3.3Å; A729-L827 HydrophobicContact CB-CD1 4.2Å; A729-L827 HydrophobicContact CB-CD2 4.15Å
730	M	97.6	Very high	97	Very high	38 Å²	38	49.3 Å²	49.3	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-54.5	-50.4	171.4	-77.7	-175.9	69	0	0	110.9	L726 A732 T733 E734 Y764	L726-M730 HydrophobicContact CD1-CG 4.03Å; L726-M730 HydrophobicContact CD1-SD 4.11Å; L726-M730 HydrophobicContact CG-CG 4.49Å; L726-M730 HydrophobicContact CG-SD 4.19Å; L726-M730 VanDerWaalsContact O-CB 3.31Å; L726-M730 WeakPolarHBondContact O-CB 3.49Å; L726-M730 VanDerWaalsContact O-CG 3.27Å; L726-M730 WeakPolarHBondContact O-CG 3.28Å; L726-M730 PolarHBondContact O-N 2.97Å; M730-A732 VanDerWaalsContact C-N 3.25Å; M730-A732 PolarHBondContact O-N 2.76Å; M730-T733 PolarHBondContact O-N 2.84Å; M730-T733 PolarHBondContact O-OG1 2.9Å; M730-E734 WeakPolarHBondContact O-CG 3.22Å; M730-E734 PolarHBondContact O-N 2.97Å; M730-Y764 HydrophobicContact CB-CE1 4.42Å; M730-Y764 HydrophobicContact CG-CD1 4.32Å; M730-Y764 HydrophobicContact CG-CE1 3.69Å; M730-Y764 HydrophobicContact CG-CE2 4.4Å; M730-Y764 PolarHBondContact N-OH 3.36Å
731	K	97.3	Very high	96.7	Very high	98 Å²	98	47.4 Å²	47.4	43%	0.426	23%	0.234	S	C	.	.	H	α-helix	trans	-52.8	-39.4	177.1	-172.9	-176.6	176.6	-178.1	0	112.9	S727 A729 K735 N831	S727-K731 WeakPolarHBondContact O-CB 3.4Å; S727-K731 PolarHBondContact O-N 3.38Å; S727-K731 VanDerWaalsContact O-N 3.07Å; A729-K731 PolarHBondContact O-N 3.01Å; K731-K735 VanDerWaalsContact O-CG 3.27Å; K731-K735 WeakPolarHBondContact O-CG 3.41Å; K731-K735 PolarHBondContact O-N 3.22Å; K731-K735 VanDerWaalsContact O-N 3.12Å; K731-N831 WeakPolarHBondContact CD-OD1 3.45Å; K731-N831 WeakPolarHBondContact CG-OD1 3.39Å
732	A	98.2	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.8	-48.6	175.3	0	0	0	0	0	112.3	W511 M728 A729 M730 E734 K735 I736 L830 L834	W511-A732 HydrophobicContact CH2-CB 3.84Å; W511-A732 HydrophobicContact CZ2-CB 4.32Å; M728-A732 PolarHBondContact O-N 3.21Å; A729-A732 PolarHBondContact O-N 3.33Å; M730-A732 VanDerWaalsContact C-N 3.25Å; M730-A732 PolarHBondContact O-N 2.76Å; A732-E734 VanDerWaalsContact C-N 3.29Å; A732-E734 PolarHBondContact O-N 3.28Å; A732-K735 PolarHBondContact O-N 2.96Å; A732-I736 PolarHBondContact O-N 3.07Å; A732-L830 HydrophobicContact CB-CD2 4.4Å; A732-L834 HydrophobicContact CB-CD1 3.98Å
733	T	98	Very high	96.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-34.2	178	67.4	0	0	0	0	112.8	W511 L517 A729 M730 I736 N737 N744 Y764 S767 F768	W511-T733 HydrophobicContact CH2-CG2 4.24Å; W511-T733 HydrophobicContact CZ2-CG2 3.78Å; L517-T733 HydrophobicContact CD2-CG2 3.69Å; A729-T733 PolarHBondContact O-N 3.44Å; A729-T733 VanDerWaalsContact O-N 3.08Å; M730-T733 PolarHBondContact O-N 2.84Å; M730-T733 PolarHBondContact O-OG1 2.9Å; T733-I736 PolarHBondContact O-N 3.19Å; T733-N737 WeakPolarHBondContact O-CB 3.5Å; T733-N737 PolarHBondContact O-N 3.41Å; T733-N744 PolarHBondContact O-ND2 3.47Å; T733-Y764 HydrophobicContact CG2-CD1 4.32Å; T733-Y764 HydrophobicContact CG2-CE1 3.9Å; T733-S767 PolarHBondContact OG1-OG 3.29Å; T733-F768 HydrophobicContact CG2-CE2 4.13Å; T733-F768 HydrophobicContact CG2-CZ 4.22Å
734	E	96.8	Very high	96.6	Very high	76 Å²	76	45.3 Å²	45.3	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-71	-40.9	178.5	-75.8	-175.2	169.9	0	0	111.8	M730 A732 I736 N737 N738	M730-E734 WeakPolarHBondContact O-CG 3.22Å; M730-E734 PolarHBondContact O-N 2.97Å; A732-E734 VanDerWaalsContact C-N 3.29Å; A732-E734 PolarHBondContact O-N 3.28Å; E734-I736 VanDerWaalsContact C-N 3.26Å; E734-I736 PolarHBondContact O-N 3.38Å; E734-N737 PolarHBondContact O-N 3.09Å; E734-N738 WeakPolarHBondContact O-CB 3.35Å; E734-N738 PolarHBondContact O-N 3.29Å; E734-N738 PolarHBondContact O-ND2 2.85Å
735	K	96.1	Very high	96.6	Very high	36 Å²	36	40.8 Å²	40.8	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-54.5	-44.9	171.9	-77.2	166.7	175.3	-178.2	0	111.5	K731 A732 N738 N831 L834 D835	K731-K735 VanDerWaalsContact O-CG 3.27Å; K731-K735 WeakPolarHBondContact O-CG 3.41Å; K731-K735 PolarHBondContact O-N 3.22Å; K731-K735 VanDerWaalsContact O-N 3.12Å; A732-K735 PolarHBondContact O-N 2.96Å; K735-N738 PolarHBondContact O-N 2.93Å; K735-N831 PolarHBondContact NZ-O 2.88Å; K735-N831 PolarHBondContact NZ-OD1 3.2Å; K735-L834 HydrophobicContact CD-CB 3.98Å; K735-L834 HydrophobicContact CD-CD1 4.5Å; K735-D835 WeakPolarHBondContact CE-OD1 3.5Å; K735-D835 IonicContact NZ-OD1 3.6Å; K735-D835 PolarHBondContact NZ-OD1 3.32Å; K735-D835 IonicContact NZ-OD2 3.06Å; K735-D835 PolarHBondContact NZ-OD2 3.5Å
736	I	97.1	Very high	96.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-48.2	178.2	-67	160.5	0	0	0	110.9	F509 W511 A732 T733 E734 N738 R739 N744 L834	F509-I736 HydrophobicContact CB-CD1 4.09Å; F509-I736 HydrophobicContact CB-CG2 4.47Å; F509-I736 HydrophobicContact CD1-CD1 3.77Å; F509-I736 HydrophobicContact CD1-CG1 4.5Å; F509-I736 HydrophobicContact CD2-CB 4.32Å; F509-I736 HydrophobicContact CD2-CD1 3.83Å; F509-I736 HydrophobicContact CD2-CG1 3.88Å; F509-I736 HydrophobicContact CD2-CG2 3.45Å; F509-I736 VanDerWaalsContact CD2-CG2 3.45Å; F509-I736 HydrophobicContact CE1-CD1 4.01Å; F509-I736 HydrophobicContact CE1-CG1 4.41Å; F509-I736 HydrophobicContact CE2-CB 4.45Å; F509-I736 HydrophobicContact CE2-CD1 4.07Å; F509-I736 HydrophobicContact CE2-CG1 3.77Å; F509-I736 HydrophobicContact CE2-CG2 3.88Å; F509-I736 HydrophobicContact CG-CD1 3.63Å; F509-I736 HydrophobicContact CG-CG1 4.22Å; F509-I736 HydrophobicContact CG-CG2 4.17Å; F509-I736 HydrophobicContact CZ-CD1 4.14Å; F509-I736 HydrophobicContact CZ-CG1 4.03Å; W511-I736 HydrophobicContact CZ2-CD1 3.76Å; A732-I736 PolarHBondContact O-N 3.07Å; T733-I736 PolarHBondContact O-N 3.19Å; E734-I736 VanDerWaalsContact C-N 3.26Å; E734-I736 PolarHBondContact O-N 3.38Å; I736-N738 PolarHBondContact O-N 3.32Å; I736-R739 PolarHBondContact O-N 2.9Å; I736-N744 VanDerWaalsContact CG2-OD1 3.22Å; I736-N744 WeakPolarHBondContact CG2-OD1 3.35Å; I736-L834 HydrophobicContact CD1-CD1 4.05Å; I736-L834 HydrophobicContact CD1-CD2 4.19Å; I736-L834 HydrophobicContact CG1-CD1 4.16Å; I736-L834 HydrophobicContact CG1-CD2 3.8Å
737	N	95.3	Very high	96.6	Very high	55 Å²	55	40.6 Å²	40.6	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-64.5	-20.7	179.9	-167.4	36.3	0	0	0	113.5	T733 E734 N766	T733-N737 WeakPolarHBondContact O-CB 3.5Å; T733-N737 PolarHBondContact O-N 3.41Å; E734-N737 PolarHBondContact O-N 3.09Å; N737-N766 PolarHBondContact ND2-O 3.31Å
738	N	94.7	Very high	96.7	Very high	109 Å²	109	37.8 Å²	37.8	58%	0.583	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.2	174.9	-84.3	-75.4	0	0	0	114.1	E734 K735 I736	E734-N738 WeakPolarHBondContact O-CB 3.35Å; E734-N738 PolarHBondContact O-N 3.29Å; E734-N738 PolarHBondContact O-ND2 2.85Å; K735-N738 PolarHBondContact O-N 2.93Å; I736-N738 PolarHBondContact O-N 3.32Å
739	R	94.1	Very high	96.7	Very high	62 Å²	62	39.6 Å²	39.6	23%	0.234	20%	0.196	C	C	.	.			trans	-100.3	137.3	176.7	-65.1	172.4	179.2	-171.4	0.9	110.9	I736 D741 S742 L834 L839	I736-R739 PolarHBondContact O-N 2.9Å; R739-D741 VanDerWaalsContact C-N 3.31Å; R739-D741 WeakPolarHBondContact CB-OD1 3.17Å; R739-D741 PolarHBondContact O-N 3.1Å; R739-S742 WeakPolarHBondContact CD-OG 3.49Å; R739-L834 PolarHBondContact NH2-O 3.47Å; R739-L839 PolarHBondContact NH1-O 3.43Å; R739-L839 PolarHBondContact NH1-OXT 3.3Å; R739-L839 PolarHBondContact NH2-O 2.89Å
740	E	90.7	Very high	96.6	Very high	183 Å²	183	40.6 Å²	40.6	86%	0.855	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-17.3	-177.9	-59.4	-178.1	158.5	0	0	114.6	K504	K504-E740 IonicContact NZ-OE2 2.62Å
741	D	92.4	Very high	96.6	Very high	62 Å²	62	40.3 Å²	40.3	33%	0.332	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	3.6	-177.6	59.5	10.5	0	0	0	113.2	T506 R507 R739	T506-D741 CarbonylContact C-O 3.22Å; T506-D741 VanDerWaalsContact CA-O 3.29Å; T506-D741 WeakPolarHBondContact CA-O 3.28Å; T506-D741 WeakPolarHBondContact CG2-O 3.23Å; R507-D741 PolarHBondContact N-O 3.1Å; R739-D741 VanDerWaalsContact C-N 3.31Å; R739-D741 WeakPolarHBondContact CB-OD1 3.17Å; R739-D741 PolarHBondContact O-N 3.1Å
742	S	95.5	Very high	96.7	Very high	12 Å²	12	35.7 Å²	35.7	8%	0.084	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142	-169	-57.1	0	0	0	0	111.2	R507 R739	R507-S742 CarbonylContact O-C 3.56Å; R507-S742 VanDerWaalsContact O-CA 3.3Å; R507-S742 WeakPolarHBondContact O-CA 3.32Å; R739-S742 WeakPolarHBondContact CD-OG 3.49Å
743	V	96.9	Very high	96.7	Very high	25 Å²	25	35.7 Å²	35.7	15%	0.152	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	128.3	-176.5	-175.4	0	0	0	0	110.4	T506 R507 I508 F509 I745 N772 F792	T506-V743 HydrophobicContact CG2-CG2 4.06Å; R507-V743 PolarHBondContact O-N 3.38Å; I508-V743 HydrophobicContact CD1-CB 3.84Å; I508-V743 HydrophobicContact CD1-CG2 4Å; F509-V743 PolarHBondContact N-O 2.9Å; V743-I745 HydrophobicContact CG1-CG1 4.27Å; V743-N772 VanDerWaalsContact CG1-ND2 3.26Å; V743-N772 WeakPolarHBondContact CG1-ND2 3.49Å; V743-F792 HydrophobicContact CG1-CE1 4.38Å; V743-F792 HydrophobicContact CG1-CZ 4.37Å
744	N	98.3	Very high	96.7	Very high	5 Å²	5	36 Å²	36	3%	0.027	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.3	166.1	-67.8	-52.2	0	0	0	110.5	W511 T733 I736 S767 F768 N772	W511-N744 PolarHBondContact NE1-OD1 2.7Å; T733-N744 PolarHBondContact O-ND2 3.47Å; I736-N744 VanDerWaalsContact CG2-OD1 3.22Å; I736-N744 WeakPolarHBondContact CG2-OD1 3.35Å; N744-S767 PolarHBondContact ND2-O 3.11Å; N744-F768 HydrophobicContact CB-CD1 4.01Å; N744-F768 HydrophobicContact CB-CE1 3.73Å; N744-F768 HydrophobicContact CB-CZ 4.2Å; N744-N772 PolarHBondContact O-ND2 2.97Å
745	I	98.6	Very high	96.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	141	169.5	-58.7	-176.5	0	0	0	108.3	I508 F509 I510 W511 V743 V747 N772 Y774 I788 F792	I508-I745 HydrophobicContact CG2-CD1 3.38Å; I508-I745 HydrophobicContact CG2-CG1 4.02Å; F509-I745 PolarHBondContact O-N 2.95Å; I510-I745 WeakPolarHBondContact CA-O 3.42Å; W511-I745 PolarHBondContact N-O 3.19Å; V743-I745 HydrophobicContact CG1-CG1 4.27Å; I745-V747 HydrophobicContact CG2-CG2 4.48Å; I745-N772 WeakPolarHBondContact CA-O 3.49Å; I745-N772 HydrophobicContact CG1-CB 4.34Å; I745-N772 WeakPolarHBondContact CG2-O 3.34Å; I745-Y774 HydrophobicContact CG2-CD2 3.72Å; I745-Y774 HydrophobicContact CG2-CE2 3.68Å; I745-I788 HydrophobicContact CD1-CG1 4.35Å; I745-I788 HydrophobicContact CD1-CG2 3.76Å; I745-I788 HydrophobicContact CG2-CD1 3.69Å; I745-I788 HydrophobicContact CG2-CG1 4.21Å; I745-F792 HydrophobicContact CD1-CD2 3.98Å; I745-F792 HydrophobicContact CD1-CE2 3.37Å; I745-F792 HydrophobicContact CD1-CZ 3.84Å; I745-F792 HydrophobicContact CG1-CE2 4.49Å
746	L	98.8	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.5	173.7	-165.1	77.9	0	0	0	110.2	W511 L513 L517 T748 I759 F768 N772 I773 Y774	W511-L746 HydrophobicContact CB-CD1 4.14Å; W511-L746 WeakPolarHBondContact O-CA 3.23Å; L513-L746 HydrophobicContact CB-CD1 4.04Å; L513-L746 HydrophobicContact CB-CD2 4.29Å; L513-L746 HydrophobicContact CB-CG 4.46Å; L513-L746 HydrophobicContact CD1-CD1 4.5Å; L513-L746 HydrophobicContact CD1-CD2 4.5Å; L513-L746 HydrophobicContact CD2-CD2 4.33Å; L517-L746 HydrophobicContact CD1-CD1 3.69Å; L746-T748 HydrophobicContact CD2-CG2 4.24Å; L746-I759 HydrophobicContact CD2-CD1 3.72Å; L746-I759 HydrophobicContact CD2-CG1 3.79Å; L746-F768 HydrophobicContact CB-CD1 3.85Å; L746-F768 HydrophobicContact CB-CE1 3.83Å; L746-F768 HydrophobicContact CD1-CE1 4.15Å; L746-F768 HydrophobicContact CD1-CZ 4.15Å; L746-N772 PolarHBondContact N-O 3.27Å; L746-I773 HydrophobicContact CB-CG1 4.22Å; L746-I773 HydrophobicContact CD2-CG1 4.45Å; L746-I773 HydrophobicContact CD2-CG2 4.19Å; L746-Y774 PolarHBondContact O-N 3.12Å
747	V	98.8	Very high	96.9	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	116.7	168.2	-177.8	0	0	0	0	107	I510 W511 D512 I745 Y774 A776 K781 C784 F785 I788	I510-V747 HydrophobicContact CG2-CB 4.3Å; I510-V747 HydrophobicContact CG2-CG2 3.67Å; W511-V747 PolarHBondContact O-N 3.46Å; D512-V747 WeakPolarHBondContact CA-O 3.46Å; D512-V747 VanDerWaalsContact OD1-O 3.12Å; I745-V747 HydrophobicContact CG2-CG2 4.48Å; V747-Y774 WeakPolarHBondContact CA-O 3.35Å; V747-Y774 HydrophobicContact CG2-CD2 4.5Å; V747-A776 HydrophobicContact CG1-CB 4.24Å; V747-K781 HydrophobicContact CG1-CB 4.18Å; V747-K781 HydrophobicContact CG1-CG 4Å; V747-C784 HydrophobicContact CG1-CB 3.58Å; V747-C784 HydrophobicContact CG2-CB 4.21Å; V747-F785 HydrophobicContact CB-CE1 4.22Å; V747-F785 HydrophobicContact CG1-CE1 4.23Å; V747-F785 HydrophobicContact CG2-CD1 4.28Å; V747-F785 HydrophobicContact CG2-CE1 4.09Å; V747-I788 HydrophobicContact CG2-CD1 3.47Å; V747-I788 VanDerWaalsContact CG2-CD1 3.47Å
748	T	98.5	Very high	97.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.5	-176.6	174.9	0	0	0	0	111.5	L513 L746 T750 Y774 A776	L513-T748 HydrophobicContact CB-CG2 4.41Å; L513-T748 HydrophobicContact CD2-CG2 4.25Å; L746-T748 HydrophobicContact CD2-CG2 4.24Å; T748-T750 PolarHBondContact O-N 3.46Å; T748-T750 PolarHBondContact OG1-N 3.18Å; T748-T750 VanDerWaalsContact OG1-N 3.15Å; T748-T750 PolarHBondContact OG1-OG1 3.07Å; T748-Y774 PolarHBondContact N-O 2.88Å; T748-Y774 VanDerWaalsContact N-O 3.17Å; T748-A776 WeakPolarHBondContact O-CB 3.21Å; T748-A776 PolarHBondContact O-N 3.01Å
749	T	97.6	Very high	97.2	Very high	68 Å²	68	23.6 Å²	23.6	42%	0.417	12%	0.119	S	C	.	.	S	Bend	trans	-74.6	-6.8	171.8	50.3	0	0	0	0	113.6	T777 E806	T749-T777 PolarHBondContact O-OG1 2.97Å; T749-E806 WeakPolarHBondContact CG2-OE2 3.25Å
750	T	97.6	Very high	97.4	Very high	21 Å²	21	20.7 Å²	20.7	13%	0.129	11%	0.108	C	C	.	.	S	Bend	trans	-69	139.2	169.7	-60.5	0	0	0	0	110.7	D514 T748 P754 K758 S775 T777	D514-T750 PolarHBondContact OD2-OG1 3.32Å; T748-T750 PolarHBondContact O-N 3.46Å; T748-T750 PolarHBondContact OG1-N 3.18Å; T748-T750 VanDerWaalsContact OG1-N 3.15Å; T748-T750 PolarHBondContact OG1-OG1 3.07Å; T750-P754 HydrophobicContact CG2-CB 3.87Å; T750-K758 HydrophobicContact CG2-CD 4.25Å; T750-K758 PolarHBondContact OG1-NZ 2.97Å; T750-S775 PolarHBondContact O-OG 2.7Å; T750-T777 PolarHBondContact O-OG1 3.15Å
751	Q	97.8	Very high	97.8	Very high	32 Å²	32	12 Å²	12	15%	0.15	7%	0.068	C	C	.	.			trans	-51.8	149.4	172.3	-75	-169.9	29.7	0	0	111.3	E564 D567 I753 P754 S755 T777	E564-Q751 PolarHBondContact O-OE1 3.42Å; D567-Q751 HydrophobicContact CB-CG 4.41Å; D567-Q751 VanDerWaalsContact OD2-CA 3.3Å; D567-Q751 WeakPolarHBondContact OD2-CA 3.16Å; D567-Q751 WeakPolarHBondContact OD2-CB 3.43Å; D567-Q751 WeakPolarHBondContact OD2-CG 3.43Å; Q751-I753 PolarHBondContact O-N 2.87Å; Q751-P754 HydrophobicContact CB-CG 4.2Å; Q751-P754 WeakPolarHBondContact O-CD 3.4Å; Q751-S755 WeakPolarHBondContact O-CB 3.2Å; Q751-S755 PolarHBondContact O-N 3.12Å; Q751-T777 WeakPolarHBondContact CA-OG1 3.46Å; Q751-T777 HydrophobicContact CG-CG2 4Å; Q751-T777 PolarHBondContact N-OG1 3.19Å; Q751-T777 VanDerWaalsContact N-OG1 3.13Å
752	F	98	Very high	98	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.6	-45.6	-169.2	-176.6	-98.2	0	0	0	112.5	D567 Q568 I571 Y685 S755 L756 I770 I773	D567-F752 VanDerWaalsContact OD1-CB 3.22Å; D567-F752 WeakPolarHBondContact OD1-CB 3.22Å; D567-F752 PolarHBondContact OD1-N 2.81Å; D567-F752 PolarHBondContact OD2-N 3.49Å; Q568-F752 VanDerWaalsContact O-CB 3.24Å; Q568-F752 WeakPolarHBondContact O-CB 3.42Å; I571-F752 HydrophobicContact CB-CE1 4.34Å; I571-F752 HydrophobicContact CB-CZ 3.8Å; I571-F752 HydrophobicContact CD1-CE1 4.01Å; I571-F752 HydrophobicContact CD1-CZ 4.22Å; I571-F752 HydrophobicContact CG1-CZ 4.48Å; Y685-F752 HydrophobicContact CD1-CE1 4.49Å; Y685-F752 AromaticContact CE1-CD1 3.89Å; Y685-F752 HydrophobicContact CE1-CD1 3.89Å; Y685-F752 HydrophobicContact CE1-CE1 4.22Å; F752-S755 WeakPolarHBondContact O-CB 3.19Å; F752-S755 PolarHBondContact O-N 2.87Å; F752-S755 PolarHBondContact O-OG 3.08Å; F752-L756 HydrophobicContact CD1-CD1 4.28Å; F752-L756 HydrophobicContact CE1-CD1 3.64Å; F752-L756 HydrophobicContact CE1-CD2 4.42Å; F752-L756 HydrophobicContact CE1-CG 4.12Å; F752-L756 HydrophobicContact CE2-CD2 4.44Å; F752-L756 HydrophobicContact CZ-CD1 4.03Å; F752-L756 HydrophobicContact CZ-CD2 4.03Å; F752-L756 HydrophobicContact CZ-CG 4.22Å; F752-L756 PolarHBondContact O-N 3.2Å; F752-L756 VanDerWaalsContact O-N 3.15Å; F752-I770 HydrophobicContact CZ-CD1 4.33Å; F752-I770 HydrophobicContact CZ-CG1 4.05Å; F752-I773 HydrophobicContact CD2-CG2 4.28Å; F752-I773 HydrophobicContact CE2-CB 4.22Å; F752-I773 HydrophobicContact CE2-CG2 3.9Å
753	I	98.1	Very high	98.1	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-66.2	-49.9	-177.4	-56.5	-60.5	0	0	0	113.1	A554 L558 F560 L563 Y685 I688 Q751 S755 L756 A757	A554-I753 HydrophobicContact CB-CG2 4.26Å; L558-I753 HydrophobicContact CB-CG2 3.52Å; L558-I753 HydrophobicContact CD1-CG2 4.28Å; F560-I753 HydrophobicContact CB-CG2 3.89Å; F560-I753 HydrophobicContact CD2-CB 3.95Å; F560-I753 HydrophobicContact CD2-CG2 4.01Å; F560-I753 HydrophobicContact CG-CG2 4.34Å; L563-I753 HydrophobicContact CD1-CD1 4.26Å; L563-I753 HydrophobicContact CD1-CG1 4.32Å; Y685-I753 HydrophobicContact CE1-CD1 4.21Å; I688-I753 HydrophobicContact CD1-CD1 3.46Å; I688-I753 VanDerWaalsContact CD1-CD1 3.46Å; I688-I753 HydrophobicContact CG1-CD1 4.3Å; I688-I753 HydrophobicContact CG2-CD1 4.25Å; Q751-I753 PolarHBondContact O-N 2.87Å; I753-S755 VanDerWaalsContact C-N 3.27Å; I753-S755 PolarHBondContact O-N 3.05Å; I753-L756 PolarHBondContact O-N 2.82Å; I753-A757 PolarHBondContact O-N 3.44Å
754	P	98.3	Very high	98.1	Very high	6 Å²	6	8.6 Å²	8.6	4%	0.039	5%	0.054	C	C	.	.	H	α-helix	trans	-61.3	-29.6	171	-25.6	35.6	0	0	0	114	I550 Y551 F560 T750 Q751 L756 A757 K758	I550-P754 HydrophobicContact CG2-CB 4.47Å; Y551-P754 HydrophobicContact CE1-CG 4.41Å; F560-P754 HydrophobicContact CD2-CG 3.97Å; F560-P754 HydrophobicContact CE1-CG 4.32Å; F560-P754 HydrophobicContact CE2-CG 3.54Å; F560-P754 HydrophobicContact CZ-CG 3.75Å; T750-P754 HydrophobicContact CG2-CB 3.87Å; Q751-P754 HydrophobicContact CB-CG 4.2Å; Q751-P754 WeakPolarHBondContact O-CD 3.4Å; P754-L756 PolarHBondContact O-N 3.35Å; P754-A757 PolarHBondContact O-N 3.43Å; P754-K758 PolarHBondContact O-N 3.36Å
755	S	98.4	Very high	98	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-64.4	-38.4	175.4	83.6	0	0	0	0	112.3	Q751 F752 I753 K758 I759	Q751-S755 WeakPolarHBondContact O-CB 3.2Å; Q751-S755 PolarHBondContact O-N 3.12Å; F752-S755 WeakPolarHBondContact O-CB 3.19Å; F752-S755 PolarHBondContact O-N 2.87Å; F752-S755 PolarHBondContact O-OG 3.08Å; I753-S755 VanDerWaalsContact C-N 3.27Å; I753-S755 PolarHBondContact O-N 3.05Å; S755-K758 PolarHBondContact O-N 3.18Å; S755-I759 WeakPolarHBondContact O-CB 3.31Å; S755-I759 WeakPolarHBondContact O-CG1 3.28Å; S755-I759 PolarHBondContact O-N 3.18Å
756	L	98.5	Very high	97.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65	-41.5	173.1	-61.5	-176.3	0	0	0	111.4	L558 I688 Y692 F752 I753 P754 I759 L760 I770 I773	L558-L756 HydrophobicContact CD1-CB 4.03Å; I688-L756 HydrophobicContact CG2-CD1 3.43Å; I688-L756 VanDerWaalsContact CG2-CD1 3.43Å; Y692-L756 HydrophobicContact CD2-CB 4.32Å; Y692-L756 HydrophobicContact CD2-CD2 4.01Å; Y692-L756 HydrophobicContact CE2-CD2 4.03Å; F752-L756 HydrophobicContact CD1-CD1 4.28Å; F752-L756 HydrophobicContact CE1-CD1 3.64Å; F752-L756 HydrophobicContact CE1-CD2 4.42Å; F752-L756 HydrophobicContact CE1-CG 4.12Å; F752-L756 HydrophobicContact CE2-CD2 4.44Å; F752-L756 HydrophobicContact CZ-CD1 4.03Å; F752-L756 HydrophobicContact CZ-CD2 4.03Å; F752-L756 HydrophobicContact CZ-CG 4.22Å; F752-L756 PolarHBondContact O-N 3.2Å; F752-L756 VanDerWaalsContact O-N 3.15Å; I753-L756 PolarHBondContact O-N 2.82Å; P754-L756 PolarHBondContact O-N 3.35Å; L756-I759 PolarHBondContact O-N 3.12Å; L756-L760 WeakPolarHBondContact O-CB 3.06Å; L756-L760 VanDerWaalsContact O-CG 3.29Å; L756-L760 WeakPolarHBondContact O-CG 3.42Å; L756-L760 PolarHBondContact O-N 3.36Å; L756-I770 HydrophobicContact CD1-CD1 3.73Å; L756-I770 HydrophobicContact CD1-CG1 4.43Å; L756-I770 HydrophobicContact CD2-CD1 4.12Å; L756-I770 HydrophobicContact CD2-CG1 3.95Å; L756-I773 HydrophobicContact CD2-CD1 3.63Å; L756-I773 HydrophobicContact CD2-CG2 4.29Å
757	A	98.4	Very high	97.7	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.7	-43.8	176.3	0	0	0	0	0	111.9	I550 L553 A554 L558 I753 P754 L760 L761	I550-A757 HydrophobicContact CG2-CB 4.11Å; I550-A757 WeakPolarHBondContact O-CB 3.32Å; L553-A757 HydrophobicContact CB-CB 4.5Å; L553-A757 HydrophobicContact CD2-CB 3.99Å; A554-A757 HydrophobicContact CB-CB 4.16Å; L558-A757 HydrophobicContact CD1-CB 4.44Å; I753-A757 PolarHBondContact O-N 3.44Å; P754-A757 PolarHBondContact O-N 3.43Å; A757-L760 PolarHBondContact O-N 3.27Å; A757-L761 WeakPolarHBondContact O-CB 3.2Å; A757-L761 VanDerWaalsContact O-CG 3.3Å; A757-L761 WeakPolarHBondContact O-CG 3.21Å; A757-L761 PolarHBondContact O-N 2.7Å
758	K	98.3	Very high	97.6	Very high	15 Å²	15	11.8 Å²	11.8	7%	0.065	7%	0.072	C	C	.	.	H	α-helix	trans	-57.1	-53.4	171.1	-74.6	177	177.2	-176.3	0	111.6	L513 D514 I518 I550 T750 P754 S755 L760 L761 Y762	L513-K758 HydrophobicContact CD2-CB 3.95Å; L513-K758 HydrophobicContact CD2-CD 3.59Å; L513-K758 HydrophobicContact CD2-CG 4.43Å; L513-K758 HydrophobicContact CG-CD 4.44Å; D514-K758 IonicContact OD1-NZ 3.57Å; D514-K758 PolarHBondContact OD1-NZ 3.26Å; D514-K758 IonicContact OD2-NZ 3.56Å; D514-K758 PolarHBondContact OD2-NZ 2.89Å; I518-K758 HydrophobicContact CD1-CB 4.4Å; I518-K758 HydrophobicContact CD1-CD 4.05Å; I518-K758 HydrophobicContact CD1-CG 4.35Å; I550-K758 HydrophobicContact CD1-CG 3.76Å; I550-K758 HydrophobicContact CG1-CG 4.12Å; I550-K758 HydrophobicContact CG2-CG 4.2Å; T750-K758 HydrophobicContact CG2-CD 4.25Å; T750-K758 PolarHBondContact OG1-NZ 2.97Å; P754-K758 PolarHBondContact O-N 3.36Å; S755-K758 PolarHBondContact O-N 3.18Å; K758-L760 VanDerWaalsContact C-N 3.3Å; K758-L760 PolarHBondContact O-N 2.94Å; K758-L761 PolarHBondContact O-N 2.87Å; K758-Y762 WeakPolarHBondContact O-CB 3.31Å; K758-Y762 WeakPolarHBondContact O-CD2 3.46Å; K758-Y762 PolarHBondContact O-N 3.17Å
759	I	98.3	Very high	97.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.1	-38	-177.5	-74.6	-69.7	0	0	0	112.4	L513 Y692 L746 S755 L756 G763 Y764 G765 F768 I773	L513-I759 HydrophobicContact CD1-CD1 3.83Å; L513-I759 HydrophobicContact CD1-CG1 4.42Å; Y692-I759 HydrophobicContact CE2-CG2 3.96Å; Y692-I759 VanDerWaalsContact OH-CG2 3.27Å; Y692-I759 WeakPolarHBondContact OH-CG2 3.29Å; L746-I759 HydrophobicContact CD2-CD1 3.72Å; L746-I759 HydrophobicContact CD2-CG1 3.79Å; S755-I759 WeakPolarHBondContact O-CB 3.31Å; S755-I759 WeakPolarHBondContact O-CG1 3.28Å; S755-I759 PolarHBondContact O-N 3.18Å; L756-I759 PolarHBondContact O-N 3.12Å; I759-G763 PolarHBondContact O-N 2.94Å; I759-Y764 HydrophobicContact CD1-CD2 4.41Å; I759-Y764 HydrophobicContact CD1-CG 4.22Å; I759-Y764 PolarHBondContact O-N 2.91Å; I759-G765 PolarHBondContact O-N 3.31Å; I759-F768 HydrophobicContact CD1-CD2 4.18Å; I759-F768 HydrophobicContact CD1-CE2 4.49Å; I759-I773 HydrophobicContact CG1-CD1 4.37Å; I759-I773 HydrophobicContact CG2-CD1 4.27Å
760	L	98	Very high	97.5	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-66.2	-55.2	172.6	-68.1	172.9	0	0	0	111.2	L553 Y692 R696 V699 L702 L756 A757 K758 Y762 G763	L553-L760 HydrophobicContact CD2-CD1 4.35Å; Y692-L760 HydrophobicContact CD2-CD1 4.18Å; Y692-L760 HydrophobicContact CD2-CD2 3.87Å; Y692-L760 HydrophobicContact CD2-CG 3.99Å; Y692-L760 HydrophobicContact CE2-CD2 3.92Å; Y692-L760 HydrophobicContact CE2-CG 4.09Å; R696-L760 HydrophobicContact CB-CD2 4.13Å; V699-L760 HydrophobicContact CG1-CB 4.31Å; V699-L760 HydrophobicContact CG2-CB 3.85Å; V699-L760 HydrophobicContact CG2-CD2 4.02Å; V699-L760 HydrophobicContact CG2-CG 4.5Å; L702-L760 HydrophobicContact CD2-CD1 4.4Å; L756-L760 WeakPolarHBondContact O-CB 3.06Å; L756-L760 VanDerWaalsContact O-CG 3.29Å; L756-L760 WeakPolarHBondContact O-CG 3.42Å; L756-L760 PolarHBondContact O-N 3.36Å; A757-L760 PolarHBondContact O-N 3.27Å; K758-L760 VanDerWaalsContact C-N 3.3Å; K758-L760 PolarHBondContact O-N 2.94Å; L760-Y762 VanDerWaalsContact C-N 3.35Å; L760-Y762 PolarHBondContact O-N 2.87Å; L760-G763 PolarHBondContact O-N 2.81Å
761	L	98	Very high	97.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-68	-28.3	-173.5	-69.1	166.5	0	0	0	114.2	M546 L549 I550 L553 V699 L703 W711 A757 K758 G763	M546-L761 HydrophobicContact CE-CB 3.68Å; L549-L761 HydrophobicContact CB-CD1 4.05Å; I550-L761 HydrophobicContact CB-CD1 4.31Å; I550-L761 HydrophobicContact CG1-CD1 3.75Å; L553-L761 HydrophobicContact CB-CD1 4.45Å; L553-L761 HydrophobicContact CD1-CD1 4.04Å; L553-L761 HydrophobicContact CD1-CD2 3.82Å; L553-L761 HydrophobicContact CD1-CG 3.75Å; V699-L761 HydrophobicContact CG1-CD2 4.33Å; L703-L761 HydrophobicContact CD1-CD2 3.93Å; L703-L761 HydrophobicContact CD2-CD2 4.3Å; W711-L761 HydrophobicContact CD2-CD2 4.33Å; W711-L761 HydrophobicContact CG-CD2 4.1Å; W711-L761 WeakPolarHBondContact CZ2-O 3.21Å; W711-L761 PolarHBondContact NE1-O 3.1Å; A757-L761 WeakPolarHBondContact O-CB 3.2Å; A757-L761 VanDerWaalsContact O-CG 3.3Å; A757-L761 WeakPolarHBondContact O-CG 3.21Å; A757-L761 PolarHBondContact O-N 2.7Å; K758-L761 PolarHBondContact O-N 2.87Å; L761-G763 VanDerWaalsContact C-N 3.34Å
762	Y	97.9	Very high	97.4	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.008	6%	0.062	C	C	.	.	H	α-helix	trans	-84.7	-6.8	172.7	-78.4	-93.3	0	0	0	113.2	I518 I519 F520 M546 I550 K715 L718 L726 K758 L760	I518-Y762 HydrophobicContact CB-CD1 3.85Å; I518-Y762 HydrophobicContact CB-CD2 4.42Å; I518-Y762 HydrophobicContact CB-CE1 3.72Å; I518-Y762 HydrophobicContact CB-CE2 4.32Å; I518-Y762 HydrophobicContact CB-CG 4.2Å; I518-Y762 HydrophobicContact CD1-CD2 3.88Å; I518-Y762 HydrophobicContact CD1-CE2 3.58Å; I518-Y762 HydrophobicContact CD1-CG 4.47Å; I518-Y762 HydrophobicContact CG2-CD1 3.37Å; I518-Y762 HydrophobicContact CG2-CD2 3.94Å; I518-Y762 HydrophobicContact CG2-CE1 3.82Å; I518-Y762 HydrophobicContact CG2-CE2 4.33Å; I518-Y762 HydrophobicContact CG2-CG 3.43Å; I518-Y762 VanDerWaalsContact CG2-CG 3.43Å; I519-Y762 PolarHBondContact O-OH 3.01Å; F520-Y762 WeakPolarHBondContact CD2-OH 3.48Å; M546-Y762 HydrophobicContact CE-CD1 4.24Å; M546-Y762 HydrophobicContact CE-CD2 3.46Å; M546-Y762 VanDerWaalsContact CE-CD2 3.46Å; M546-Y762 HydrophobicContact CE-CE1 4.16Å; M546-Y762 HydrophobicContact CE-CE2 3.34Å; M546-Y762 HydrophobicContact CE-CG 3.94Å; M546-Y762 HydrophobicContact CG-CE2 3.93Å; I550-Y762 HydrophobicContact CD1-CE2 4.5Å; K715-Y762 WeakPolarHBondContact CE-O 3.37Å; K715-Y762 PolarHBondContact NZ-O 3.41Å; L718-Y762 HydrophobicContact CD1-CE1 4.4Å; L718-Y762 HydrophobicContact CD2-CE1 4.17Å; L726-Y762 HydrophobicContact CD1-CD1 3.97Å; L726-Y762 HydrophobicContact CD2-CD1 3.82Å; L726-Y762 HydrophobicContact CG-CD1 4.47Å; K758-Y762 WeakPolarHBondContact O-CB 3.31Å; K758-Y762 WeakPolarHBondContact O-CD2 3.46Å; K758-Y762 PolarHBondContact O-N 3.17Å; L760-Y762 VanDerWaalsContact C-N 3.35Å; L760-Y762 PolarHBondContact O-N 2.87Å
763	G	96.4	Very high	97.5	Very high	26 Å²	26	11.1 Å²	11.1	27%	0.268	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	8.9	173.7	0	0	0	0	0	115.3	I759 L760 L761 G765	I759-G763 PolarHBondContact O-N 2.94Å; L760-G763 PolarHBondContact O-N 2.81Å; L761-G763 VanDerWaalsContact C-N 3.34Å; G763-G765 PolarHBondContact O-N 2.95Å
764	Y	97.7	Very high	97.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-3.1	-178.9	-78.8	-70.5	0	0	0	114.8	L517 I518 L726 A729 M730 T733 I759 N766 S767 F768	L517-Y764 HydrophobicContact CB-CE2 4.16Å; L517-Y764 HydrophobicContact CD2-CE1 4.05Å; L517-Y764 PolarHBondContact O-OH 3.1Å; L517-Y764 VanDerWaalsContact O-OH 3.12Å; I518-Y764 HydrophobicContact CG2-CD2 4.29Å; I518-Y764 HydrophobicContact CG2-CE2 3.72Å; L726-Y764 HydrophobicContact CD1-CD2 4.36Å; L726-Y764 HydrophobicContact CD1-CE2 3.41Å; L726-Y764 VanDerWaalsContact CD1-CE2 3.41Å; A729-Y764 WeakPolarHBondContact CB-OH 3.3Å; M730-Y764 HydrophobicContact CB-CE1 4.42Å; M730-Y764 HydrophobicContact CG-CD1 4.32Å; M730-Y764 HydrophobicContact CG-CE1 3.69Å; M730-Y764 HydrophobicContact CG-CE2 4.4Å; M730-Y764 PolarHBondContact N-OH 3.36Å; T733-Y764 HydrophobicContact CG2-CD1 4.32Å; T733-Y764 HydrophobicContact CG2-CE1 3.9Å; I759-Y764 HydrophobicContact CD1-CD2 4.41Å; I759-Y764 HydrophobicContact CD1-CG 4.22Å; I759-Y764 PolarHBondContact O-N 2.91Å; Y764-N766 PolarHBondContact O-N 2.92Å; Y764-N766 VanDerWaalsContact O-N 3.09Å; Y764-S767 PolarHBondContact O-N 3.43Å; Y764-F768 HydrophobicContact CD1-CD2 4.36Å; Y764-F768 AromaticContact CD1-CE2 3.9Å; Y764-F768 HydrophobicContact CD1-CE2 3.9Å; Y764-F768 HydrophobicContact CG-CE2 4.35Å; Y764-F768 PolarHBondContact O-N 3.01Å
765	G	95.7	Very high	97.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-28.8	180	0	0	0	0	0	114.8	R696 I759 G763	R696-G765 PolarHBondContact NE-O 3.26Å; R696-G765 PolarHBondContact NH2-O 3.24Å; R696-G765 CarbonylContact O-C 3.55Å; I759-G765 PolarHBondContact O-N 3.31Å; G763-G765 PolarHBondContact O-N 2.95Å
766	N	94.1	Very high	97.5	Very high	70 Å²	70	11.3 Å²	11.3	37%	0.374	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-45.9	172.2	-173.3	32.7	0	0	0	112.1	R696 N737 Y764	R696-N766 PolarHBondContact NH2-O 3.34Å; N737-N766 PolarHBondContact ND2-O 3.31Å; Y764-N766 PolarHBondContact O-N 2.92Å; Y764-N766 VanDerWaalsContact O-N 3.09Å
767	S	96.2	Very high	97.4	Very high	6 Å²	6	13.7 Å²	13.7	4%	0.042	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-28.6	-172.3	-58.5	0	0	0	0	114.6	T733 N744 Y764	T733-S767 PolarHBondContact OG1-OG 3.29Å; N744-S767 PolarHBondContact ND2-O 3.11Å; Y764-S767 PolarHBondContact O-N 3.43Å
768	F	97.5	Very high	97.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.			trans	-117.6	121.6	-178.1	-62.8	-90.9	0	0	0	111.7	W511 L517 Y692 R696 T733 N744 L746 I759 Y764 I773	W511-F768 HydrophobicContact CB-CZ 4.36Å; W511-F768 AromaticContact CD1-CZ 3.93Å; W511-F768 HydrophobicContact CG-CZ 4.18Å; L517-F768 HydrophobicContact CD1-CE2 3.95Å; L517-F768 HydrophobicContact CD1-CZ 3.75Å; Y692-F768 PolarHBondContact OH-O 3.01Å; R696-F768 PolarHBondContact NH2-O 3.09Å; T733-F768 HydrophobicContact CG2-CE2 4.13Å; T733-F768 HydrophobicContact CG2-CZ 4.22Å; N744-F768 HydrophobicContact CB-CD1 4.01Å; N744-F768 HydrophobicContact CB-CE1 3.73Å; N744-F768 HydrophobicContact CB-CZ 4.2Å; L746-F768 HydrophobicContact CB-CD1 3.85Å; L746-F768 HydrophobicContact CB-CE1 3.83Å; L746-F768 HydrophobicContact CD1-CE1 4.15Å; L746-F768 HydrophobicContact CD1-CZ 4.15Å; I759-F768 HydrophobicContact CD1-CD2 4.18Å; I759-F768 HydrophobicContact CD1-CE2 4.49Å; Y764-F768 HydrophobicContact CD1-CD2 4.36Å; Y764-F768 AromaticContact CD1-CE2 3.9Å; Y764-F768 HydrophobicContact CD1-CE2 3.9Å; Y764-F768 HydrophobicContact CG-CE2 4.35Å; Y764-F768 PolarHBondContact O-N 3.01Å; F768-I773 HydrophobicContact CB-CD1 4.26Å; F768-I773 HydrophobicContact CB-CG1 4.25Å
769	Q	96	Very high	97.2	Very high	64 Å²	64	21 Å²	21	30%	0.299	11%	0.114	S	C	.	.			trans	-71.4	145.6	163.3	-61.9	-177.9	-44.3	0	0	108.9	E771 N772	Q769-E771 PolarHBondContact O-N 2.96Å; Q769-N772 HydrophobicContact CB-CB 4.5Å; Q769-N772 WeakPolarHBondContact O-CA 3.42Å; Q769-N772 WeakPolarHBondContact O-CB 3.38Å; Q769-N772 PolarHBondContact O-N 2.98Å
770	I	97.5	Very high	97.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-63.7	-30.5	-179.8	-174.9	171.6	0	0	0	111.9	I571 I688 R689 Y692 F752 L756 N772 I773	I571-I770 HydrophobicContact CB-CD1 4.4Å; I571-I770 HydrophobicContact CB-CG1 4.11Å; I571-I770 HydrophobicContact CD1-CD1 3.64Å; I571-I770 HydrophobicContact CD1-CG1 4.29Å; I571-I770 HydrophobicContact CG1-CD1 3.74Å; I571-I770 HydrophobicContact CG1-CG1 3.92Å; I571-I770 HydrophobicContact CG2-CG1 4.36Å; I688-I770 HydrophobicContact CG2-CD1 4.27Å; R689-I770 HydrophobicContact CB-CD1 4.48Å; R689-I770 HydrophobicContact CG-CG2 3.71Å; Y692-I770 HydrophobicContact CD1-CB 3.65Å; Y692-I770 HydrophobicContact CD1-CD1 4.45Å; Y692-I770 HydrophobicContact CD1-CG1 4.49Å; Y692-I770 HydrophobicContact CD1-CG2 4.1Å; Y692-I770 HydrophobicContact CE1-CB 3.86Å; Y692-I770 HydrophobicContact CG-CB 4.12Å; Y692-I770 HydrophobicContact CG-CD1 4.1Å; Y692-I770 HydrophobicContact CG-CG1 4.5Å; F752-I770 HydrophobicContact CZ-CD1 4.33Å; F752-I770 HydrophobicContact CZ-CG1 4.05Å; L756-I770 HydrophobicContact CD1-CD1 3.73Å; L756-I770 HydrophobicContact CD1-CG1 4.43Å; L756-I770 HydrophobicContact CD2-CD1 4.12Å; L756-I770 HydrophobicContact CD2-CG1 3.95Å; I770-N772 PolarHBondContact O-N 2.88Å; I770-N772 VanDerWaalsContact O-N 3.16Å; I770-I773 PolarHBondContact O-N 3.41Å
771	E	96.6	Very high	97.1	Very high	36 Å²	36	22.5 Å²	22.5	17%	0.168	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-63.1	-14.1	170	-64.7	70.6	-155.2	0	0	113.2	H570 I571 R689 Q769 R791	H570-E771 WeakPolarHBondContact NE2-CA 3.33Å; H570-E771 CovalentContact NE2-O 1.81Å; H570-E771 PolarHBondContact NE2-O 3.33Å; I571-E771 HydrophobicContact CG2-CG 4.45Å; R689-E771 WeakPolarHBondContact CD-OE1 3.49Å; R689-E771 IonicContact CZ-OE1 3.59Å; R689-E771 IonicContact NE-OE1 2.66Å; R689-E771 IonicContact NH1-OE1 3.55Å; R689-E771 PolarHBondContact NH1-OE1 2.89Å; Q769-E771 PolarHBondContact O-N 2.96Å; E771-R791 PolarHBondContact O-NH1 2.93Å
772	N	98.1	Very high	97.1	Very high	7 Å²	7	26.4 Å²	26.4	4%	0.037	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-108.8	18.9	179.1	-69.2	10.5	0	0	0	112.8	V743 N744 I745 L746 Q769 I770 R791	V743-N772 VanDerWaalsContact CG1-ND2 3.26Å; V743-N772 WeakPolarHBondContact CG1-ND2 3.49Å; N744-N772 PolarHBondContact O-ND2 2.97Å; I745-N772 WeakPolarHBondContact CA-O 3.49Å; I745-N772 HydrophobicContact CG1-CB 4.34Å; I745-N772 WeakPolarHBondContact CG2-O 3.34Å; L746-N772 PolarHBondContact N-O 3.27Å; Q769-N772 HydrophobicContact CB-CB 4.5Å; Q769-N772 WeakPolarHBondContact O-CA 3.42Å; Q769-N772 WeakPolarHBondContact O-CB 3.38Å; Q769-N772 PolarHBondContact O-N 2.98Å; I770-N772 PolarHBondContact O-N 2.88Å; I770-N772 VanDerWaalsContact O-N 3.16Å; N772-R791 PolarHBondContact OD1-NH1 3.05Å; N772-R791 PolarHBondContact OD1-NH2 3.16Å
773	I	98.5	Very high	97.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.1	174.9	-63	173.1	0	0	0	108.5	H570 Y692 L746 F752 L756 I759 F768 I770	H570-I773 PolarHBondContact CD2-O 3.06Å; Y692-I773 HydrophobicContact CE2-CD1 4.33Å; L746-I773 HydrophobicContact CB-CG1 4.22Å; L746-I773 HydrophobicContact CD2-CG1 4.45Å; L746-I773 HydrophobicContact CD2-CG2 4.19Å; F752-I773 HydrophobicContact CD2-CG2 4.28Å; F752-I773 HydrophobicContact CE2-CB 4.22Å; F752-I773 HydrophobicContact CE2-CG2 3.9Å; L756-I773 HydrophobicContact CD2-CD1 3.63Å; L756-I773 HydrophobicContact CD2-CG2 4.29Å; I759-I773 HydrophobicContact CG1-CD1 4.37Å; I759-I773 HydrophobicContact CG2-CD1 4.27Å; F768-I773 HydrophobicContact CB-CD1 4.26Å; F768-I773 HydrophobicContact CB-CG1 4.25Å; I770-I773 PolarHBondContact O-N 3.41Å
774	Y	98.6	Very high	97.1	Very high	8 Å²	8	28.7 Å²	28.7	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133	177.9	-62.4	-97.8	0	0	0	110.3	V569 H570 I745 L746 V747 T748 R787 I788 R791	V569-Y774 HydrophobicContact CG1-CD1 4.48Å; V569-Y774 CarbonylContact O-C 3.53Å; V569-Y774 WeakPolarHBondContact O-CA 3.47Å; H570-Y774 HydrophobicContact CB-CD1 4.23Å; H570-Y774 HydrophobicContact CB-CE1 4.39Å; H570-Y774 AromaticContact CD2-CD1 3.66Å; H570-Y774 AromaticContact CD2-CE1 3.43Å; H570-Y774 VanDerWaalsContact CD2-CE1 3.43Å; H570-Y774 WeakPolarHBondContact CD2-CE1 3.44Å; H570-Y774 AromaticContact CD2-CZ 3.78Å; H570-Y774 AromaticContact NE2-CZ 3.89Å; I745-Y774 HydrophobicContact CG2-CD2 3.72Å; I745-Y774 HydrophobicContact CG2-CE2 3.68Å; L746-Y774 PolarHBondContact O-N 3.12Å; V747-Y774 WeakPolarHBondContact CA-O 3.35Å; V747-Y774 HydrophobicContact CG2-CD2 4.5Å; T748-Y774 PolarHBondContact N-O 2.88Å; T748-Y774 VanDerWaalsContact N-O 3.17Å; Y774-R787 HydrophobicContact CE1-CB 4.48Å; Y774-I788 HydrophobicContact CD2-CD1 4.03Å; Y774-I788 HydrophobicContact CD2-CG1 4.12Å; Y774-I788 HydrophobicContact CE1-CG1 4.4Å; Y774-I788 HydrophobicContact CE2-CD1 4.03Å; Y774-I788 HydrophobicContact CE2-CG1 3.64Å; Y774-R791 WeakPolarHBondContact OH-CD 3.36Å; Y774-R791 PolarHBondContact OH-NH1 3.43Å
775	S	98.5	Very high	97.2	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.7	169.6	-178.4	0	0	0	0	110.6	V569 T750 T777	V569-S775 PolarHBondContact O-N 3.49Å; T750-S775 PolarHBondContact O-OG 2.7Å; S775-T777 VanDerWaalsContact C-N 3.35Å; S775-T777 PolarHBondContact OG-N 2.96Å; S775-T777 PolarHBondContact OG-OG1 2.87Å
776	A	98.3	Very high	97.3	Very high	2 Å²	2	34 Å²	34	2%	0.017	18%	0.175	C	C	.	.			trans	-82.8	-8.7	175	0	0	0	0	0	112.9	V747 T748 K778 V779 G780 K781	V747-A776 HydrophobicContact CG1-CB 4.24Å; T748-A776 WeakPolarHBondContact O-CB 3.21Å; T748-A776 PolarHBondContact O-N 3.01Å; A776-K778 PolarHBondContact O-N 2.97Å; A776-V779 PolarHBondContact O-N 3.01Å; A776-G780 PolarHBondContact O-N 3.01Å; A776-K781 HydrophobicContact CB-CG 3.86Å
777	T	96.8	Very high	97.4	Very high	49 Å²	49	35.6 Å²	35.6	30%	0.301	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-34.7	-166.6	-49.4	0	0	0	0	114.8	T749 T750 Q751 S775	T749-T777 PolarHBondContact O-OG1 2.97Å; T750-T777 PolarHBondContact O-OG1 3.15Å; Q751-T777 WeakPolarHBondContact CA-OG1 3.46Å; Q751-T777 HydrophobicContact CG-CG2 4Å; Q751-T777 PolarHBondContact N-OG1 3.19Å; Q751-T777 VanDerWaalsContact N-OG1 3.13Å; S775-T777 VanDerWaalsContact C-N 3.35Å; S775-T777 PolarHBondContact OG-N 2.96Å; S775-T777 PolarHBondContact OG-OG1 2.87Å
778	K	95.4	Very high	97.5	Very high	115 Å²	115	35.3 Å²	35.3	50%	0.5	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-6.7	-178.5	-65.1	-178.6	178.7	177.7	0	114.7	E565 D567 A776	E565-K778 PolarHBondContact O-NZ 3.21Å; D567-K778 VanDerWaalsContact N-NZ 3.16Å; D567-K778 WeakPolarHBondContact O-CE 3.27Å; D567-K778 PolarHBondContact O-NZ 2.77Å; A776-K778 PolarHBondContact O-N 2.97Å
779	V	96	Very high	97.4	Very high	54 Å²	54	36.5 Å²	36.5	33%	0.327	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-12.1	-170.5	-61.6	0	0	0	0	115.8	V569 A776 N783	V569-V779 HydrophobicContact CG1-CG2 4.16Å; V569-V779 HydrophobicContact CG2-CB 4.32Å; V569-V779 HydrophobicContact CG2-CG1 3.66Å; V569-V779 HydrophobicContact CG2-CG2 3.65Å; A776-V779 PolarHBondContact O-N 3.01Å; V779-N783 HydrophobicContact CB-CB 4.01Å; V779-N783 HydrophobicContact CG2-CB 4.23Å; V779-N783 PolarHBondContact O-ND2 3.35Å
780	G	96.9	Very high	97.4	Very high	21 Å²	21	37.9 Å²	37.9	22%	0.216	20%	0.201	C	C	.	.	H	α-helix	trans	75.8	155.5	-172.9	0	0	0	0	0	113.9	A776 E782 N783 C784 E806	A776-G780 PolarHBondContact O-N 3.01Å; G780-E782 VanDerWaalsContact C-N 3.26Å; G780-E782 PolarHBondContact O-N 3.45Å; G780-N783 PolarHBondContact O-N 3.43Å; G780-C784 PolarHBondContact O-N 3.29Å; G780-E806 VanDerWaalsContact CA-OE1 3.25Å; G780-E806 WeakPolarHBondContact CA-OE1 3.36Å
781	K	98	Very high	97.3	Very high	11 Å²	11	42.4 Å²	42.4	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-32.2	-176.6	-62.6	-177.6	-162.8	-175.8	0	112.1	D512 V747 A776 C784 F785 E806 E807	D512-K781 WeakPolarHBondContact OD1-CE 3.37Å; D512-K781 IonicContact OD1-NZ 3.41Å; D512-K781 PolarHBondContact OD1-NZ 3.3Å; V747-K781 HydrophobicContact CG1-CB 4.18Å; V747-K781 HydrophobicContact CG1-CG 4Å; A776-K781 HydrophobicContact CB-CG 3.86Å; K781-C784 WeakPolarHBondContact O-CB 2.94Å; K781-C784 PolarHBondContact O-N 2.94Å; K781-F785 HydrophobicContact CB-CE1 4.26Å; K781-F785 WeakPolarHBondContact O-CD1 3.44Å; K781-F785 WeakPolarHBondContact O-CG 3.42Å; K781-F785 PolarHBondContact O-N 3.41Å; K781-E806 HydrophobicContact CB-CG 4.13Å; K781-E806 HydrophobicContact CD-CB 4.09Å; K781-E806 HydrophobicContact CD-CG 4.13Å; K781-E806 VanDerWaalsContact CE-OE2 3.23Å; K781-E806 WeakPolarHBondContact CE-OE2 3.27Å; K781-E806 HydrophobicContact CG-CG 4.1Å; K781-E806 PolarHBondContact N-OE1 2.77Å; K781-E807 HydrophobicContact CD-CB 3.82Å; K781-E807 IonicContact NZ-OE1 3.73Å; K781-E807 PolarHBondContact NZ-OE1 2.91Å; K781-E807 IonicContact NZ-OE2 2.81Å; K781-E807 PolarHBondContact NZ-OE2 3.23Å
782	E	97.6	Very high	97.3	Very high	82 Å²	82	42.7 Å²	42.7	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-55.9	-50.6	176.2	-170.8	-165.8	156.8	0	0	112.9	G780 C784 F785 E786 A810 Q813 F814	G780-E782 VanDerWaalsContact C-N 3.26Å; G780-E782 PolarHBondContact O-N 3.45Å; E782-C784 VanDerWaalsContact C-N 3.31Å; E782-C784 PolarHBondContact O-N 2.77Å; E782-F785 WeakPolarHBondContact O-CA 3.37Å; E782-F785 WeakPolarHBondContact O-CB 3.32Å; E782-F785 PolarHBondContact O-N 3.44Å; E782-E786 PolarHBondContact O-N 3.02Å; E782-A810 HydrophobicContact CB-CB 4.27Å; E782-Q813 PolarHBondContact OE1-NE2 2.95Å; E782-Q813 PolarHBondContact OE1-OE1 3.29Å; E782-F814 HydrophobicContact CG-CE2 4.09Å
783	N	97.8	Very high	97	Very high	76 Å²	76	43.6 Å²	43.6	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-68	-31.5	178.6	-75.1	-67.3	0	0	0	112.1	V779 G780 E786 R787	V779-N783 HydrophobicContact CB-CB 4.01Å; V779-N783 HydrophobicContact CG2-CB 4.23Å; V779-N783 PolarHBondContact O-ND2 3.35Å; G780-N783 PolarHBondContact O-N 3.43Å; N783-E786 PolarHBondContact O-N 3.01Å; N783-R787 WeakPolarHBondContact O-CG 3.45Å; N783-R787 PolarHBondContact O-N 2.68Å; N783-R787 VanDerWaalsContact O-N 3.09Å
784	C	98.3	Very high	96.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-39.3	169.3	-70.9	0	0	0	0	111.6	V747 G780 K781 E782 R787 I788	V747-C784 HydrophobicContact CG1-CB 3.58Å; V747-C784 HydrophobicContact CG2-CB 4.21Å; G780-C784 PolarHBondContact O-N 3.29Å; K781-C784 WeakPolarHBondContact O-CB 2.94Å; K781-C784 PolarHBondContact O-N 2.94Å; E782-C784 VanDerWaalsContact C-N 3.31Å; E782-C784 PolarHBondContact O-N 2.77Å; C784-R787 PolarHBondContact O-N 3.39Å; C784-I788 WeakPolarHBondContact O-CD1 3.48Å; C784-I788 VanDerWaalsContact O-CG1 3.25Å; C784-I788 WeakPolarHBondContact O-CG1 3.26Å; C784-I788 PolarHBondContact O-N 2.81Å
785	F	98.2	Very high	96.3	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.009	30%	0.3	C	S	.	.	H	α-helix	trans	-66.7	-38.2	176.6	-70.8	14.2	0	0	0	111.3	I510 V747 K781 E782 I788 A789 V800 E807 A810 F814 W816	I510-F785 HydrophobicContact CD1-CD1 4.49Å; I510-F785 HydrophobicContact CG2-CD1 4.24Å; I510-F785 HydrophobicContact CG2-CE1 3.65Å; I510-F785 HydrophobicContact CG2-CZ 4.19Å; V747-F785 HydrophobicContact CB-CE1 4.22Å; V747-F785 HydrophobicContact CG1-CE1 4.23Å; V747-F785 HydrophobicContact CG2-CD1 4.28Å; V747-F785 HydrophobicContact CG2-CE1 4.09Å; K781-F785 HydrophobicContact CB-CE1 4.26Å; K781-F785 WeakPolarHBondContact O-CD1 3.44Å; K781-F785 WeakPolarHBondContact O-CG 3.42Å; K781-F785 PolarHBondContact O-N 3.41Å; E782-F785 WeakPolarHBondContact O-CA 3.37Å; E782-F785 WeakPolarHBondContact O-CB 3.32Å; E782-F785 PolarHBondContact O-N 3.44Å; F785-I788 PolarHBondContact O-N 3.37Å; F785-A789 WeakPolarHBondContact O-CB 3.4Å; F785-A789 PolarHBondContact O-N 3.18Å; F785-V800 HydrophobicContact CD2-CG2 4.5Å; F785-V800 HydrophobicContact CE2-CG1 3.91Å; F785-V800 HydrophobicContact CE2-CG2 3.79Å; F785-V800 HydrophobicContact CZ-CG1 3.62Å; F785-V800 HydrophobicContact CZ-CG2 4.1Å; F785-E807 HydrophobicContact CZ-CB 4.14Å; F785-A810 HydrophobicContact CD2-CB 3.65Å; F785-A810 HydrophobicContact CE2-CB 3.6Å; F785-A810 HydrophobicContact CZ-CB 4.42Å; F785-F814 HydrophobicContact CB-CD2 4.05Å; F785-F814 HydrophobicContact CB-CE2 3.84Å; F785-F814 HydrophobicContact CB-CZ 4.31Å; F785-F814 HydrophobicContact CD2-CD2 4.39Å; F785-W816 HydrophobicContact CB-CH2 4.18Å; F785-W816 HydrophobicContact CB-CZ3 3.76Å; F785-W816 HydrophobicContact CD2-CE3 4.07Å; F785-W816 AromaticContact CD2-CZ3 3.85Å; F785-W816 HydrophobicContact CD2-CZ3 3.85Å; F785-W816 AromaticContact CG-CZ3 3.86Å; F785-W816 HydrophobicContact CG-CZ3 3.86Å
786	E	97.4	Very high	96	Very high	110 Å²	110	62.3 Å²	62.3	51%	0.514	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-44.4	172.5	-161.8	-172.2	-159.9	0	0	112	E782 N783 I788 A789 S790 F814	E782-E786 PolarHBondContact O-N 3.02Å; N783-E786 PolarHBondContact O-N 3.01Å; E786-I788 VanDerWaalsContact C-N 3.33Å; E786-I788 PolarHBondContact O-N 3.26Å; E786-A789 PolarHBondContact O-N 2.9Å; E786-S790 VanDerWaalsContact O-CB 3.31Å; E786-S790 WeakPolarHBondContact O-CB 3.43Å; E786-S790 PolarHBondContact O-N 3.44Å; E786-S790 PolarHBondContact O-OG 2.96Å; E786-F814 HydrophobicContact CB-CE1 4.41Å; E786-F814 HydrophobicContact CB-CZ 3.87Å; E786-F814 HydrophobicContact CG-CZ 4.38Å
787	R	97.4	Very high	95.9	Very high	104 Å²	104	65.1 Å²	65.1	39%	0.392	32%	0.323	S	S	.	.	H	α-helix	trans	-59.6	-41.5	174.8	-79.1	179.9	145.3	-143.1	-12.7	112	D573 Y774 N783 C784 R791	D573-R787 VanDerWaalsContact CG-NH1 3.35Å; D573-R787 IonicContact OD1-CZ 3.79Å; D573-R787 VanDerWaalsContact OD1-CZ 3.3Å; D573-R787 IonicContact OD1-NH1 2.85Å; D573-R787 PolarHBondContact OD1-NH1 3.07Å; D573-R787 IonicContact OD1-NH2 3.79Å; D573-R787 PolarHBondContact OD1-NH2 3Å; D573-R787 IonicContact OD2-CZ 3.78Å; D573-R787 IonicContact OD2-NH1 2.7Å; D573-R787 PolarHBondContact OD2-NH1 3.22Å; D573-R787 IonicContact OD2-NH2 3.3Å; Y774-R787 HydrophobicContact CE1-CB 4.48Å; N783-R787 WeakPolarHBondContact O-CG 3.45Å; N783-R787 PolarHBondContact O-N 2.68Å; N783-R787 VanDerWaalsContact O-N 3.09Å; C784-R787 PolarHBondContact O-N 3.39Å; R787-R791 WeakPolarHBondContact O-CB 3.24Å; R787-R791 PolarHBondContact O-N 3.44Å; R787-R791 VanDerWaalsContact O-N 3.09Å
788	I	97.8	Very high	95.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.1	-48.4	176.1	-70.7	160.5	0	0	0	111	I508 I510 I745 V747 Y774 C784 F785 E786 S790 R791 F792 Y798	I508-I788 HydrophobicContact CG2-CG2 4.38Å; I510-I788 HydrophobicContact CD1-CD1 4.24Å; I510-I788 HydrophobicContact CD1-CG2 3.91Å; I510-I788 HydrophobicContact CG2-CD1 4.4Å; I745-I788 HydrophobicContact CD1-CG1 4.35Å; I745-I788 HydrophobicContact CD1-CG2 3.76Å; I745-I788 HydrophobicContact CG2-CD1 3.69Å; I745-I788 HydrophobicContact CG2-CG1 4.21Å; V747-I788 HydrophobicContact CG2-CD1 3.47Å; V747-I788 VanDerWaalsContact CG2-CD1 3.47Å; Y774-I788 HydrophobicContact CD2-CD1 4.03Å; Y774-I788 HydrophobicContact CD2-CG1 4.12Å; Y774-I788 HydrophobicContact CE1-CG1 4.4Å; Y774-I788 HydrophobicContact CE2-CD1 4.03Å; Y774-I788 HydrophobicContact CE2-CG1 3.64Å; C784-I788 WeakPolarHBondContact O-CD1 3.48Å; C784-I788 VanDerWaalsContact O-CG1 3.25Å; C784-I788 WeakPolarHBondContact O-CG1 3.26Å; C784-I788 PolarHBondContact O-N 2.81Å; F785-I788 PolarHBondContact O-N 3.37Å; E786-I788 VanDerWaalsContact C-N 3.33Å; E786-I788 PolarHBondContact O-N 3.26Å; I788-S790 VanDerWaalsContact C-N 3.25Å; I788-S790 PolarHBondContact O-N 3.36Å; I788-R791 PolarHBondContact O-N 2.95Å; I788-R791 VanDerWaalsContact O-N 3.11Å; I788-F792 HydrophobicContact CG2-CD2 4.19Å; I788-F792 PolarHBondContact O-N 2.9Å; I788-Y798 HydrophobicContact CG2-CD1 4.35Å; I788-Y798 HydrophobicContact CG2-CE1 3.9Å
789	A	96.5	Very high	96	Very high	24 Å²	24	58 Å²	58	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-37.7	177.2	0	0	0	0	0	112.3	F785 E786 G793 F814 W816	F785-A789 WeakPolarHBondContact O-CB 3.4Å; F785-A789 PolarHBondContact O-N 3.18Å; E786-A789 PolarHBondContact O-N 2.9Å; A789-G793 WeakPolarHBondContact O-CA 3.39Å; A789-G793 PolarHBondContact O-N 3.01Å; A789-F814 HydrophobicContact CB-CE1 4.45Å; A789-W816 HydrophobicContact CB-CH2 3.93Å; A789-W816 HydrophobicContact CB-CZ2 3.82Å
790	S	96	Very high	96.2	Very high	94 Å²	94	55.5 Å²	55.5	66%	0.657	27%	0.273	S	S	*	.	H	α-helix	trans	-69.9	-34.6	176.9	-61	0	0	0	0	112.7	E786 I788	E786-S790 VanDerWaalsContact O-CB 3.31Å; E786-S790 WeakPolarHBondContact O-CB 3.43Å; E786-S790 PolarHBondContact O-N 3.44Å; E786-S790 PolarHBondContact O-OG 2.96Å; I788-S790 VanDerWaalsContact C-N 3.25Å; I788-S790 PolarHBondContact O-N 3.36Å
791	R	95.9	Very high	96.3	Very high	95 Å²	95	54.5 Å²	54.5	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-77.1	-44.1	179.9	175.6	177.7	165.4	-159.4	-3.1	113.5	H570 E771 N772 Y774 R787 I788	H570-R791 PolarHBondContact NE2-NH1 2.79Å; E771-R791 PolarHBondContact O-NH1 2.93Å; N772-R791 PolarHBondContact OD1-NH1 3.05Å; N772-R791 PolarHBondContact OD1-NH2 3.16Å; Y774-R791 WeakPolarHBondContact OH-CD 3.36Å; Y774-R791 PolarHBondContact OH-NH1 3.43Å; R787-R791 WeakPolarHBondContact O-CB 3.24Å; R787-R791 PolarHBondContact O-N 3.44Å; R787-R791 VanDerWaalsContact O-N 3.09Å; I788-R791 PolarHBondContact O-N 2.95Å; I788-R791 VanDerWaalsContact O-N 3.11Å
792	F	94.7	Very high	96.3	Very high	41 Å²	41	54 Å²	54	18%	0.18	26%	0.261	C	S	.	.	H	α-helix	trans	-96.4	-20.6	-175.9	-70	-90	0	0	0	113.1	I508 V743 I745 I788 C796 Y798	I508-F792 HydrophobicContact CD1-CB 4.38Å; I508-F792 HydrophobicContact CD1-CD1 3.52Å; I508-F792 HydrophobicContact CD1-CE1 3.88Å; I508-F792 HydrophobicContact CD1-CG 3.96Å; I508-F792 HydrophobicContact CG1-CB 4.37Å; I508-F792 HydrophobicContact CG1-CD1 4.37Å; I508-F792 HydrophobicContact CG1-CG 4.35Å; V743-F792 HydrophobicContact CG1-CE1 4.38Å; V743-F792 HydrophobicContact CG1-CZ 4.37Å; I745-F792 HydrophobicContact CD1-CD2 3.98Å; I745-F792 HydrophobicContact CD1-CE2 3.37Å; I745-F792 HydrophobicContact CD1-CZ 3.84Å; I745-F792 HydrophobicContact CG1-CE2 4.49Å; I788-F792 HydrophobicContact CG2-CD2 4.19Å; I788-F792 PolarHBondContact O-N 2.9Å; F792-C796 PolarHBondContact O-SG 3.26Å; F792-Y798 HydrophobicContact CB-CE1 4.37Å; F792-Y798 WeakPolarHBondContact CB-OH 3.38Å
793	G	93.6	Very high	96.3	Very high	26 Å²	26	52.7 Å²	52.7	27%	0.268	26%	0.256	S	S	.	.			trans	77.9	179.1	172.5	0	0	0	0	0	115.1	A789 K795 Y798	A789-G793 WeakPolarHBondContact O-CA 3.39Å; A789-G793 PolarHBondContact O-N 3.01Å; G793-K795 VanDerWaalsContact C-N 3.35Å; G793-K795 PolarHBondContact O-N 2.91Å; G793-Y798 PolarHBondContact N-OH 3.37Å; G793-Y798 PolarHBondContact O-OH 3.25Å
794	R	90.3	Very high	96.2	Very high	256 Å²	256	49.9 Å²	49.9	97%	0.966	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	1	-170.6	-58.7	179.5	-174.3	160.2	1.5	115	C796	R794-C796 VanDerWaalsContact C-N 3.3Å
795	K	90.4	Very high	96.1	Very high	125 Å²	125	56.8 Å²	56.8	54%	0.543	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.9	172.2	-77.9	-167.8	173.5	-170.6	0	113.1	D502 F505 G793	D502-K795 PolarHBondContact O-NZ 3.4Å; D502-K795 IonicContact OD1-NZ 3Å; D502-K795 PolarHBondContact OD1-NZ 3.41Å; F505-K795 WeakPolarHBondContact CD1-O 3.37Å; G793-K795 VanDerWaalsContact C-N 3.35Å; G793-K795 PolarHBondContact O-N 2.91Å
796	C	93.8	Very high	96.1	Very high	22 Å²	22	60.4 Å²	60.4	15%	0.149	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	148.8	-175.8	-61.3	0	0	0	0	112.4	T506 I508 F792 R794 Y798	T506-C796 CarbonylContact O-C 3.55Å; T506-C796 VanDerWaalsContact O-CA 3.24Å; T506-C796 WeakPolarHBondContact O-CA 3.31Å; T506-C796 WeakPolarHBondContact O-CB 3.42Å; I508-C796 HydrophobicContact CG1-CB 3.9Å; F792-C796 PolarHBondContact O-SG 3.26Å; R794-C796 VanDerWaalsContact C-N 3.3Å; C796-Y798 HydrophobicContact CB-CE2 3.87Å; C796-Y798 WeakPolarHBondContact O-CE2 3.5Å
797	T	94.8	Very high	96.1	Very high	61 Å²	61	55.4 Å²	55.4	37%	0.374	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.8	169.8	-60.6	0	0	0	0	108.9	T506 R507 I508	T506-T797 PolarHBondContact O-N 3.17Å; R507-T797 CarbonylContact C-O 3.41Å; R507-T797 VanDerWaalsContact CA-O 3.29Å; R507-T797 WeakPolarHBondContact CA-O 3.46Å; R507-T797 HydrophobicContact CG-CG2 4.44Å; R507-T797 WeakPolarHBondContact CG-O 3.49Å; I508-T797 PolarHBondContact N-O 3.41Å
798	Y	97.8	Very high	96.1	Very high	11 Å²	11	52.2 Å²	52.2	4%	0.043	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	145.1	177.6	-59.4	-90.6	0	0	0	110.3	I508 I510 I788 F792 G793 C796 W816 P817	I508-Y798 HydrophobicContact CB-CD1 3.61Å; I508-Y798 HydrophobicContact CB-CE1 3.87Å; I508-Y798 HydrophobicContact CB-CG 4.41Å; I508-Y798 HydrophobicContact CG1-CD1 4.05Å; I508-Y798 HydrophobicContact CG1-CE1 3.82Å; I508-Y798 HydrophobicContact CG2-CD1 3.82Å; I508-Y798 HydrophobicContact CG2-CE1 4Å; I508-Y798 CarbonylContact O-C 3.31Å; I508-Y798 WeakPolarHBondContact O-CA 3.31Å; I510-Y798 HydrophobicContact CD1-CD1 4.1Å; I788-Y798 HydrophobicContact CG2-CD1 4.35Å; I788-Y798 HydrophobicContact CG2-CE1 3.9Å; F792-Y798 HydrophobicContact CB-CE1 4.37Å; F792-Y798 WeakPolarHBondContact CB-OH 3.38Å; G793-Y798 PolarHBondContact N-OH 3.37Å; G793-Y798 PolarHBondContact O-OH 3.25Å; C796-Y798 HydrophobicContact CB-CE2 3.87Å; C796-Y798 WeakPolarHBondContact O-CE2 3.5Å; Y798-W816 VanDerWaalsContact CB-CD2 3.43Å; Y798-W816 HydrophobicContact CD1-CE3 4.49Å; Y798-W816 AromaticContact CD1-CH2 3.82Å; Y798-W816 HydrophobicContact CD1-CH2 3.82Å; Y798-W816 AromaticContact CD1-CZ2 3.85Å; Y798-W816 HydrophobicContact CD1-CZ2 3.85Å; Y798-W816 HydrophobicContact CD1-CZ3 4.16Å; Y798-W816 HydrophobicContact CD2-CD2 4.24Å; Y798-W816 AromaticContact CD2-CE2 3.51Å; Y798-W816 HydrophobicContact CD2-CH2 4.41Å; Y798-W816 AromaticContact CD2-CZ2 3.61Å; Y798-W816 HydrophobicContact CD2-CZ2 3.61Å; Y798-W816 AromaticContact CD2-NE1 3.57Å; Y798-W816 HydrophobicContact CE1-CH2 4.15Å; Y798-W816 HydrophobicContact CE1-CZ2 4.14Å; Y798-W816 AromaticContact CE2-CZ2 3.93Å; Y798-W816 HydrophobicContact CE2-CZ2 3.93Å; Y798-W816 AromaticContact CG-CD2 3.83Å; Y798-W816 HydrophobicContact CG-CD2 3.83Å; Y798-W816 AromaticContact CG-CE2 3.5Å; Y798-W816 VanDerWaalsContact CG-CE2 3.5Å; Y798-W816 HydrophobicContact CG-CE3 4.19Å; Y798-W816 HydrophobicContact CG-CG 4.42Å; Y798-W816 AromaticContact CG-CH2 3.97Å; Y798-W816 HydrophobicContact CG-CH2 3.97Å; Y798-W816 AromaticContact CG-CZ2 3.58Å; Y798-W816 HydrophobicContact CG-CZ2 3.58Å; Y798-W816 HydrophobicContact CG-CZ3 4.26Å; Y798-W816 AromaticContact CG-NE1 3.95Å; Y798-P817 VanDerWaalsContact O-CD 3.24Å; Y798-P817 WeakPolarHBondContact O-CD 3.4Å; Y798-P817 VanDerWaalsContact O-CG 3.25Å; Y798-P817 WeakPolarHBondContact O-CG 3.4Å
799	V	97.9	Very high	96.2	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	122	171.5	-176	0	0	0	0	107	R507 I508 F509 I510 I801 P817 L839	R507-V799 HydrophobicContact CG-CG2 4.22Å; I508-V799 PolarHBondContact O-N 2.82Å; F509-V799 WeakPolarHBondContact CA-O 3.34Å; F509-V799 HydrophobicContact CD1-CB 3.99Å; F509-V799 HydrophobicContact CD1-CG1 4.29Å; F509-V799 HydrophobicContact CD1-CG2 4.49Å; F509-V799 HydrophobicContact CE1-CB 4.28Å; F509-V799 HydrophobicContact CE1-CG1 4.45Å; F509-V799 HydrophobicContact CE1-CG2 4.36Å; I510-V799 PolarHBondContact N-O 2.83Å; V799-I801 HydrophobicContact CG1-CG1 4.34Å; V799-P817 HydrophobicContact CG2-CG 4.28Å; V799-L839 HydrophobicContact CG1-CD2 4.4Å; V799-L839 HydrophobicContact CG2-CD2 4.32Å
800	V	98.7	Very high	96.2	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.7	180	-176.6	0	0	0	0	109.1	I510 F785 E807 A811 W816 P817 F818 W819	I510-V800 HydrophobicContact CB-CG2 4.37Å; I510-V800 HydrophobicContact CD1-CG2 4.39Å; I510-V800 CarbonylContact O-C 3.59Å; I510-V800 WeakPolarHBondContact O-CA 3.31Å; F785-V800 HydrophobicContact CD2-CG2 4.5Å; F785-V800 HydrophobicContact CE2-CG1 3.91Å; F785-V800 HydrophobicContact CE2-CG2 3.79Å; F785-V800 HydrophobicContact CZ-CG1 3.62Å; F785-V800 HydrophobicContact CZ-CG2 4.1Å; V800-E807 HydrophobicContact CG1-CB 4.06Å; V800-A811 HydrophobicContact CB-CB 3.92Å; V800-A811 HydrophobicContact CG1-CB 4.26Å; V800-A811 HydrophobicContact CG2-CB 3.83Å; V800-W816 HydrophobicContact CG2-CB 4.35Å; V800-W816 HydrophobicContact CG2-CE3 3.86Å; V800-P817 PolarHBondContact N-O 3.4Å; V800-F818 HydrophobicContact CB-CD2 3.94Å; V800-F818 HydrophobicContact CG1-CD2 3.75Å; V800-F818 HydrophobicContact CG1-CE2 4Å; V800-F818 CarbonylContact O-C 3.57Å; V800-F818 WeakPolarHBondContact O-CA 3.42Å; V800-W819 PolarHBondContact O-N 2.85Å
801	I	98.8	Very high	96.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.6	-175.6	-50.1	175.9	0	0	0	108.8	F509 I510 W511 D512 T516 V799 W819 I821 L830	F509-I801 HydrophobicContact CD1-CD1 3.99Å; I510-I801 PolarHBondContact O-N 3.46Å; W511-I801 WeakPolarHBondContact CA-O 3.02Å; W511-I801 HydrophobicContact CD2-CB 4.25Å; W511-I801 HydrophobicContact CD2-CD1 3.98Å; W511-I801 HydrophobicContact CE3-CB 3.88Å; W511-I801 HydrophobicContact CE3-CD1 4.06Å; W511-I801 HydrophobicContact CE3-CG2 3.7Å; W511-I801 HydrophobicContact CH2-CD1 3.91Å; W511-I801 HydrophobicContact CZ2-CD1 3.79Å; W511-I801 HydrophobicContact CZ3-CB 4.29Å; W511-I801 HydrophobicContact CZ3-CD1 4.03Å; W511-I801 HydrophobicContact CZ3-CG2 3.7Å; D512-I801 PolarHBondContact N-O 2.85Å; T516-I801 HydrophobicContact CG2-CG2 4.41Å; V799-I801 HydrophobicContact CG1-CG1 4.34Å; I801-W819 WeakPolarHBondContact CA-O 3.33Å; I801-W819 HydrophobicContact CG1-CB 4.28Å; I801-I821 HydrophobicContact CG2-CD1 4.26Å; I801-I821 HydrophobicContact CG2-CG1 3.67Å; I801-L830 HydrophobicContact CD1-CD1 4.22Å; I801-L830 HydrophobicContact CD1-CD2 4Å; I801-L830 HydrophobicContact CG2-CD2 4.14Å
802	G	98.6	Very high	96.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	166.7	179.1	0	0	0	0	0	113	T516 F818 W819 R820 I821	T516-G802 VanDerWaalsContact OG1-CA 3.28Å; T516-G802 WeakPolarHBondContact OG1-CA 3.47Å; G802-F818 VanDerWaalsContact O-CZ 3.27Å; G802-F818 WeakPolarHBondContact O-CZ 3.45Å; G802-W819 PolarHBondContact N-O 2.81Å; G802-R820 CarbonylContact O-C 3.56Å; G802-R820 VanDerWaalsContact O-CA 3.24Å; G802-R820 WeakPolarHBondContact O-CA 3.27Å; G802-I821 PolarHBondContact O-N 2.82Å
803	D	98	Very high	96.5	Very high	54 Å²	54	54.3 Å²	54.3	29%	0.289	26%	0.26	S	S	.	.	S	Bend	trans	-85.3	-39.6	168.8	67.1	-64	0	0	0	110.9	T516 R820 I821	T516-D803 PolarHBondContact OG1-N 2.89Å; T516-D803 PolarHBondContact OG1-OD1 3.36Å; D803-R820 PolarHBondContact O-NH1 3.01Å; D803-I821 VanDerWaalsContact CA-O 3.26Å; D803-I821 WeakPolarHBondContact CA-O 3.29Å; D803-I821 WeakPolarHBondContact CB-O 3.43Å
804	G	95.8	Very high	96.7	Very high	18 Å²	18	55.9 Å²	55.9	19%	0.186	26%	0.259	C	S	.	.	S	Bend	trans	-69.3	171.3	-167	0	0	0	0	0	116	E807 R820	G804-E807 VanDerWaalsContact CA-CD 3.46Å; G804-E807 VanDerWaalsContact CA-OE2 3.3Å; G804-E807 WeakPolarHBondContact CA-OE2 3.32Å; G804-E807 PolarHBondContact N-OE1 2.94Å; G804-R820 PolarHBondContact O-NH1 3.02Å
805	K	96.6	Very high	97	Very high	144 Å²	144	50.6 Å²	50.6	63%	0.626	25%	0.25	S	S	*	.	S	Bend	trans	-89	-28.4	179.1	-178.6	176.6	171.4	-176.4	0	113	E808 D809	K805-E808 PolarHBondContact O-N 3.15Å; K805-D809 WeakPolarHBondContact CE-OD2 3.39Å; K805-D809 WeakPolarHBondContact CG-OD2 3.23Å; K805-D809 WeakPolarHBondContact O-CB 2.95Å; K805-D809 PolarHBondContact O-N 3.26Å
806	E	97.1	Very high	97.3	Very high	79 Å²	79	46.3 Å²	46.3	37%	0.369	23%	0.231	S	C	.	.	H	α-helix	trans	-66.6	-46	-174.6	-169.8	-168.5	171.3	0	0	111.3	T749 G780 K781 E808 A810	T749-E806 WeakPolarHBondContact CG2-OE2 3.25Å; G780-E806 VanDerWaalsContact CA-OE1 3.25Å; G780-E806 WeakPolarHBondContact CA-OE1 3.36Å; K781-E806 HydrophobicContact CB-CG 4.13Å; K781-E806 HydrophobicContact CD-CB 4.09Å; K781-E806 HydrophobicContact CD-CG 4.13Å; K781-E806 VanDerWaalsContact CE-OE2 3.23Å; K781-E806 WeakPolarHBondContact CE-OE2 3.27Å; K781-E806 HydrophobicContact CG-CG 4.1Å; K781-E806 PolarHBondContact N-OE1 2.77Å; E806-E808 VanDerWaalsContact C-N 3.33Å; E806-A810 VanDerWaalsContact O-CB 3.23Å; E806-A810 WeakPolarHBondContact O-CB 3.31Å; E806-A810 PolarHBondContact O-N 3.24Å
807	E	97.5	Very high	97.5	Very high	5 Å²	5	49 Å²	49	2%	0.023	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-32.2	174.4	55.2	-91.4	-108.3	0	0	112.7	K781 F785 V800 G804 A811 F818	K781-E807 HydrophobicContact CD-CB 3.82Å; K781-E807 IonicContact NZ-OE1 3.73Å; K781-E807 PolarHBondContact NZ-OE1 2.91Å; K781-E807 IonicContact NZ-OE2 2.81Å; K781-E807 PolarHBondContact NZ-OE2 3.23Å; F785-E807 HydrophobicContact CZ-CB 4.14Å; V800-E807 HydrophobicContact CG1-CB 4.06Å; G804-E807 VanDerWaalsContact CA-CD 3.46Å; G804-E807 VanDerWaalsContact CA-OE2 3.3Å; G804-E807 WeakPolarHBondContact CA-OE2 3.32Å; G804-E807 PolarHBondContact N-OE1 2.94Å; E807-A811 WeakPolarHBondContact O-CB 3.31Å; E807-A811 PolarHBondContact O-N 3.33Å; E807-F818 HydrophobicContact CB-CE2 4.18Å; E807-F818 HydrophobicContact CG-CE2 3.56Å; E807-F818 HydrophobicContact CG-CZ 3.96Å
808	E	98.3	Very high	97.7	Very high	37 Å²	37	48.6 Å²	48.6	17%	0.173	24%	0.241	C	C	.	.	H	α-helix	trans	-71.5	-48.1	177.4	-172	-156.4	175.1	0	0	110.9	K805 E806 A811 K812 F818 R820	K805-E808 PolarHBondContact O-N 3.15Å; E806-E808 VanDerWaalsContact C-N 3.33Å; E808-A811 PolarHBondContact O-N 3.12Å; E808-K812 WeakPolarHBondContact O-CG 3.44Å; E808-K812 PolarHBondContact O-N 3.3Å; E808-K812 WeakPolarHBondContact OE1-CE 3.31Å; E808-K812 IonicContact OE1-NZ 2.87Å; E808-K812 PolarHBondContact OE1-NZ 2.88Å; E808-K812 IonicContact OE2-NZ 2.66Å; E808-K812 PolarHBondContact OE2-NZ 3.34Å; E808-F818 HydrophobicContact CB-CD1 4.05Å; E808-F818 HydrophobicContact CB-CD2 4.23Å; E808-F818 HydrophobicContact CB-CE1 3.79Å; E808-F818 HydrophobicContact CB-CE2 4.03Å; E808-F818 HydrophobicContact CB-CG 4.24Å; E808-F818 HydrophobicContact CB-CZ 3.79Å; E808-F818 HydrophobicContact CG-CD1 3.63Å; E808-F818 HydrophobicContact CG-CD2 4.48Å; E808-F818 HydrophobicContact CG-CE1 3.75Å; E808-F818 HydrophobicContact CG-CG 4Å; E808-F818 HydrophobicContact CG-CZ 4.28Å; E808-R820 IonicContact OE1-NH2 2.69Å; E808-R820 PolarHBondContact OE1-NH2 3.08Å; E808-R820 IonicContact OE2-CZ 2.67Å; E808-R820 IonicContact OE2-NH1 3.23Å; E808-R820 IonicContact OE2-NH2 2.88Å; E808-R820 PolarHBondContact OE2-NH2 3.39Å
809	D	98	Very high	97.7	Very high	63 Å²	63	51.3 Å²	51.3	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-69.4	-36.6	179.9	-73.1	-15.1	0	0	0	111.1	K805 K812 Q813	K805-D809 WeakPolarHBondContact CE-OD2 3.39Å; K805-D809 WeakPolarHBondContact CG-OD2 3.23Å; K805-D809 WeakPolarHBondContact O-CB 2.95Å; K805-D809 PolarHBondContact O-N 3.26Å; D809-K812 PolarHBondContact O-N 2.92Å; D809-K812 IonicContact OD1-NZ 2.74Å; D809-K812 PolarHBondContact OD1-NZ 3.18Å; D809-Q813 PolarHBondContact O-N 2.94Å
810	A	98	Very high	97.7	Very high	5 Å²	5	55.2 Å²	55.2	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-44.6	167.5	0	0	0	0	0	112.1	E782 F785 E806 K812 Q813 F814	E782-A810 HydrophobicContact CB-CB 4.27Å; F785-A810 HydrophobicContact CD2-CB 3.65Å; F785-A810 HydrophobicContact CE2-CB 3.6Å; F785-A810 HydrophobicContact CZ-CB 4.42Å; E806-A810 VanDerWaalsContact O-CB 3.23Å; E806-A810 WeakPolarHBondContact O-CB 3.31Å; E806-A810 PolarHBondContact O-N 3.24Å; A810-K812 VanDerWaalsContact C-N 3.34Å; A810-K812 PolarHBondContact O-N 3.14Å; A810-Q813 PolarHBondContact O-N 2.86Å; A810-F814 WeakPolarHBondContact O-CD2 3.42Å; A810-F814 PolarHBondContact O-N 2.92Å
811	A	98.3	Very high	97.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-41.7	176.8	0	0	0	0	0	112.2	V800 E807 E808 Q813 F814 N815 W816 F818	V800-A811 HydrophobicContact CB-CB 3.92Å; V800-A811 HydrophobicContact CG1-CB 4.26Å; V800-A811 HydrophobicContact CG2-CB 3.83Å; E807-A811 WeakPolarHBondContact O-CB 3.31Å; E807-A811 PolarHBondContact O-N 3.33Å; E808-A811 PolarHBondContact O-N 3.12Å; A811-Q813 PolarHBondContact O-N 3.19Å; A811-F814 PolarHBondContact O-N 2.84Å; A811-N815 PolarHBondContact O-N 3.49Å; A811-N815 VanDerWaalsContact O-N 3.09Å; A811-W816 PolarHBondContact O-N 3.38Å; A811-F818 HydrophobicContact CB-CB 4.05Å; A811-F818 HydrophobicContact CB-CD2 4.15Å
812	K	97.7	Very high	97.6	Very high	111 Å²	111	58.9 Å²	58.9	48%	0.483	29%	0.285	S	S	.	.	H	α-helix	trans	-58.2	-45.9	173.2	-70.3	166.4	-166.7	151.7	0	111.5	E808 D809 A810 F814 N815	E808-K812 WeakPolarHBondContact O-CG 3.44Å; E808-K812 PolarHBondContact O-N 3.3Å; E808-K812 WeakPolarHBondContact OE1-CE 3.31Å; E808-K812 IonicContact OE1-NZ 2.87Å; E808-K812 PolarHBondContact OE1-NZ 2.88Å; E808-K812 IonicContact OE2-NZ 2.66Å; E808-K812 PolarHBondContact OE2-NZ 3.34Å; D809-K812 PolarHBondContact O-N 2.92Å; D809-K812 IonicContact OD1-NZ 2.74Å; D809-K812 PolarHBondContact OD1-NZ 3.18Å; A810-K812 VanDerWaalsContact C-N 3.34Å; A810-K812 PolarHBondContact O-N 3.14Å; K812-F814 PolarHBondContact O-N 3.3Å; K812-N815 WeakPolarHBondContact O-CA 3.36Å; K812-N815 PolarHBondContact O-N 3.19Å
813	Q	96.8	Very high	97.6	Very high	119 Å²	119	59.7 Å²	59.7	56%	0.556	29%	0.292	S	S	*	.	H	α-helix	trans	-64.4	-38.7	-178.2	-176.5	176.3	-16.7	0	0	113.1	E782 D809 A810 A811 N815	E782-Q813 PolarHBondContact OE1-NE2 2.95Å; E782-Q813 PolarHBondContact OE1-OE1 3.29Å; D809-Q813 PolarHBondContact O-N 2.94Å; A810-Q813 PolarHBondContact O-N 2.86Å; A811-Q813 PolarHBondContact O-N 3.19Å; Q813-N815 PolarHBondContact O-N 3.44Å
814	F	96.7	Very high	97.6	Very high	58 Å²	58	58.4 Å²	58.4	25%	0.254	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.5	172.6	-77.1	-89.6	0	0	0	113.8	E782 F785 E786 A789 A810 A811 K812 W816	E782-F814 HydrophobicContact CG-CE2 4.09Å; F785-F814 HydrophobicContact CB-CD2 4.05Å; F785-F814 HydrophobicContact CB-CE2 3.84Å; F785-F814 HydrophobicContact CB-CZ 4.31Å; F785-F814 HydrophobicContact CD2-CD2 4.39Å; E786-F814 HydrophobicContact CB-CE1 4.41Å; E786-F814 HydrophobicContact CB-CZ 3.87Å; E786-F814 HydrophobicContact CG-CZ 4.38Å; A789-F814 HydrophobicContact CB-CE1 4.45Å; A810-F814 WeakPolarHBondContact O-CD2 3.42Å; A810-F814 PolarHBondContact O-N 2.92Å; A811-F814 PolarHBondContact O-N 2.84Å; K812-F814 PolarHBondContact O-N 3.3Å; F814-W816 VanDerWaalsContact C-N 3.31Å; F814-W816 HydrophobicContact CB-CD2 3.65Å; F814-W816 HydrophobicContact CB-CE3 4.07Å; F814-W816 HydrophobicContact CB-CG 3.92Å; F814-W816 HydrophobicContact CB-CZ2 4.19Å; F814-W816 HydrophobicContact CD1-CH2 4.28Å; F814-W816 AromaticContact CD1-CZ2 3.99Å; F814-W816 HydrophobicContact CD1-CZ2 3.99Å; F814-W816 HydrophobicContact CG-CD2 4.45Å; F814-W816 HydrophobicContact CG-CH2 4.4Å; F814-W816 HydrophobicContact CG-CZ2 4.28Å; F814-W816 PolarHBondContact O-N 3.43Å; F814-W816 PolarHBondContact O-NE1 3Å
815	N	97.3	Very high	97.7	Very high	146 Å²	146	60.9 Å²	60.9	78%	0.781	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	48	-172	-168.4	91.9	0	0	0	111.9	A811 K812 Q813	A811-N815 PolarHBondContact O-N 3.49Å; A811-N815 VanDerWaalsContact O-N 3.09Å; K812-N815 WeakPolarHBondContact O-CA 3.36Å; K812-N815 PolarHBondContact O-N 3.19Å; Q813-N815 PolarHBondContact O-N 3.44Å
816	W	97.6	Very high	97.8	Very high	35 Å²	35	55.9 Å²	55.9	13%	0.133	28%	0.279	C	S	.	.			trans	-104.8	141	175.6	-65.2	-10.7	0	0	0	110.4	I510 F785 A789 Y798 V800 A811 F814 F818	I510-W816 HydrophobicContact CD1-CE3 3.99Å; I510-W816 HydrophobicContact CD1-CH2 4.21Å; I510-W816 HydrophobicContact CD1-CZ3 3.43Å; I510-W816 VanDerWaalsContact CD1-CZ3 3.43Å; F785-W816 HydrophobicContact CB-CH2 4.18Å; F785-W816 HydrophobicContact CB-CZ3 3.76Å; F785-W816 HydrophobicContact CD2-CE3 4.07Å; F785-W816 AromaticContact CD2-CZ3 3.85Å; F785-W816 HydrophobicContact CD2-CZ3 3.85Å; F785-W816 AromaticContact CG-CZ3 3.86Å; F785-W816 HydrophobicContact CG-CZ3 3.86Å; A789-W816 HydrophobicContact CB-CH2 3.93Å; A789-W816 HydrophobicContact CB-CZ2 3.82Å; Y798-W816 VanDerWaalsContact CB-CD2 3.43Å; Y798-W816 HydrophobicContact CD1-CE3 4.49Å; Y798-W816 AromaticContact CD1-CH2 3.82Å; Y798-W816 HydrophobicContact CD1-CH2 3.82Å; Y798-W816 AromaticContact CD1-CZ2 3.85Å; Y798-W816 HydrophobicContact CD1-CZ2 3.85Å; Y798-W816 HydrophobicContact CD1-CZ3 4.16Å; Y798-W816 HydrophobicContact CD2-CD2 4.24Å; Y798-W816 AromaticContact CD2-CE2 3.51Å; Y798-W816 HydrophobicContact CD2-CH2 4.41Å; Y798-W816 AromaticContact CD2-CZ2 3.61Å; Y798-W816 HydrophobicContact CD2-CZ2 3.61Å; Y798-W816 AromaticContact CD2-NE1 3.57Å; Y798-W816 HydrophobicContact CE1-CH2 4.15Å; Y798-W816 HydrophobicContact CE1-CZ2 4.14Å; Y798-W816 AromaticContact CE2-CZ2 3.93Å; Y798-W816 HydrophobicContact CE2-CZ2 3.93Å; Y798-W816 AromaticContact CG-CD2 3.83Å; Y798-W816 HydrophobicContact CG-CD2 3.83Å; Y798-W816 AromaticContact CG-CE2 3.5Å; Y798-W816 VanDerWaalsContact CG-CE2 3.5Å; Y798-W816 HydrophobicContact CG-CE3 4.19Å; Y798-W816 HydrophobicContact CG-CG 4.42Å; Y798-W816 AromaticContact CG-CH2 3.97Å; Y798-W816 HydrophobicContact CG-CH2 3.97Å; Y798-W816 AromaticContact CG-CZ2 3.58Å; Y798-W816 HydrophobicContact CG-CZ2 3.58Å; Y798-W816 HydrophobicContact CG-CZ3 4.26Å; Y798-W816 AromaticContact CG-NE1 3.95Å; V800-W816 HydrophobicContact CG2-CB 4.35Å; V800-W816 HydrophobicContact CG2-CE3 3.86Å; A811-W816 PolarHBondContact O-N 3.38Å; F814-W816 VanDerWaalsContact C-N 3.31Å; F814-W816 HydrophobicContact CB-CD2 3.65Å; F814-W816 HydrophobicContact CB-CE3 4.07Å; F814-W816 HydrophobicContact CB-CG 3.92Å; F814-W816 HydrophobicContact CB-CZ2 4.19Å; F814-W816 HydrophobicContact CD1-CH2 4.28Å; F814-W816 AromaticContact CD1-CZ2 3.99Å; F814-W816 HydrophobicContact CD1-CZ2 3.99Å; F814-W816 HydrophobicContact CG-CD2 4.45Å; F814-W816 HydrophobicContact CG-CH2 4.4Å; F814-W816 HydrophobicContact CG-CZ2 4.28Å; F814-W816 PolarHBondContact O-N 3.43Å; F814-W816 PolarHBondContact O-NE1 3Å; W816-F818 PolarHBondContact O-N 3.37Å
817	P	97.7	Very high	97.8	Very high	79 Å²	79	52.1 Å²	52.1	51%	0.513	26%	0.261	S	S	.	.			trans	-63.5	129.6	174.7	26.5	-34.5	0	0	0	110.9	Y798 V799 V800	Y798-P817 VanDerWaalsContact O-CD 3.24Å; Y798-P817 WeakPolarHBondContact O-CD 3.4Å; Y798-P817 VanDerWaalsContact O-CG 3.25Å; Y798-P817 WeakPolarHBondContact O-CG 3.4Å; V799-P817 HydrophobicContact CG2-CG 4.28Å; V800-P817 PolarHBondContact N-O 3.4Å
818	F	98.3	Very high	97.8	Very high	52 Å²	52	56.1 Å²	56.1	23%	0.228	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.4	176.1	-176.5	-104.2	0	0	0	110.7	V800 G802 E807 E808 A811 W816 R820	V800-F818 HydrophobicContact CB-CD2 3.94Å; V800-F818 HydrophobicContact CG1-CD2 3.75Å; V800-F818 HydrophobicContact CG1-CE2 4Å; V800-F818 CarbonylContact O-C 3.57Å; V800-F818 WeakPolarHBondContact O-CA 3.42Å; G802-F818 VanDerWaalsContact O-CZ 3.27Å; G802-F818 WeakPolarHBondContact O-CZ 3.45Å; E807-F818 HydrophobicContact CB-CE2 4.18Å; E807-F818 HydrophobicContact CG-CE2 3.56Å; E807-F818 HydrophobicContact CG-CZ 3.96Å; E808-F818 HydrophobicContact CB-CD1 4.05Å; E808-F818 HydrophobicContact CB-CD2 4.23Å; E808-F818 HydrophobicContact CB-CE1 3.79Å; E808-F818 HydrophobicContact CB-CE2 4.03Å; E808-F818 HydrophobicContact CB-CG 4.24Å; E808-F818 HydrophobicContact CB-CZ 3.79Å; E808-F818 HydrophobicContact CG-CD1 3.63Å; E808-F818 HydrophobicContact CG-CD2 4.48Å; E808-F818 HydrophobicContact CG-CE1 3.75Å; E808-F818 HydrophobicContact CG-CG 4Å; E808-F818 HydrophobicContact CG-CZ 4.28Å; A811-F818 HydrophobicContact CB-CB 4.05Å; A811-F818 HydrophobicContact CB-CD2 4.15Å; W816-F818 PolarHBondContact O-N 3.37Å; F818-R820 HydrophobicContact CD1-CB 4.27Å; F818-R820 HydrophobicContact CE1-CB 3.64Å; F818-R820 HydrophobicContact CE1-CG 3.9Å; F818-R820 HydrophobicContact CZ-CB 4.49Å; F818-R820 HydrophobicContact CZ-CG 4.46Å
819	W	98.4	Very high	97.8	Very high	68 Å²	68	56.5 Å²	56.5	26%	0.258	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	105.5	172.9	-170	-69.1	0	0	0	109	V800 I801 G802 D826 A829 L830 A833 L839	V800-W819 PolarHBondContact O-N 2.85Å; I801-W819 WeakPolarHBondContact CA-O 3.33Å; I801-W819 HydrophobicContact CG1-CB 4.28Å; G802-W819 PolarHBondContact N-O 2.81Å; W819-D826 PolarHBondContact NE1-O 3.3Å; W819-A829 HydrophobicContact CH2-CB 4.49Å; W819-A829 HydrophobicContact CZ2-CB 3.82Å; W819-L830 HydrophobicContact CD2-CD1 4.24Å; W819-L830 HydrophobicContact CG-CD1 4.46Å; W819-L830 HydrophobicContact CZ2-CB 4.02Å; W819-L830 VanDerWaalsContact CZ2-N 3.31Å; W819-A833 HydrophobicContact CH2-CB 3.94Å; W819-A833 HydrophobicContact CZ3-CB 4.22Å; W819-L839 HydrophobicContact CD2-CD1 4.46Å; W819-L839 HydrophobicContact CE3-CD1 3.73Å; W819-L839 HydrophobicContact CZ3-CD1 3.79Å
820	R	98.4	Very high	97.8	Very high	84 Å²	84	53.5 Å²	53.5	32%	0.317	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.5	179	-159.8	-177.4	-62.3	-82.4	6.6	111.1	G802 D803 G804 E808 F818 N822	G802-R820 CarbonylContact O-C 3.56Å; G802-R820 VanDerWaalsContact O-CA 3.24Å; G802-R820 WeakPolarHBondContact O-CA 3.27Å; D803-R820 PolarHBondContact O-NH1 3.01Å; G804-R820 PolarHBondContact O-NH1 3.02Å; E808-R820 IonicContact OE1-NH2 2.69Å; E808-R820 PolarHBondContact OE1-NH2 3.08Å; E808-R820 IonicContact OE2-CZ 2.67Å; E808-R820 IonicContact OE2-NH1 3.23Å; E808-R820 IonicContact OE2-NH2 2.88Å; E808-R820 PolarHBondContact OE2-NH2 3.39Å; F818-R820 HydrophobicContact CD1-CB 4.27Å; F818-R820 HydrophobicContact CE1-CB 3.64Å; F818-R820 HydrophobicContact CE1-CG 3.9Å; F818-R820 HydrophobicContact CZ-CB 4.49Å; F818-R820 HydrophobicContact CZ-CG 4.46Å; R820-N822 VanDerWaalsContact CD-CG 3.45Å; R820-N822 WeakPolarHBondContact CD-ND2 3.48Å; R820-N822 WeakPolarHBondContact CD-OD1 3.28Å
821	I	98.4	Very high	97.8	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.276	C	S	.	.			trans	-110.9	102.3	166.6	-59.2	-59.9	0	0	0	108.6	T516 W725 I801 G802 D803 D826 L827 L830	T516-I821 HydrophobicContact CG2-CG1 4.42Å; W725-I821 HydrophobicContact CH2-CG2 3.85Å; W725-I821 HydrophobicContact CZ2-CG2 3.52Å; I801-I821 HydrophobicContact CG2-CD1 4.26Å; I801-I821 HydrophobicContact CG2-CG1 3.67Å; G802-I821 PolarHBondContact O-N 2.82Å; D803-I821 VanDerWaalsContact CA-O 3.26Å; D803-I821 WeakPolarHBondContact CA-O 3.29Å; D803-I821 WeakPolarHBondContact CB-O 3.43Å; I821-D826 HydrophobicContact CD1-CB 3.93Å; I821-L827 HydrophobicContact CD1-CD2 3.88Å; I821-L827 HydrophobicContact CD1-CG 4.15Å; I821-L827 HydrophobicContact CG1-CD2 4.27Å; I821-L827 HydrophobicContact CG2-CD1 4.47Å; I821-L827 HydrophobicContact CG2-CD2 4.19Å; I821-L827 HydrophobicContact CG2-CG 3.89Å; I821-L830 HydrophobicContact CD1-CD2 4.2Å
822	N	96.4	Very high	97.8	Very high	79 Å²	79	59 Å²	59	42%	0.422	30%	0.301	S	S	.	.	S	Bend	trans	-105.2	-25.7	173.4	-83.8	-7.5	0	0	0	112.3	R531 R820 D826	R531-N822 PolarHBondContact NH1-O 3.43Å; R531-N822 PolarHBondContact NH2-O 3.41Å; R820-N822 VanDerWaalsContact CD-CG 3.45Å; R820-N822 WeakPolarHBondContact CD-ND2 3.48Å; R820-N822 WeakPolarHBondContact CD-OD1 3.28Å; N822-D826 WeakPolarHBondContact CA-OD2 3.31Å; N822-D826 WeakPolarHBondContact CB-OD2 2.96Å; N822-D826 PolarHBondContact N-OD2 3.46Å
823	A	97.5	Very high	97.8	Very high	17 Å²	17	54 Å²	54	14%	0.14	28%	0.281	C	S	.	.	S	Bend	trans	-155.6	172.3	-177.4	0	0	0	0	0	112.6	Y532 S825 D826	Y532-A823 WeakPolarHBondContact OH-CB 3.36Å; A823-S825 PolarHBondContact O-N 3.42Å; A823-S825 VanDerWaalsContact O-N 3.09Å; A823-D826 PolarHBondContact N-OD2 3.43Å; A823-D826 WeakPolarHBondContact O-CB 3.37Å; A823-D826 PolarHBondContact O-N 2.97Å
824	H	98.2	Very high	97.8	Very high	26 Å²	26	48.8 Å²	48.8	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-53.3	-28.4	175	-50.4	72.8	0	0	0	113.7	Y528 Y532 T722 W725 M728 D826 N828	Y528-H824 PolarHBondContact OH-CE1 3.04Å; Y528-H824 PolarHBondContact OH-NE2 2.71Å; Y528-H824 VanDerWaalsContact OH-NE2 3.15Å; Y532-H824 AromaticContact CD1-CE1 3.8Å; Y532-H824 AromaticContact CE1-CE1 3.4Å; Y532-H824 WeakPolarHBondContact CE1-CE1 3.41Å; Y532-H824 AromaticContact CE1-ND1 3.39Å; Y532-H824 WeakPolarHBondContact CE1-ND1 3.46Å; Y532-H824 AromaticContact CZ-CE1 3.65Å; Y532-H824 AromaticContact CZ-ND1 3.69Å; T722-H824 PolarHBondContact O-NE2 3.01Å; W725-H824 AromaticContact CE3-CD2 3.85Å; W725-H824 AromaticContact CE3-CE1 3.64Å; W725-H824 AromaticContact CE3-CG 3.97Å; W725-H824 AromaticContact CE3-ND1 3.86Å; W725-H824 AromaticContact CE3-NE2 3.62Å; W725-H824 AromaticContact CZ3-CE1 3.98Å; W725-H824 AromaticContact CZ3-ND1 3.89Å; M728-H824 HydrophobicContact CE-CB 3.96Å; M728-H824 VanDerWaalsContact CE-O 3.24Å; M728-H824 WeakPolarHBondContact CE-O 3.49Å; H824-D826 PolarHBondContact O-N 3.47Å; H824-N828 WeakPolarHBondContact O-CB 3.48Å; H824-N828 PolarHBondContact O-N 3.39Å; H824-N828 PolarHBondContact O-ND2 3.01Å
825	S	98.1	Very high	97.7	Very high	71 Å²	71	50.7 Å²	50.7	50%	0.497	27%	0.27	S	S	.	.	H	α-helix	trans	-54.1	-37.8	171.9	44.9	0	0	0	0	112.4	A823 N828 A829	A823-S825 PolarHBondContact O-N 3.42Å; A823-S825 VanDerWaalsContact O-N 3.09Å; S825-N828 PolarHBondContact O-N 3.33Å; S825-A829 WeakPolarHBondContact O-CB 3.47Å; S825-A829 PolarHBondContact O-N 2.79Å
826	D	98.5	Very high	97.5	Very high	39 Å²	39	47.7 Å²	47.7	21%	0.209	25%	0.253	C	S	.	.	H	α-helix	trans	-88.3	-34	-165.8	-42.7	-26.6	0	0	0	109.9	W819 I821 N822 A823 H824 L830	W819-D826 PolarHBondContact NE1-O 3.3Å; I821-D826 HydrophobicContact CD1-CB 3.93Å; N822-D826 WeakPolarHBondContact CA-OD2 3.31Å; N822-D826 WeakPolarHBondContact CB-OD2 2.96Å; N822-D826 PolarHBondContact N-OD2 3.46Å; A823-D826 PolarHBondContact N-OD2 3.43Å; A823-D826 WeakPolarHBondContact O-CB 3.37Å; A823-D826 PolarHBondContact O-N 2.97Å; H824-D826 PolarHBondContact O-N 3.47Å; D826-L830 VanDerWaalsContact O-CB 3.23Å; D826-L830 WeakPolarHBondContact O-CB 3.27Å; D826-L830 PolarHBondContact O-N 3.47Å
827	L	98	Very high	97.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-34.6	165.3	-76.2	176.9	0	0	0	112.4	W725 M728 A729 I821 N831	W725-L827 HydrophobicContact CD2-CD1 3.75Å; W725-L827 HydrophobicContact CE3-CD1 4.39Å; W725-L827 HydrophobicContact CG-CD1 4Å; W725-L827 HydrophobicContact CZ2-CD1 3.93Å; M728-L827 HydrophobicContact CB-CD1 4.5Å; M728-L827 HydrophobicContact CE-CB 3.71Å; A729-L827 HydrophobicContact CB-CD1 4.2Å; A729-L827 HydrophobicContact CB-CD2 4.15Å; I821-L827 HydrophobicContact CD1-CD2 3.88Å; I821-L827 HydrophobicContact CD1-CG 4.15Å; I821-L827 HydrophobicContact CG1-CD2 4.27Å; I821-L827 HydrophobicContact CG2-CD1 4.47Å; I821-L827 HydrophobicContact CG2-CD2 4.19Å; I821-L827 HydrophobicContact CG2-CG 3.89Å; L827-N831 VanDerWaalsContact O-CB 3.31Å; L827-N831 WeakPolarHBondContact O-CB 3.38Å; L827-N831 PolarHBondContact O-N 3.36Å; L827-N831 PolarHBondContact O-ND2 3.4Å
828	N	97.8	Very high	96.8	Very high	88 Å²	88	52.5 Å²	52.5	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-69.5	-45.3	173.3	-84.6	-47.8	0	0	0	111.5	M728 H824 S825 L830 N831 H832	M728-N828 HydrophobicContact CE-CB 4.43Å; M728-N828 VanDerWaalsContact CE-ND2 3.28Å; M728-N828 WeakPolarHBondContact CE-ND2 3.23Å; H824-N828 WeakPolarHBondContact O-CB 3.48Å; H824-N828 PolarHBondContact O-N 3.39Å; H824-N828 PolarHBondContact O-ND2 3.01Å; S825-N828 PolarHBondContact O-N 3.33Å; N828-L830 VanDerWaalsContact C-N 3.35Å; N828-L830 PolarHBondContact O-N 2.86Å; N828-N831 WeakPolarHBondContact O-CB 3.31Å; N828-N831 PolarHBondContact O-N 3.04Å; N828-H832 WeakPolarHBondContact O-CB 3.24Å; N828-H832 PolarHBondContact O-N 3.08Å
829	A	98.3	Very high	96.3	Very high	46 Å²	46	51.2 Å²	51.2	38%	0.38	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-41	174.9	0	0	0	0	0	112	W819 S825 H832 A833	W819-A829 HydrophobicContact CH2-CB 4.49Å; W819-A829 HydrophobicContact CZ2-CB 3.82Å; S825-A829 WeakPolarHBondContact O-CB 3.47Å; S825-A829 PolarHBondContact O-N 2.79Å; A829-H832 PolarHBondContact O-N 2.66Å; A829-A833 WeakPolarHBondContact O-CB 3.31Å; A829-A833 PolarHBondContact O-N 3.09Å
830	L	98.2	Very high	96.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-46.7	173.7	176.6	58.3	0	0	0	111.3	W511 A732 I801 W819 I821 D826 N828 H832 A833 L834 L839	W511-L830 HydrophobicContact CH2-CD2 3.58Å; W511-L830 HydrophobicContact CZ3-CD2 3.94Å; A732-L830 HydrophobicContact CB-CD2 4.4Å; I801-L830 HydrophobicContact CD1-CD1 4.22Å; I801-L830 HydrophobicContact CD1-CD2 4Å; I801-L830 HydrophobicContact CG2-CD2 4.14Å; W819-L830 HydrophobicContact CD2-CD1 4.24Å; W819-L830 HydrophobicContact CG-CD1 4.46Å; W819-L830 HydrophobicContact CZ2-CB 4.02Å; W819-L830 VanDerWaalsContact CZ2-N 3.31Å; I821-L830 HydrophobicContact CD1-CD2 4.2Å; D826-L830 VanDerWaalsContact O-CB 3.23Å; D826-L830 WeakPolarHBondContact O-CB 3.27Å; D826-L830 PolarHBondContact O-N 3.47Å; N828-L830 VanDerWaalsContact C-N 3.35Å; N828-L830 PolarHBondContact O-N 2.86Å; L830-H832 VanDerWaalsContact C-N 3.28Å; L830-H832 PolarHBondContact O-N 3.04Å; L830-A833 PolarHBondContact O-N 3.18Å; L830-L834 HydrophobicContact CD1-CD1 4.13Å; L830-L834 HydrophobicContact CD1-CG 4.36Å; L830-L834 HydrophobicContact CG-CD1 4.15Å; L830-L834 WeakPolarHBondContact O-CB 3.33Å; L830-L834 WeakPolarHBondContact O-CG 3.41Å; L830-L834 PolarHBondContact O-N 3.35Å; L830-L839 HydrophobicContact CD1-CD1 3.55Å
831	N	97.8	Very high	96.1	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-43.7	174.8	-98.4	-82	0	0	0	111.9	M728 K731 K735 L827 N828 L834 D835	M728-N831 PolarHBondContact O-ND2 3.08Å; K731-N831 WeakPolarHBondContact CD-OD1 3.45Å; K731-N831 WeakPolarHBondContact CG-OD1 3.39Å; K735-N831 PolarHBondContact NZ-O 2.88Å; K735-N831 PolarHBondContact NZ-OD1 3.2Å; L827-N831 VanDerWaalsContact O-CB 3.31Å; L827-N831 WeakPolarHBondContact O-CB 3.38Å; L827-N831 PolarHBondContact O-N 3.36Å; L827-N831 PolarHBondContact O-ND2 3.4Å; N828-N831 WeakPolarHBondContact O-CB 3.31Å; N828-N831 PolarHBondContact O-N 3.04Å; N831-L834 PolarHBondContact O-N 3.16Å; N831-D835 PolarHBondContact O-N 3.21Å; N831-D835 VanDerWaalsContact O-OD2 3.09Å
832	H	97.5	Very high	96	Very high	114 Å²	114	51.3 Å²	51.3	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-42.1	179.8	-174.3	54.5	0	0	0	112.4	N828 A829 L830 L834 D835 L836	N828-H832 WeakPolarHBondContact O-CB 3.24Å; N828-H832 PolarHBondContact O-N 3.08Å; A829-H832 PolarHBondContact O-N 2.66Å; L830-H832 VanDerWaalsContact C-N 3.28Å; L830-H832 PolarHBondContact O-N 3.04Å; H832-L834 VanDerWaalsContact C-N 3.27Å; H832-L834 PolarHBondContact O-N 3.09Å; H832-D835 PolarHBondContact O-N 3.34Å; H832-D835 VanDerWaalsContact O-N 3.12Å; H832-L836 WeakPolarHBondContact O-CG 3.33Å; H832-L836 PolarHBondContact O-N 3.47Å
833	A	97.4	Very high	96	Very high	8 Å²	8	49.6 Å²	49.6	7%	0.066	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-35	174	0	0	0	0	0	112.6	W819 A829 L830 G837 Y838 L839	W819-A833 HydrophobicContact CH2-CB 3.94Å; W819-A833 HydrophobicContact CZ3-CB 4.22Å; A829-A833 WeakPolarHBondContact O-CB 3.31Å; A829-A833 PolarHBondContact O-N 3.09Å; L830-A833 PolarHBondContact O-N 3.18Å; A833-G837 PolarHBondContact O-N 3.32Å; A833-G837 VanDerWaalsContact O-N 3.11Å; A833-Y838 PolarHBondContact O-N 3.45Å; A833-L839 HydrophobicContact CB-CD1 4.09Å; A833-L839 HydrophobicContact CB-CG 4.21Å; A833-L839 PolarHBondContact O-N 2.94Å
834	L	96.5	Very high	95.9	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-74	-29.7	173.1	-70.3	167.6	0	0	0	113.4	F509 A732 K735 I736 R739 L830 N831 H832 L839	F509-L834 HydrophobicContact CE1-CD2 4.09Å; F509-L834 HydrophobicContact CZ-CD2 3.8Å; A732-L834 HydrophobicContact CB-CD1 3.98Å; K735-L834 HydrophobicContact CD-CB 3.98Å; K735-L834 HydrophobicContact CD-CD1 4.5Å; I736-L834 HydrophobicContact CD1-CD1 4.05Å; I736-L834 HydrophobicContact CD1-CD2 4.19Å; I736-L834 HydrophobicContact CG1-CD1 4.16Å; I736-L834 HydrophobicContact CG1-CD2 3.8Å; R739-L834 PolarHBondContact NH2-O 3.47Å; L830-L834 HydrophobicContact CD1-CD1 4.13Å; L830-L834 HydrophobicContact CD1-CG 4.36Å; L830-L834 HydrophobicContact CG-CD1 4.15Å; L830-L834 WeakPolarHBondContact O-CB 3.33Å; L830-L834 WeakPolarHBondContact O-CG 3.41Å; L830-L834 PolarHBondContact O-N 3.35Å; N831-L834 PolarHBondContact O-N 3.16Å; H832-L834 VanDerWaalsContact C-N 3.27Å; H832-L834 PolarHBondContact O-N 3.09Å; L834-L839 HydrophobicContact CD2-CB 3.89Å; L834-L839 HydrophobicContact CG-CB 4.44Å
835	D	94.8	Very high	95.7	Very high	98 Å²	98	53.4 Å²	53.4	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-72.2	-34.5	173.3	-74.1	-38.2	0	0	0	111.7	K735 N831 H832	K735-D835 WeakPolarHBondContact CE-OD1 3.5Å; K735-D835 IonicContact NZ-OD1 3.6Å; K735-D835 PolarHBondContact NZ-OD1 3.32Å; K735-D835 IonicContact NZ-OD2 3.06Å; K735-D835 PolarHBondContact NZ-OD2 3.5Å; N831-D835 PolarHBondContact O-N 3.21Å; N831-D835 VanDerWaalsContact O-OD2 3.09Å; H832-D835 PolarHBondContact O-N 3.34Å; H832-D835 VanDerWaalsContact O-N 3.12Å
836	L	94.2	Very high	95.5	Very high	83 Å²	83	52.1 Å²	52.1	44%	0.435	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.2	177.6	-63.2	-179.1	0	0	0	114.3	H832 Y838	H832-L836 WeakPolarHBondContact O-CG 3.33Å; H832-L836 PolarHBondContact O-N 3.47Å; L836-Y838 VanDerWaalsContact C-N 3.28Å; L836-Y838 HydrophobicContact CB-CD1 4.07Å; L836-Y838 HydrophobicContact CB-CD2 4.14Å; L836-Y838 HydrophobicContact CB-CE1 3.93Å; L836-Y838 HydrophobicContact CB-CE2 4.01Å; L836-Y838 HydrophobicContact CB-CG 4.18Å; L836-Y838 HydrophobicContact CD1-CD2 4.29Å; L836-Y838 HydrophobicContact CD1-CE2 3.53Å; L836-Y838 HydrophobicContact CG-CE2 4.44Å; L836-Y838 PolarHBondContact O-N 3.43Å
837	G	90.7	Very high	95.3	Very high	46 Å²	46	53.2 Å²	53.2	47%	0.474	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	16.8	-179.9	0	0	0	0	0	115.1	A833 L839	A833-G837 PolarHBondContact O-N 3.32Å; A833-G837 VanDerWaalsContact O-N 3.11Å; G837-L839 VanDerWaalsContact C-N 3.3Å; G837-L839 CarbonylContact C-O 3.54Å
838	Y	89.8	Confident	95.1	Very high	170 Å²	170	57.6 Å²	57.6	67%	0.667	31%	0.312	S	S	*	.			trans	-68	-36.5	173.7	-60.1	-18	0	0	0	110.9	R507 A833 L836	R507-Y838 PolarHBondContact NH2-O 3.2Å; A833-Y838 PolarHBondContact O-N 3.45Å; L836-Y838 VanDerWaalsContact C-N 3.28Å; L836-Y838 HydrophobicContact CB-CD1 4.07Å; L836-Y838 HydrophobicContact CB-CD2 4.14Å; L836-Y838 HydrophobicContact CB-CE1 3.93Å; L836-Y838 HydrophobicContact CB-CE2 4.01Å; L836-Y838 HydrophobicContact CB-CG 4.18Å; L836-Y838 HydrophobicContact CD1-CD2 4.29Å; L836-Y838 HydrophobicContact CD1-CE2 3.53Å; L836-Y838 HydrophobicContact CG-CE2 4.44Å; L836-Y838 PolarHBondContact O-N 3.43Å
839	L	88	Confident	94.8	Very high	25 Å²	25	54.8 Å²	54.8	13%	0.131	30%	0.298	C	S	.	.			trans	-104.1	0	161.4	-61.8	177	0	0	0	107.9	R507 F509 R739 V799 W819 L830 A833 L834 G837	R507-L839 VanDerWaalsContact CD-OXT 3.31Å; R507-L839 WeakPolarHBondContact CD-OXT 3.3Å; R507-L839 PolarHBondContact NE-OXT 3.36Å; R507-L839 PolarHBondContact NH2-OXT 3.07Å; F509-L839 HydrophobicContact CE1-CB 4.1Å; F509-L839 HydrophobicContact CZ-CB 4.17Å; R739-L839 PolarHBondContact NH1-O 3.43Å; R739-L839 PolarHBondContact NH1-OXT 3.3Å; R739-L839 PolarHBondContact NH2-O 2.89Å; V799-L839 HydrophobicContact CG1-CD2 4.4Å; V799-L839 HydrophobicContact CG2-CD2 4.32Å; W819-L839 HydrophobicContact CD2-CD1 4.46Å; W819-L839 HydrophobicContact CE3-CD1 3.73Å; W819-L839 HydrophobicContact CZ3-CD1 3.79Å; L830-L839 HydrophobicContact CD1-CD1 3.55Å; A833-L839 HydrophobicContact CB-CD1 4.09Å; A833-L839 HydrophobicContact CB-CG 4.21Å; A833-L839 PolarHBondContact O-N 2.94Å; L834-L839 HydrophobicContact CD2-CB 3.89Å; L834-L839 HydrophobicContact CG-CB 4.44Å; G837-L839 VanDerWaalsContact C-N 3.3Å; G837-L839 CarbonylContact C-O 3.54Å

Retrieved 839 of 839 residues in 710.9 ms (Link to these results)

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