A0A093K863_STRCA Loading...

Mitogen-activated protein kinase kinase kinase 14

AlphaFold DB , UniProt , Accession A0A093K863, Species STRCA (Struthio camelus australis), Gene n/a, Length 944 aa.

						>A0A093K863_STRCA|A0A093K863
MAVMGITCQGAPDPTIKHKKELTATKGLNETVSEKQSSVCKVEDSKKVAFHSPWKILNDVITKGTAKEETEGGSASISIIAQAECENSQEFSPTLSERSFIAHSKRYSRSDSLDQIPNNVAHATEGKMAPTCWRGRHRGKNRKKRHKKRSKLKIQTVVAGRRGPRTPEQESCTPIPVQEDETHQSTLYRNNFWVSELGKDLVYDPLLFEKPGKVLSAGKLHPPRSQYKTELHKLISPVQCLNHVWKRHYQGDSVPQPETLHPFPYNIIPPHFPPLDSPLHAMKLNALGTYFHGDFNYQNSEHRLSSLNLECSFPRCVNQSVKTSSDKISVEEYLVDALKGSVSLGEPQNLASLAKTWRGGGLDLKEQFQEADENEGVLLNEKLKPVDYEYREEVHWTKCHSSLGVGSFGEVYKIEDKQTGFQCAAKKVQVEHFRAEELTTCAAITSPKVVPLYGAVKEGPWVTIFMKLMEGGSLGQLIKQSGCLPEDRALSYLGQALEGLEHLHAQNILHGDVKADNVLLSDDGSRALLCDFGHSAHLHPDSLGKCLITGNYVPGTETHMAPEVVMGKRCDSKVDVWSSCCMMLHMLNGCHPWTQYYNHPLCLKIAKEPPPLREIPPSCNPLTAEIIKMGLEKEPVQRASASELKTKTTVALEEVGGVTSPWKGEYREPRHLALNKENSQQTSLPPTVSPVSETGSDGKLAVKVSCASPFLPPPSLERTEEVEGPPWNLCKELSGIWDPPPLSSLAPLPLKSCSHVERATTISEQELQQLEIELFLNSLSQPYSLEEQEQMLSCLSIDSPFVSDASEKNSLKASHSLRDTMSSGIHSWNSQTDGQSFSWNNLLNRSRHTDTPSYFNGVKIQIQLLSGENLHIRDFHRTKVGDIATGISSQIPVPAFSLVTKEGQPVHYDMEVPDSGIELQCTLAPDCSISWTWRVKHGQLENRP
					

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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	26.2	Very low	28.4	Very low	256 Å²	256	139.4 Å²	139.4	100%	1.261	86%	0.864	S	S	*	*				0	152.9	0	-65.8	-178	-177.5	0	0	108.6
2	A	34.3	Very low	29.6	Very low	98 Å²	98	138.4 Å²	138.4	81%	0.81	86%	0.861	S	S	*	*			trans	-135	148.9	-173.9	0	0	0	0	0	112.4
3	V	22.9	Very low	29.5	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	86%	0.858	S	S	*	*			trans	-145.9	97.6	166.2	177.2	0	0	0	0	105.2
4	M	27.6	Very low	31.4	Very low	178 Å²	178	136.1 Å²	136.1	88%	0.877	84%	0.839	S	S	*	*				68.6	141.4	98.6	-68.4	-160	-61.7	0	0	116.5
5	G	26.7	Very low	31.2	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	83%	0.833	S	S	*	*			trans	137.5	101.2	143.4	0	0	0	0	0	116.9
6	I	26.7	Very low	31.3	Very low	164 Å²	164	135.8 Å²	135.8	84%	0.841	83%	0.828	S	S	*	*			trans	-138.2	132.2	151.8	-56.8	-179	0	0	0	107.7
7	T	24.5	Very low	31	Very low	141 Å²	141	139.5 Å²	139.5	87%	0.865	83%	0.83	S	S	*	*			trans	-128.3	150.8	174.4	43.6	0	0	0	0	110.4
8	C	33.2	Very low	30.9	Very low	116 Å²	116	140.7 Å²	140.7	78%	0.784	83%	0.825	S	S	*	*			trans	-111.2	138.3	-175.5	-58.8	0	0	0	0	112.3
9	Q	30.5	Very low	30.8	Very low	205 Å²	205	142.1 Å²	142.1	96%	0.958	82%	0.82	S	S	*	*			trans	179.6	160.7	157.4	-101.7	158.1	57.7	0	0	107.6
10	G	28.6	Very low	30.7	Very low	68 Å²	68	143.4 Å²	143.4	70%	0.701	82%	0.815	S	S	*	*			cis	-175.2	164.9	-1.5	0	0	0	0	0	109.4
11	A	31	Very low	30.6	Very low	105 Å²	105	142.4 Å²	142.4	87%	0.868	80%	0.804	S	S	*	*			trans	-82.1	164	-173.2	0	0	0	0	0	114.5
12	P	42.5	Very low	30.7	Very low	128 Å²	128	137 Å²	137	83%	0.831	78%	0.779	S	S	*	*			trans	-135.5	149.3	144.2	38.5	-26.8	0	0	0	115
13	D	29.2	Very low	30.3	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	78%	0.778	S	S	*	*			trans	-160.9	165.3	167	-156.9	34.6	0	0	0	105.5
14	P	55.6	Low	30.5	Very low	92 Å²	92	136.3 Å²	136.3	60%	0.597	77%	0.774	S	S	*	*			cis	-130.7	175.8	-2.3	37.1	-18.3	0	0	0	115.7
15	T	28.8	Very low	30.7	Very low	121 Å²	121	133.7 Å²	133.7	74%	0.742	77%	0.768	S	S	*	*				169.2	115.3	115.9	36.3	0	0	0	0	116.8
16	I	32.1	Very low	30.9	Very low	146 Å²	146	139.7 Å²	139.7	75%	0.749	77%	0.773	S	S	*	*			trans	39.9	111.9	133	-40.9	172.9	0	0	0	120.5
17	K	25.8	Very low	30.9	Very low	198 Å²	198	135.4 Å²	135.4	86%	0.861	77%	0.769	S	S	*	*				-175.4	114.8	121.1	-103.1	163.2	-171.4	170.8	0	117.4
18	H	30.2	Very low	31.2	Very low	161 Å²	161	135.9 Å²	135.9	75%	0.745	77%	0.766	S	S	*	*			trans	21.1	131.1	145.1	-72.8	-47.7	0	0	0	125.8
19	K	28.8	Very low	31	Very low	168 Å²	168	136 Å²	136	73%	0.73	76%	0.759	S	S	*	*				84	137.2	124.2	-83.7	-177.7	173.9	174.6	0	122.6
20	K	28.8	Very low	31	Very low	167 Å²	167	133.6 Å²	133.6	73%	0.726	75%	0.748	S	S	*	*			trans	69.5	159.5	144.1	-78.1	-173.1	164.1	-86.8	0	117.3
21	E	28.2	Very low	30.9	Very low	123 Å²	123	135.5 Å²	135.5	58%	0.575	75%	0.746	S	S	*	*			cis	-175.8	151.6	-34.6	-146.2	-177.2	120.8	0	0	107.5
22	L	28.6	Very low	30.8	Very low	142 Å²	142	136.7 Å²	136.7	74%	0.743	74%	0.742	S	S	*	*			trans	63.8	165.9	168.5	-53.8	154.9	0	0	0	114
23	T	26.4	Very low	30	Very low	129 Å²	129	135.7 Å²	135.7	79%	0.791	74%	0.738	S	S	*	*			cis	-142.7	159.6	-2	-22.8	0	0	0	0	110.5
24	A	27.5	Very low	30	Very low	83 Å²	83	135 Å²	135	69%	0.686	73%	0.73	S	S	*	*			trans	-70.5	167.3	172.4	0	0	0	0	0	114
25	T	30	Very low	28.8	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	73%	0.731	S	S	*	*				-167.6	145	116.2	15.9	0	0	0	0	113.8
26	K	31.8	Very low	28.8	Very low	200 Å²	200	139.6 Å²	139.6	87%	0.87	73%	0.733	S	S	*	*			trans	34.2	127.9	146	-59.2	169.5	-177.8	179.3	0	118
27	G	27.5	Very low	28.6	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	73%	0.731	S	S	*	*				103.9	159.2	54.2	0	0	0	0	0	109.1
28	L	30.4	Very low	28.7	Very low	152 Å²	152	133.7 Å²	133.7	80%	0.796	73%	0.729	S	S	*	*			cis	-168.6	137.9	10.1	-174.4	89.4	0	0	0	109
29	N	28.5	Very low	28.5	Very low	119 Å²	119	132.8 Å²	132.8	64%	0.636	74%	0.735	S	S	*	*			trans	59	177.5	156.9	-70.8	22.1	0	0	0	117.2
30	E	30.6	Very low	28.3	Very low	154 Å²	154	130.3 Å²	130.3	72%	0.72	74%	0.737	S	S	*	*			cis	-166.5	171	-26.7	-101.8	173.6	137	0	0	107.2
31	T	27	Very low	28.1	Very low	108 Å²	108	132.1 Å²	132.1	66%	0.663	75%	0.745	S	S	*	*			cis	-158.6	144.9	-3.6	16	0	0	0	0	110
32	V	28.3	Very low	28.3	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	76%	0.758	S	S	*	*			trans	43.7	146	132.4	-174	0	0	0	0	122.7
33	S	26.6	Very low	28.3	Very low	107 Å²	107	135 Å²	135	75%	0.748	76%	0.764	S	S	*	*			trans	100.2	149.2	158	80.2	0	0	0	0	117.9
34	E	29.4	Very low	28.5	Very low	140 Å²	140	135.9 Å²	135.9	65%	0.654	76%	0.764	S	S	*	*			cis	-160.2	156.5	-28.7	-110.5	-151.5	134.9	0	0	110.8
35	K	29.8	Very low	28.6	Very low	144 Å²	144	136.9 Å²	136.9	63%	0.626	77%	0.766	S	S	*	*			trans	59.9	128.3	146.9	-73.5	173	-179.4	133.6	0	123.3
36	Q	28.4	Very low	28.6	Very low	164 Å²	164	140.5 Å²	140.5	77%	0.766	77%	0.771	S	S	*	*				85	98.6	128.3	-73.3	176.7	-14	0	0	123
37	S	27.2	Very low	28.5	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	77%	0.772	S	S	*	*				97.1	162.5	104.1	80.3	0	0	0	0	121.4
38	S	27.9	Very low	28.5	Very low	117 Å²	117	143.7 Å²	143.7	82%	0.818	78%	0.775	S	S	*	*			trans	76.3	122.5	170.3	75.4	0	0	0	0	118.1
39	V	26.3	Very low	28.4	Very low	142 Å²	142	140.5 Å²	140.5	86%	0.861	77%	0.771	S	S	*	*			trans	-107.9	126.7	167.5	168.9	0	0	0	0	107.6
40	C	24.6	Very low	28.3	Very low	116 Å²	116	145.2 Å²	145.2	78%	0.784	79%	0.786	S	S	*	*			trans	-168.2	138.6	146.8	-110.3	0	0	0	0	114.7
41	K	25.1	Very low	28.4	Very low	205 Å²	205	147 Å²	147	89%	0.891	79%	0.794	S	S	*	*			trans	70.5	152.1	160.8	-62.1	-170.7	174.4	-171.4	0	118.5
42	V	31.6	Very low	28.7	Very low	138 Å²	138	146.2 Å²	146.2	84%	0.836	79%	0.793	S	S	*	*			trans	-136.2	133.8	-171.2	169.6	0	0	0	0	106.7
43	E	29.7	Very low	29.4	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	79%	0.792	S	S	*	*			trans	-162.5	136.9	156.5	-115.4	160.9	-139.8	0	0	111.4
44	D	30.7	Very low	30.4	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	79%	0.789	S	S	*	*			trans	8.8	127.2	167.3	-61	-13.6	0	0	0	123.4
45	S	28.7	Very low	31.1	Very low	105 Å²	105	150.5 Å²	150.5	73%	0.734	79%	0.792	S	S	*	*				172.3	131.2	106.4	-82.5	0	0	0	0	117.2
46	K	29.5	Very low	32	Very low	198 Å²	198	150.2 Å²	150.2	86%	0.861	80%	0.796	S	S	*	*			trans	59.8	121.6	143.8	-64.9	174	-178.3	168.2	0	122.9
47	K	30.3	Very low	32.8	Very low	203 Å²	203	147.6 Å²	147.6	88%	0.883	79%	0.787	S	S	*	*			trans	12.4	132.9	141.8	-63.4	-177	176.2	-176.6	0	121.2
48	V	27.6	Very low	33.7	Very low	138 Å²	138	147.4 Å²	147.4	84%	0.836	78%	0.778	S	S	*	*				174.8	103.3	123.6	146	0	0	0	0	107
49	A	28.3	Very low	34.6	Very low	85 Å²	85	144.4 Å²	144.4	70%	0.702	75%	0.753	S	S	*	*				79.8	130.3	83.2	0	0	0	0	0	115.3
50	F	26.6	Very low	35.7	Very low	218 Å²	218	140.9 Å²	140.9	96%	0.956	73%	0.731	S	S	*	*			trans	-134	143.6	170	-100.3	-92	0	0	0	109.3
51	H	32	Very low	36.6	Very low	193 Å²	193	141.3 Å²	141.3	89%	0.894	73%	0.725	S	S	*	*			trans	-93.9	154.5	-179.7	-83.2	-86.2	0	0	0	112.8
52	S	34.6	Very low	37.6	Very low	90 Å²	90	136 Å²	136	63%	0.629	71%	0.71	S	S	*	*			trans	-137	144.3	-178.9	-179.9	0	0	0	0	110.8	W54	S52-W54 VanDerWaalsContact C-N 3.31Å; S52-W54 PolarHBondContact O-N 3.24Å
53	P	42.7	Very low	38.5	Very low	118 Å²	118	136 Å²	136	77%	0.766	70%	0.698	S	S	*	*	S	Bend	trans	-85.5	47.2	-163.9	36.2	-39.1	0	0	0	115.1
54	W	46.3	Very low	38.9	Very low	179 Å²	179	130.1 Å²	130.1	68%	0.678	69%	0.688	S	S	*	*			trans	-116.8	53.4	-179.8	-66.5	99.2	0	0	0	112.6	S52 I56 L57 N58	S52-W54 VanDerWaalsContact C-N 3.31Å; S52-W54 PolarHBondContact O-N 3.24Å; W54-I56 PolarHBondContact O-N 3.08Å; W54-L57 HydrophobicContact CB-CB 4.27Å; W54-L57 PolarHBondContact O-N 3.42Å; W54-N58 PolarHBondContact O-N 2.98Å; W54-N58 VanDerWaalsContact O-N 3.08Å
55	K	45.8	Very low	39.6	Very low	169 Å²	169	128.2 Å²	128.2	74%	0.735	68%	0.682	S	S	*	*	H	α-helix	trans	-58	-42.5	-171.9	-153.7	179.8	-177.1	-171	0	113.1	N58 D59	K55-N58 WeakPolarHBondContact O-CB 3.39Å; K55-N58 PolarHBondContact O-N 2.78Å; K55-D59 PolarHBondContact O-N 3.26Å
56	I	48.2	Very low	40.3	Very low	138 Å²	138	126.9 Å²	126.9	71%	0.708	68%	0.677	S	S	*	*	H	α-helix	trans	-61.6	-46.5	178.3	-59.6	171.5	0	0	0	111.2	W54 N58 D59 V60	W54-I56 PolarHBondContact O-N 3.08Å; I56-N58 VanDerWaalsContact C-N 3.28Å; I56-N58 PolarHBondContact O-N 3.31Å; I56-D59 PolarHBondContact O-N 3.24Å; I56-V60 WeakPolarHBondContact O-CG2 3.45Å; I56-V60 PolarHBondContact O-N 2.89Å
57	L	44.7	Very low	40.9	Very low	109 Å²	109	127.1 Å²	127.1	57%	0.571	68%	0.678	S	S	*	*	H	α-helix	trans	-61.9	-41	177.9	-153.5	84.8	0	0	0	110.8	W54 V60 I61	W54-L57 HydrophobicContact CB-CB 4.27Å; W54-L57 PolarHBondContact O-N 3.42Å; L57-V60 PolarHBondContact O-N 3.25Å; L57-I61 HydrophobicContact CD2-CD1 4.16Å; L57-I61 HydrophobicContact CG-CD1 4.06Å; L57-I61 WeakPolarHBondContact O-CB 3.31Å; L57-I61 WeakPolarHBondContact O-CD1 3.29Å; L57-I61 VanDerWaalsContact O-CG1 3.23Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.11Å
58	N	46.8	Very low	41.3	Very low	99 Å²	99	125.8 Å²	125.8	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-67.5	-38.4	179.4	-139.3	-1.7	0	0	0	112.1	W54 K55 I56 I61 T62	W54-N58 PolarHBondContact O-N 2.98Å; W54-N58 VanDerWaalsContact O-N 3.08Å; K55-N58 WeakPolarHBondContact O-CB 3.39Å; K55-N58 PolarHBondContact O-N 2.78Å; I56-N58 VanDerWaalsContact C-N 3.28Å; I56-N58 PolarHBondContact O-N 3.31Å; N58-I61 PolarHBondContact O-N 3Å; N58-T62 WeakPolarHBondContact O-CB 3.36Å; N58-T62 WeakPolarHBondContact O-CG2 3.28Å; N58-T62 PolarHBondContact O-N 3.05Å; N58-T62 PolarHBondContact O-OG1 3.31Å
59	D	46.7	Very low	41.8	Very low	55 Å²	55	128.4 Å²	128.4	29%	0.294	68%	0.678	S	S	.	*	H	α-helix	trans	-69.4	-38.5	174.8	-80.8	-37.2	0	0	0	112.2	K55 I56 T62 K63	K55-D59 PolarHBondContact O-N 3.26Å; I56-D59 PolarHBondContact O-N 3.24Å; D59-T62 PolarHBondContact O-N 3.45Å; D59-K63 WeakPolarHBondContact O-CA 3.46Å; D59-K63 VanDerWaalsContact O-CB 3.28Å; D59-K63 WeakPolarHBondContact O-CB 3.32Å; D59-K63 PolarHBondContact O-N 3.35Å; D59-K63 VanDerWaalsContact OD1-CE 3.31Å; D59-K63 WeakPolarHBondContact OD1-CE 3.42Å; D59-K63 IonicContact OD1-NZ 3.49Å; D59-K63 PolarHBondContact OD1-NZ 3.49Å
60	V	48.9	Very low	42.3	Very low	67 Å²	67	130.1 Å²	130.1	41%	0.406	68%	0.68	S	S	.	*	H	α-helix	trans	-61.4	-48	171.7	171.2	0	0	0	0	111	I56 L57 T62 G64 A66	I56-V60 WeakPolarHBondContact O-CG2 3.45Å; I56-V60 PolarHBondContact O-N 2.89Å; L57-V60 PolarHBondContact O-N 3.25Å; V60-T62 PolarHBondContact O-N 2.92Å; V60-G64 WeakPolarHBondContact O-CA 3.2Å; V60-G64 PolarHBondContact O-N 3.16Å; V60-A66 HydrophobicContact CG2-CB 4.09Å
61	I	43.3	Very low	42.7	Very low	126 Å²	126	129.3 Å²	129.3	65%	0.646	68%	0.679	S	S	*	*	H	α-helix	trans	-66.5	-34.6	-178.9	-69.1	165.4	0	0	0	112.3	L57 N58	L57-I61 HydrophobicContact CD2-CD1 4.16Å; L57-I61 HydrophobicContact CG-CD1 4.06Å; L57-I61 WeakPolarHBondContact O-CB 3.31Å; L57-I61 WeakPolarHBondContact O-CD1 3.29Å; L57-I61 VanDerWaalsContact O-CG1 3.23Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.11Å; N58-I61 PolarHBondContact O-N 3Å
62	T	45.8	Very low	43	Very low	93 Å²	93	124.1 Å²	124.1	57%	0.571	68%	0.678	S	S	*	*	H	α-helix	trans	-97.2	-16.4	-175.6	59.5	0	0	0	0	115.3	N58 D59 V60	N58-T62 WeakPolarHBondContact O-CB 3.36Å; N58-T62 WeakPolarHBondContact O-CG2 3.28Å; N58-T62 PolarHBondContact O-N 3.05Å; N58-T62 PolarHBondContact O-OG1 3.31Å; D59-T62 PolarHBondContact O-N 3.45Å; V60-T62 PolarHBondContact O-N 2.92Å
63	K	50.4	Low	43	Very low	138 Å²	138	123.3 Å²	123.3	60%	0.6	68%	0.684	S	S	*	*	H	α-helix	trans	-131.8	-1.8	-174.8	-57.5	166.7	-176.4	164	0	114.4	D59 T65	D59-K63 WeakPolarHBondContact O-CA 3.46Å; D59-K63 VanDerWaalsContact O-CB 3.28Å; D59-K63 WeakPolarHBondContact O-CB 3.32Å; D59-K63 PolarHBondContact O-N 3.35Å; D59-K63 VanDerWaalsContact OD1-CE 3.31Å; D59-K63 WeakPolarHBondContact OD1-CE 3.42Å; D59-K63 IonicContact OD1-NZ 3.49Å; D59-K63 PolarHBondContact OD1-NZ 3.49Å; K63-T65 PolarHBondContact O-N 3.23Å; K63-T65 PolarHBondContact O-OG1 3.41Å
64	G	39.3	Very low	42.4	Very low	64 Å²	64	124.1 Å²	124.1	66%	0.66	69%	0.693	S	S	*	*	S	Bend	trans	64.7	5.7	172.6	0	0	0	0	0	116.1	V60	V60-G64 WeakPolarHBondContact O-CA 3.2Å; V60-G64 PolarHBondContact O-N 3.16Å
65	T	44.3	Very low	41.9	Very low	107 Å²	107	120.6 Å²	120.6	66%	0.656	70%	0.701	S	S	*	*			trans	-145.3	137.6	-177.9	45.5	0	0	0	0	110.5	K63	K63-T65 PolarHBondContact O-N 3.23Å; K63-T65 PolarHBondContact O-OG1 3.41Å
66	A	45.3	Very low	41	Very low	77 Å²	77	118 Å²	118	64%	0.636	70%	0.704	S	S	*	*			trans	-97.3	149.4	170.3	0	0	0	0	0	110.3	V60	V60-A66 HydrophobicContact CG2-CB 4.09Å
67	K	40.7	Very low	40.2	Very low	204 Å²	204	119.3 Å²	119.3	89%	0.887	71%	0.711	S	S	*	*			trans	-114.3	143.4	162.6	-78.9	-169.9	172.5	-172.2	0	109.1
68	E	40.2	Very low	39.4	Very low	175 Å²	175	119.9 Å²	119.9	82%	0.818	72%	0.724	S	S	*	*			trans	-84.4	128.3	178.3	-169.1	173.2	-149.9	0	0	109.9	T70	E68-T70 HydrophobicContact CG-CG2 4.17Å
69	E	36.2	Very low	38.7	Very low	193 Å²	193	122.7 Å²	122.7	90%	0.902	74%	0.738	S	S	*	*			trans	-104.3	123.1	163.2	-75.3	-174.3	146.4	0	0	107.8
70	T	39.8	Very low	37.9	Very low	120 Å²	120	127.8 Å²	127.8	74%	0.736	76%	0.763	S	S	*	*			trans	-100.3	94.6	-169.1	29.8	0	0	0	0	112.9	E68	E68-T70 HydrophobicContact CG-CG2 4.17Å
71	E	35.1	Very low	36.9	Very low	201 Å²	201	129.1 Å²	129.1	94%	0.939	78%	0.782	S	S	*	*			trans	-157.6	132.4	158.4	-120.9	170.5	-150.9	0	0	111.5
72	G	37.4	Very low	36.2	Very low	85 Å²	85	130.6 Å²	130.6	88%	0.876	79%	0.786	S	S	*	*	S	Bend	trans	109.1	2.8	152.9	0	0	0	0	0	121.8
73	G	34.8	Very low	35.5	Very low	73 Å²	73	131 Å²	131	75%	0.753	80%	0.798	S	S	*	*			trans	94.7	157.2	156.8	0	0	0	0	0	119.8
74	S	31.5	Very low	34.5	Very low	135 Å²	135	132.3 Å²	132.3	94%	0.944	81%	0.807	S	S	*	*			trans	57	79.6	173.8	-60.7	0	0	0	0	116.8
75	A	34.4	Very low	34.1	Very low	104 Å²	104	135.2 Å²	135.2	86%	0.86	82%	0.815	S	S	*	*			trans	-93.3	147.4	179.1	0	0	0	0	0	114.2
76	S	26.6	Very low	33.4	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	82%	0.823	S	S	*	*			trans	-170.9	104.5	138.5	60.7	0	0	0	0	112.8
77	I	33.1	Very low	32.7	Very low	167 Å²	167	140.3 Å²	140.3	86%	0.856	82%	0.822	S	S	*	*			trans	-139	127	155.4	-60.9	-176.7	0	0	0	108.3
78	S	27.1	Very low	32.4	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	81%	0.809	S	S	*	*			trans	-161.7	109.5	166.4	-78.4	0	0	0	0	109.5
79	I	31.7	Very low	32	Very low	158 Å²	158	133.8 Å²	133.8	81%	0.81	81%	0.805	S	S	*	*			trans	-136.8	125.1	161.5	-62.1	-177.4	0	0	0	106.9
80	I	29.6	Very low	31.8	Very low	161 Å²	161	131 Å²	131	83%	0.826	79%	0.792	S	S	*	*			trans	-96.2	135	163.2	-65.4	172.1	0	0	0	106.6
81	A	28.6	Very low	31	Very low	96 Å²	96	134 Å²	134	79%	0.793	80%	0.795	S	S	*	*			trans	-119.7	134	163.2	0	0	0	0	0	108
82	Q	28.1	Very low	31	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	79%	0.786	S	S	*	*			trans	-131.1	124.4	169.8	-174	168	-13.1	0	0	107.3	E84	Q82-E84 PolarHBondContact NE2-OE1 3.31Å
83	A	32.3	Very low	31	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	79%	0.785	S	S	*	*			trans	-128.1	131.2	171.9	0	0	0	0	0	106.5
84	E	28.7	Very low	30.6	Very low	166 Å²	166	134 Å²	134	78%	0.776	78%	0.784	S	S	*	*			trans	-111.3	135.3	176.9	-72	178.5	-172.2	0	0	109	Q82	Q82-E84 PolarHBondContact NE2-OE1 3.31Å
85	C	31.7	Very low	30.5	Very low	125 Å²	125	135.5 Å²	135.5	85%	0.845	78%	0.78	S	S	*	*			trans	-147.1	125.2	-176.2	-178.2	0	0	0	0	108.8
86	E	28.8	Very low	30.2	Very low	175 Å²	175	134.8 Å²	134.8	82%	0.818	77%	0.77	S	S	*	*			trans	-133.6	138.6	165.3	-68.2	-159.5	133.3	0	0	107.4
87	N	30.6	Very low	30.2	Very low	116 Å²	116	136.9 Å²	136.9	62%	0.62	77%	0.767	S	S	*	*			cis	-154	154.1	-7.6	-127.3	-49.5	0	0	0	110.7
88	S	34.3	Very low	29.8	Very low	88 Å²	88	139.6 Å²	139.6	62%	0.615	77%	0.766	S	S	*	*			trans	3.1	152.5	134.5	-44.4	0	0	0	0	118.7
89	Q	31.4	Very low	29.8	Very low	154 Å²	154	137.8 Å²	137.8	72%	0.72	75%	0.753	S	S	*	*			cis	-178.3	165	-0.1	-110.6	-173.5	-37.1	0	0	107.1
90	E	31.3	Very low	29.5	Very low	135 Å²	135	139.1 Å²	139.1	63%	0.631	75%	0.754	S	S	*	*			cis	-165.1	174.6	-18.4	-141.6	167.2	-122.5	0	0	109.9
91	F	25	Very low	29.4	Very low	182 Å²	182	137.7 Å²	137.7	80%	0.798	75%	0.747	S	S	*	*			trans	47.1	136.7	161.4	-78.1	-72.4	0	0	0	124.2
92	S	34.2	Very low	29.3	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	75%	0.745	S	S	*	*			trans	-105.4	159.1	160.4	-42.2	0	0	0	0	111.7
93	P	36.5	Very low	29.2	Very low	130 Å²	130	138.1 Å²	138.1	84%	0.844	75%	0.747	S	S	*	*			trans	-121.1	173.3	153.2	36.7	-26.4	0	0	0	113.4
94	T	28.2	Very low	29.1	Very low	119 Å²	119	136.7 Å²	136.7	73%	0.73	73%	0.731	S	S	*	*			trans	-130.7	163.6	-158.1	53.9	0	0	0	0	115.2
95	L	28.1	Very low	29.2	Very low	167 Å²	167	137.3 Å²	137.3	87%	0.874	73%	0.731	S	S	*	*			trans	70.4	134.4	162.5	-63.2	150.6	0	0	0	115.8
96	S	27.5	Very low	29.2	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	73%	0.725	S	S	*	*				-163.6	164.8	51.5	-158.9	0	0	0	0	114.6
97	E	26.6	Very low	29.4	Very low	158 Å²	158	140.3 Å²	140.3	74%	0.738	72%	0.718	S	S	*	*			trans	36.5	127.1	148.6	-72.8	176	131.5	0	0	123
98	R	26.4	Very low	29.2	Very low	223 Å²	223	139.6 Å²	139.6	84%	0.842	72%	0.722	S	S	*	*				66.9	137.5	78.7	-93.1	-177	175.7	173.4	-0.9	113.9
99	S	25.9	Very low	28.9	Very low	83 Å²	83	146.4 Å²	146.4	58%	0.58	74%	0.735	S	S	*	*			cis	-160.7	-168	16.3	-81.7	0	0	0	0	111.9
100	F	25.1	Very low	28.9	Very low	187 Å²	187	142.7 Å²	142.7	82%	0.82	73%	0.726	S	S	*	*			trans	86.5	126.2	170	-66.1	-92.1	0	0	0	116.8
101	I	28.4	Very low	28.7	Very low	131 Å²	131	142.8 Å²	142.8	67%	0.672	73%	0.731	S	S	*	*			cis	108.2	106.8	16.6	-64.3	162.3	0	0	0	114.2
102	A	27	Very low	28.8	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	73%	0.73	S	S	*	*			trans	-162.3	127.8	141	0	0	0	0	0	106.3
103	H	25.4	Very low	28.6	Very low	171 Å²	171	142 Å²	142	79%	0.792	74%	0.735	S	S	*	*				57.5	131.8	50.5	-71.8	-48.8	0	0	0	114
104	S	30	Very low	28.3	Very low	71 Å²	71	141.3 Å²	141.3	50%	0.497	72%	0.724	S	S	.	*			cis	-174.2	177	-1	52.7	0	0	0	0	111.3
105	K	30.6	Very low	28.3	Very low	178 Å²	178	142.7 Å²	142.7	77%	0.774	72%	0.722	S	S	*	*			trans	76.1	155	161.5	-63.8	149.5	-170	163	0	115.3
106	R	31.9	Very low	28.4	Very low	189 Å²	189	141.4 Å²	141.4	71%	0.713	71%	0.714	S	S	*	*			cis	-169.1	162.6	1	-111.8	166.2	160.6	179	-13.3	106
107	Y	32.1	Very low	29.4	Very low	174 Å²	174	142 Å²	142	68%	0.682	72%	0.716	S	S	*	*			cis	-152.4	151.8	-13.3	-87	-58	0	0	0	104.3
108	S	27.2	Very low	29.5	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	71%	0.714	S	S	*	*			cis	93	52.5	4.6	92.5	0	0	0	0	120.3
109	R	28.2	Very low	29.7	Very low	231 Å²	231	137.3 Å²	137.3	87%	0.872	71%	0.713	S	S	*	*			trans	-158.2	147.1	153.6	-88.8	-155.9	148.4	149.6	-5.2	110.1
110	S	30.6	Very low	30	Very low	76 Å²	76	140.1 Å²	140.1	53%	0.531	73%	0.726	S	S	.	*			cis	114.3	125.7	4.2	93.8	0	0	0	0	117.1
111	D	28.2	Very low	30.3	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	72%	0.716	S	S	*	*			trans	81	139.2	147.9	-41.8	-45.3	0	0	0	124.1
112	S	27.6	Very low	30.4	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	73%	0.726	S	S	*	*			trans	72.9	151.9	162.3	74.3	0	0	0	0	118.1
113	L	28.1	Very low	30.6	Very low	162 Å²	162	137.1 Å²	137.1	85%	0.848	72%	0.722	S	S	*	*			cis	-148.6	-162.3	30.3	-154.2	80.6	0	0	0	113.2
114	D	30.3	Very low	30.9	Very low	115 Å²	115	135.5 Å²	135.5	62%	0.615	72%	0.724	S	S	*	*			trans	-93.9	153.3	-159.8	-83.7	-89.3	0	0	0	119.4
115	Q	29.4	Very low	31	Very low	147 Å²	147	139.2 Å²	139.2	69%	0.687	73%	0.734	S	S	*	*			trans	65.2	131.2	133.1	-70.1	172	51.8	0	0	125.3
116	I	29.9	Very low	30.9	Very low	140 Å²	140	134.6 Å²	134.6	72%	0.718	74%	0.737	S	S	*	*			trans	74.9	155.7	133.6	-69.7	173	0	0	0	117.1
117	P	47.9	Very low	30.8	Very low	103 Å²	103	133.1 Å²	133.1	67%	0.669	74%	0.736	S	S	*	*			cis	-127.2	167.1	4	21.6	3	0	0	0	118.7
118	N	29.6	Very low	30.6	Very low	132 Å²	132	133.6 Å²	133.6	71%	0.706	75%	0.746	S	S	*	*			trans	24	137.1	138	-48	-15.1	0	0	0	122
119	N	30.2	Very low	30.8	Very low	150 Å²	150	133 Å²	133	80%	0.802	75%	0.747	S	S	*	*				175.6	139.1	91.6	-92.1	-60.3	0	0	0	114
120	V	31.3	Very low	31.4	Very low	142 Å²	142	127 Å²	127	86%	0.861	74%	0.739	S	S	*	*				164.5	136.2	128.7	157	0	0	0	0	109.5
121	A	31.9	Very low	31.3	Very low	74 Å²	74	129.3 Å²	129.3	61%	0.612	75%	0.749	S	S	*	*			trans	-115.3	-179	176.8	0	0	0	0	0	109.3
122	H	32	Very low	31.4	Very low	192 Å²	192	127.8 Å²	127.8	89%	0.889	75%	0.748	S	S	*	*			cis	-151.2	165.3	22.2	-109.3	-70.3	0	0	0	113.1
123	A	30.3	Very low	31.4	Very low	80 Å²	80	133.9 Å²	133.9	66%	0.661	75%	0.754	S	S	*	*			trans	-57.5	163.6	175.5	0	0	0	0	0	118.9
124	T	32.2	Very low	31.7	Very low	137 Å²	137	137.4 Å²	137.4	84%	0.84	76%	0.756	S	S	*	*			trans	-166.5	107.2	134.5	12.3	0	0	0	0	107.6
125	E	30.9	Very low	31.6	Very low	150 Å²	150	135.8 Å²	135.8	70%	0.701	77%	0.767	S	S	*	*				65.8	116.5	86.4	-78.4	-114.9	92.2	0	0	115.3	K127	E125-K127 IonicContact OE1-NZ 3.65Å; E125-K127 PolarHBondContact OE1-NZ 2.99Å; E125-K127 IonicContact OE2-NZ 3.53Å
126	G	28.6	Very low	31.7	Very low	81 Å²	81	140.2 Å²	140.2	84%	0.835	78%	0.777	S	S	*	*			trans	-179.4	78.6	177.7	0	0	0	0	0	112.4
127	K	30.7	Very low	31.8	Very low	158 Å²	158	142.3 Å²	142.3	69%	0.687	78%	0.784	S	S	*	*			trans	-86	141.1	-171.5	-58.2	171.1	174.1	97.7	0	112.4	E125	E125-K127 IonicContact OE1-NZ 3.65Å; E125-K127 PolarHBondContact OE1-NZ 2.99Å; E125-K127 IonicContact OE2-NZ 3.53Å
128	M	27.5	Very low	31	Very low	183 Å²	183	148.3 Å²	148.3	90%	0.901	79%	0.793	S	S	*	*				167.9	150.5	110	-89.3	-167.8	176.9	0	0	114.8
129	A	30.5	Very low	31	Very low	88 Å²	88	145.3 Å²	145.3	73%	0.727	79%	0.794	S	S	*	*			trans	-102	-163.6	164.7	0	0	0	0	0	108.3
130	P	42.4	Very low	31.1	Very low	107 Å²	107	147.3 Å²	147.3	70%	0.695	80%	0.795	S	S	*	*			cis	-148.6	-177.3	16.4	40.2	-16.1	0	0	0	118.8
131	T	27.7	Very low	31.1	Very low	123 Å²	123	147.6 Å²	147.6	76%	0.755	79%	0.792	S	S	*	*			trans	55.6	114.5	148.3	47.3	0	0	0	0	122.9
132	C	30.9	Very low	31.2	Very low	106 Å²	106	154.2 Å²	154.2	72%	0.716	80%	0.801	S	S	*	*				23.5	133.6	117	-170.1	0	0	0	0	120.3
133	W	27.5	Very low	31.3	Very low	241 Å²	241	153.6 Å²	153.6	91%	0.913	80%	0.795	S	S	*	*				-166.1	161.7	123.4	-104	101.1	0	0	0	112.2
134	R	34	Very low	31.3	Very low	236 Å²	236	159.1 Å²	159.1	89%	0.891	81%	0.805	S	S	*	*			trans	-96.3	144.6	178.6	-75.1	-173.1	-91.9	-144.4	-4.9	112.6
135	G	29.1	Very low	31.5	Very low	81 Å²	81	163.9 Å²	163.9	84%	0.835	81%	0.807	S	S	*	*			trans	-152.2	119.5	169.5	0	0	0	0	0	113.8
136	R	31	Very low	31.6	Very low	241 Å²	241	165 Å²	165	91%	0.909	81%	0.812	S	S	*	*			trans	-85.4	157.3	166.5	-66.5	176.7	170.7	-175.9	-3	109.4
137	H	31.1	Very low	32	Very low	184 Å²	184	170.3 Å²	170.3	85%	0.852	81%	0.812	S	S	*	*			trans	-156.9	178.1	135.4	-120.4	-90.6	0	0	0	113.7
138	R	31.1	Very low	32.2	Very low	228 Å²	228	170.8 Å²	170.8	86%	0.86	81%	0.814	S	S	*	*			trans	-100.3	137.6	-160.4	-61.9	164.9	167.7	157.7	-7.4	113.8
139	G	29.9	Very low	32.5	Very low	70 Å²	70	173.7 Å²	173.7	72%	0.722	82%	0.815	S	S	*	*			trans	-88.3	-169.4	169.5	0	0	0	0	0	114.8
140	K	33.6	Very low	32.5	Very low	192 Å²	192	174.5 Å²	174.5	84%	0.835	82%	0.816	S	S	*	*			trans	-179.2	127.9	165.8	-106.5	164.4	-175.3	178.5	0	113.4
141	N	31.2	Very low	32.1	Very low	148 Å²	148	177.4 Å²	177.4	79%	0.791	82%	0.818	S	S	*	*			trans	56.2	164.6	146.2	-57.4	-25.2	0	0	0	118.7
142	R	32.6	Very low	32.3	Very low	212 Å²	212	178.5 Å²	178.5	80%	0.8	82%	0.818	S	S	*	*			cis	-170.7	163.2	24.4	-154.3	174.1	169.1	-174	-2.8	111.2
143	K	34.2	Very low	32.3	Very low	179 Å²	179	180.9 Å²	180.9	78%	0.778	82%	0.816	S	S	*	*			trans	72.5	155.6	165.3	-55.1	174.4	-176.2	172.7	0	115.9
144	K	31.2	Very low	32.6	Very low	196 Å²	196	176.2 Å²	176.2	85%	0.852	81%	0.807	S	S	*	*			cis	151.4	110.1	-28.9	-103.3	-165.2	174.2	-170.9	0	109
145	R	35.5	Very low	32.5	Very low	237 Å²	237	173.9 Å²	173.9	89%	0.894	81%	0.807	S	S	*	*			trans	174.2	127.4	145.6	-98.3	160.8	176.6	-179.8	-2.7	106.8
146	H	33.8	Very low	32.5	Very low	175 Å²	175	175.2 Å²	175.2	81%	0.81	80%	0.799	S	S	*	*				54.7	134	67.1	-71.9	-39.4	0	0	0	112.6
147	K	36.4	Very low	32.4	Very low	191 Å²	191	169.8 Å²	169.8	83%	0.83	79%	0.792	S	S	*	*			cis	-163.8	-178.5	25.7	-124.6	170.7	-176	177.5	0	108
148	K	34.6	Very low	32.4	Very low	169 Å²	169	167.3 Å²	167.3	74%	0.735	79%	0.789	S	S	*	*			cis	-166.5	97.8	2.9	167.9	-139.2	172.1	-174.7	0	111.7
149	R	34	Very low	32.5	Very low	243 Å²	243	161.2 Å²	161.2	92%	0.917	79%	0.788	S	S	*	*			trans	64.8	160.6	157.5	-56.5	175.2	173.7	177.4	-4.5	117.1
150	S	31.3	Very low	32.4	Very low	106 Å²	106	161.3 Å²	161.3	74%	0.741	79%	0.789	S	S	*	*			cis	-151.7	165.5	12.6	92.2	0	0	0	0	109.6
151	K	33.9	Very low	32.4	Very low	168 Å²	168	162.7 Å²	162.7	73%	0.73	79%	0.789	S	S	*	*			cis	72.1	105.2	5.1	-136.1	178.6	-171.7	174.8	0	116.3
152	L	32.1	Very low	32.2	Very low	145 Å²	145	166.3 Å²	166.3	76%	0.759	79%	0.792	S	S	*	*				-147.8	144.7	72.9	-105.1	78.3	0	0	0	112.4
153	K	30.9	Very low	32.1	Very low	156 Å²	156	159.8 Å²	159.8	68%	0.678	79%	0.79	S	S	*	*				63.7	127.6	85.9	-68.7	-166	165.9	-159.5	0	115.1
154	I	33.4	Very low	32.6	Very low	143 Å²	143	157 Å²	157	73%	0.733	79%	0.79	S	S	*	*			cis	75.8	112.8	46.5	-58.4	164.3	0	0	0	114.1
155	Q	31.2	Very low	32.6	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	79%	0.793	S	S	*	*				-173.3	-179	129.7	-107.7	176.1	-31.7	0	0	112.9
156	T	28.7	Very low	32.5	Very low	109 Å²	109	153.9 Å²	153.9	67%	0.669	79%	0.787	S	S	*	*				-158	173.6	-94	-59.5	0	0	0	0	109.6
157	V	29.2	Very low	33.1	Very low	127 Å²	127	150.2 Å²	150.2	77%	0.77	78%	0.779	S	S	*	*			trans	83.1	155.5	164.1	-167.5	0	0	0	0	116.1
158	V	31.8	Very low	32.9	Very low	131 Å²	131	149.1 Å²	149.1	79%	0.794	78%	0.777	S	S	*	*				179.8	153.7	-60.5	141.4	0	0	0	0	111.3
159	A	32.2	Very low	32.8	Very low	100 Å²	100	148.5 Å²	148.5	83%	0.826	78%	0.777	S	S	*	*			trans	82.8	117.8	162.2	0	0	0	0	0	122
160	G	28.7	Very low	32.5	Very low	72 Å²	72	145 Å²	145	74%	0.742	77%	0.771	S	S	*	*			trans	-111.7	-152.4	175.4	0	0	0	0	0	117
161	R	33.5	Very low	32.4	Very low	221 Å²	221	144.8 Å²	144.8	83%	0.834	77%	0.769	S	S	*	*			trans	-178.9	141.3	161.9	-107.7	171.6	-174.4	-146.4	0	116
162	R	27.6	Very low	32.1	Very low	225 Å²	225	142.8 Å²	142.8	85%	0.849	78%	0.775	S	S	*	*			trans	70.2	145	152.1	-64.2	179.8	172.6	-176.3	-5.4	121.3
163	G	29.3	Very low	32.1	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	78%	0.777	S	S	*	*			trans	-110.4	-144.4	172.6	0	0	0	0	0	112.5
164	P	45.5	Very low	32.6	Very low	121 Å²	121	139.6 Å²	139.6	79%	0.786	78%	0.777	S	S	*	*			cis	-145	-162.9	11.4	44.7	-24.2	0	0	0	117.2
165	R	30.1	Very low	32.2	Very low	241 Å²	241	140.1 Å²	140.1	91%	0.909	78%	0.779	S	S	*	*			trans	95.1	154.7	154.3	-82.9	178.5	179	167.8	-1	123.3
166	T	33.7	Very low	32.7	Very low	127 Å²	127	136.2 Å²	136.2	78%	0.779	77%	0.77	S	S	*	*			trans	-114.5	-172.9	178.7	54.4	0	0	0	0	111
167	P	47.8	Very low	32.5	Very low	98 Å²	98	136.6 Å²	136.6	64%	0.636	77%	0.772	S	S	*	*				-121.2	-153.4	70.1	21.3	2.1	0	0	0	111.6
168	E	31.4	Very low	32.4	Very low	167 Å²	167	137.4 Å²	137.4	78%	0.78	77%	0.767	S	S	*	*			cis	-141.9	170.1	17	-71.4	169.3	175.9	0	0	108.4
169	Q	31.8	Very low	32.3	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	76%	0.761	S	S	*	*			cis	73.6	136.9	38.8	-78.1	171.2	-95.4	0	0	114.8
170	E	28.3	Very low	32.2	Very low	169 Å²	169	139.4 Å²	139.4	79%	0.79	76%	0.755	S	S	*	*			cis	-147	-171.2	4.1	-150.5	154.5	-101.2	0	0	113.2
171	S	29.5	Very low	32.2	Very low	102 Å²	102	143.5 Å²	143.5	71%	0.713	76%	0.755	S	S	*	*			trans	-144.5	157.9	-166.5	63.2	0	0	0	0	115.9
172	C	28	Very low	31.8	Very low	126 Å²	126	137.1 Å²	137.1	85%	0.851	74%	0.741	S	S	*	*			trans	162.1	167.8	138.4	-90	0	0	0	0	115.5
173	T	31.1	Very low	32	Very low	131 Å²	131	133.3 Å²	133.3	80%	0.804	73%	0.732	S	S	*	*			trans	-103.3	-173	179.3	49.2	0	0	0	0	110.9
174	P	42.2	Very low	31.8	Very low	103 Å²	103	137.4 Å²	137.4	67%	0.669	73%	0.732	S	S	*	*			cis	-149	179.9	13.8	49	-28.9	0	0	0	119.5
175	I	25.6	Very low	30.8	Very low	154 Å²	154	136.5 Å²	136.5	79%	0.79	73%	0.728	S	S	*	*			trans	30.1	137.8	132.5	-66	169.4	0	0	0	119
176	P	40.7	Very low	30.6	Very low	106 Å²	106	130.4 Å²	130.4	69%	0.688	72%	0.718	S	S	*	*			cis	-150.9	178.2	35.8	39.4	-16.6	0	0	0	120.9
177	V	25.3	Very low	30.2	Very low	116 Å²	116	131.1 Å²	131.1	70%	0.703	72%	0.716	S	S	*	*			trans	78.9	129.8	132.5	147.6	0	0	0	0	125.2
178	Q	27	Very low	29	Very low	144 Å²	144	136.4 Å²	136.4	67%	0.673	73%	0.725	S	S	*	*			trans	52.3	154.6	147.5	-67	177.5	-62.1	0	0	121.2
179	E	28.8	Very low	28.8	Very low	141 Å²	141	138.8 Å²	138.8	66%	0.659	73%	0.727	S	S	*	*			cis	-161	172.2	-15.5	-119.2	157.8	-164.5	0	0	110.9
180	D	29.7	Very low	28.4	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	73%	0.729	S	S	*	*			trans	65.3	136.9	146.9	-76.1	8	0	0	0	124.7
181	E	28.8	Very low	28.5	Very low	158 Å²	158	136.5 Å²	136.5	74%	0.738	73%	0.725	S	S	*	*				57	143	128	-63.6	-80.1	118.9	0	0	121.4
182	T	26.7	Very low	28.3	Very low	86 Å²	86	139.3 Å²	139.3	53%	0.528	73%	0.725	S	S	.	*			cis	-164.2	-170.8	-17.3	11.1	0	0	0	0	108.6
183	H	30.3	Very low	28.3	Very low	145 Å²	145	143.7 Å²	143.7	67%	0.671	72%	0.723	S	S	*	*			trans	71.4	104.1	162.5	-61	-72.4	0	0	0	117
184	Q	25.7	Very low	28.2	Very low	161 Å²	161	141.9 Å²	141.9	75%	0.752	71%	0.712	S	S	*	*				82.9	119.7	79.5	-80.5	176.6	-21.5	0	0	115
185	S	24.5	Very low	27.4	Very low	101 Å²	101	142.8 Å²	142.8	71%	0.706	72%	0.721	S	S	*	*			trans	26.3	136.2	141.5	68.3	0	0	0	0	120.1
186	T	25.1	Very low	27.7	Very low	113 Å²	113	143.9 Å²	143.9	69%	0.693	72%	0.722	S	S	*	*				-169.5	145.6	56.2	43	0	0	0	0	114.9
187	L	25.3	Very low	27	Very low	143 Å²	143	145.9 Å²	145.9	75%	0.749	73%	0.727	S	S	*	*			trans	62.2	163.2	133.4	-63	168.6	0	0	0	123.5
188	Y	24.3	Very low	27.2	Very low	208 Å²	208	143 Å²	143	82%	0.816	72%	0.721	S	S	*	*			trans	71.4	84.7	160.7	-73.6	-67.4	0	0	0	121.6
189	R	26.4	Very low	27.4	Very low	218 Å²	218	145 Å²	145	82%	0.823	73%	0.727	S	S	*	*			trans	-27	139.7	132.6	167	-163.7	-79.8	178.6	-5.6	112.9
190	N	23.3	Very low	27.4	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	73%	0.725	S	S	*	*			trans	-142.9	145.9	145.9	-146.3	-5.7	0	0	0	111.5
191	N	29.6	Very low	27.4	Very low	130 Å²	130	144.7 Å²	144.7	70%	0.695	73%	0.729	S	S	*	*			trans	-125	146	-174.9	-89.4	19.4	0	0	0	111.3
192	F	26.1	Very low	27.3	Very low	162 Å²	162	142.7 Å²	142.7	71%	0.711	73%	0.727	S	S	*	*			trans	-165.2	141.7	172.5	-103.2	-76.4	0	0	0	106	V194	F192-V194 HydrophobicContact CD1-CG2 4.27Å; F192-V194 HydrophobicContact CE1-CG2 4.42Å
193	W	28.1	Very low	27.4	Very low	218 Å²	218	149.4 Å²	149.4	83%	0.826	75%	0.745	S	S	*	*			cis	-132.9	138.3	22.3	-85.9	72.1	0	0	0	110.2
194	V	28.4	Very low	27.4	Very low	93 Å²	93	149.3 Å²	149.3	56%	0.564	75%	0.749	S	S	*	*				75.4	118.4	77.4	173.6	0	0	0	0	115.7	F192	F192-V194 HydrophobicContact CD1-CG2 4.27Å; F192-V194 HydrophobicContact CE1-CG2 4.42Å
195	S	26.6	Very low	28.5	Very low	122 Å²	122	146.1 Å²	146.1	85%	0.853	74%	0.742	S	S	*	*			trans	-162.9	138.4	135.7	-76.9	0	0	0	0	109.8
196	E	30.8	Very low	28.7	Very low	177 Å²	177	148.1 Å²	148.1	83%	0.827	74%	0.744	S	S	*	*			trans	-87.5	177.2	179.3	-59.2	169.4	101.2	0	0	110.3
197	L	26.7	Very low	28.8	Very low	148 Å²	148	149.2 Å²	149.2	78%	0.775	75%	0.745	S	S	*	*			cis	-162.2	157.1	20.9	-174.4	72.2	0	0	0	108
198	G	28.4	Very low	29	Very low	56 Å²	56	150.5 Å²	150.5	58%	0.577	75%	0.745	S	S	*	*			cis	138	140.3	-6.8	0	0	0	0	0	113.4
199	K	32.2	Very low	29.1	Very low	185 Å²	185	148.7 Å²	148.7	80%	0.804	74%	0.744	S	S	*	*			trans	72	146.5	168.8	-62.5	-173.7	170.4	-170.7	0	117.9
200	D	29.4	Very low	29.3	Very low	117 Å²	117	147.4 Å²	147.4	63%	0.626	75%	0.745	S	S	*	*			cis	-161.9	158	-7.7	-112.1	-23.5	0	0	0	113.4
201	L	28.7	Very low	30	Very low	150 Å²	150	146.9 Å²	146.9	79%	0.785	75%	0.749	S	S	*	*			trans	72.7	135.6	142.5	-73	167.9	0	0	0	125.8
202	V	27.6	Very low	30	Very low	117 Å²	117	143.9 Å²	143.9	71%	0.709	75%	0.749	S	S	*	*			trans	101.9	106.7	135.3	165.6	0	0	0	0	122.8
203	Y	27.9	Very low	30.1	Very low	227 Å²	227	146 Å²	146	89%	0.89	76%	0.758	S	S	*	*			trans	63.2	137.5	140.7	-80.9	-103.5	0	0	0	126.1
204	D	30.8	Very low	30.2	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	75%	0.752	S	S	*	*			trans	-74.6	177.6	161.2	-148.6	29.8	0	0	0	110.5
205	P	48.1	Very low	30.3	Very low	94 Å²	94	144.4 Å²	144.4	61%	0.61	77%	0.765	S	S	*	*			cis	-148.4	-168.7	12.5	43.2	-20.4	0	0	0	118.7
206	L	29.1	Very low	30.3	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	76%	0.763	S	S	*	*			trans	83.8	110.7	154	-66.3	171.3	0	0	0	123.2
207	L	27.4	Very low	30.4	Very low	136 Å²	136	140.3 Å²	140.3	71%	0.712	76%	0.762	S	S	*	*				36.8	119.4	114.8	-99.6	162	0	0	0	121.3
208	F	29.2	Very low	30.5	Very low	169 Å²	169	136.7 Å²	136.7	74%	0.741	76%	0.76	S	S	*	*				177.2	147.3	104.9	-113.2	-86.7	0	0	0	116.9
209	E	25.6	Very low	30.6	Very low	171 Å²	171	144.1 Å²	144.1	80%	0.799	78%	0.777	S	S	*	*			trans	62.7	168.9	147.6	-105.7	164.7	-145.8	0	0	127.7
210	K	31.3	Very low	30.4	Very low	191 Å²	191	142.1 Å²	142.1	83%	0.83	77%	0.774	S	S	*	*			trans	-123.6	166.6	-176.5	-48.3	172	-179.1	172.8	0	109.1
211	P	38.5	Very low	30.4	Very low	135 Å²	135	144.4 Å²	144.4	88%	0.877	78%	0.78	S	S	*	*				-148.4	-179.1	83.5	32.8	-11.6	0	0	0	113.4
212	G	29.1	Very low	30.9	Very low	67 Å²	67	142.4 Å²	142.4	69%	0.691	78%	0.777	S	S	*	*			cis	158.7	174.4	-5.8	0	0	0	0	0	112.3
213	K	29.4	Very low	31.8	Very low	207 Å²	207	142.1 Å²	142.1	90%	0.9	78%	0.777	S	S	*	*			trans	78.9	144.5	172.1	-69.9	-175.8	178.9	178.7	0	119.6
214	V	29.7	Very low	31.7	Very low	115 Å²	115	142.6 Å²	142.6	70%	0.697	78%	0.777	S	S	*	*			cis	-168.4	138.4	-26.5	107.8	0	0	0	0	112.7
215	L	30.2	Very low	31.5	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	77%	0.773	S	S	*	*			trans	57	157.4	155.8	-62.6	171.7	0	0	0	120
216	S	27.2	Very low	30.5	Very low	117 Å²	117	145.4 Å²	145.4	82%	0.818	79%	0.788	S	S	*	*			cis	-140.5	176.2	25.8	61.6	0	0	0	0	116.6
217	A	32.3	Very low	30.5	Very low	97 Å²	97	149.1 Å²	149.1	80%	0.802	79%	0.794	S	S	*	*			trans	-82.2	168.7	-172.5	0	0	0	0	0	114.4
218	G	28	Very low	30.4	Very low	71 Å²	71	151.6 Å²	151.6	73%	0.732	80%	0.799	S	S	*	*			cis	133.9	156.6	-2	0	0	0	0	0	113.8
219	K	30.4	Very low	30.2	Very low	212 Å²	212	148.9 Å²	148.9	92%	0.922	80%	0.796	S	S	*	*			trans	-166.1	160.2	166.3	-111.2	168.5	-175.1	178.7	0	111.4
220	L	28.9	Very low	30	Very low	144 Å²	144	148.6 Å²	148.6	75%	0.754	80%	0.795	S	S	*	*			trans	-99.8	173.4	-177.7	-46.9	96	0	0	0	110.3
221	H	29.9	Very low	29.8	Very low	164 Å²	164	147.1 Å²	147.1	76%	0.759	80%	0.795	S	S	*	*			cis	-155.9	-172.4	30.1	-113.6	-45.4	0	0	0	111.1
222	P	38	Very low	29.1	Very low	109 Å²	109	149.8 Å²	149.8	71%	0.708	80%	0.796	S	S	*	*			trans	-122.7	-141.6	-146.7	33.7	-8.3	0	0	0	114.5
223	P	46.6	Very low	28.8	Very low	110 Å²	110	155.6 Å²	155.6	71%	0.714	80%	0.802	S	S	*	*				-127.3	174.9	-77.1	37	-21.7	0	0	0	115.3
224	R	26.3	Very low	28.8	Very low	238 Å²	238	153.6 Å²	153.6	90%	0.898	80%	0.8	S	S	*	*			trans	-177.7	109.7	144.3	-100.7	156.3	179.9	-169.1	-0.4	108.6
225	S	26.3	Very low	28.6	Very low	95 Å²	95	152.9 Å²	152.9	66%	0.664	79%	0.792	S	S	*	*				67.5	90.2	67.9	78	0	0	0	0	114.6
226	Q	28.5	Very low	28.7	Very low	201 Å²	201	147.9 Å²	147.9	94%	0.939	77%	0.77	S	S	*	*			trans	-101.7	142.1	158.7	-76.1	-179.6	-26.2	0	0	109.2
227	Y	27	Very low	29.1	Very low	221 Å²	221	146.9 Å²	146.9	87%	0.867	76%	0.761	S	S	*	*			trans	-119.7	142.5	178.5	-96.3	-83.9	0	0	0	110.7
228	K	25.6	Very low	29.2	Very low	187 Å²	187	147.2 Å²	147.2	81%	0.813	75%	0.753	S	S	*	*			trans	-82.3	162.6	152.3	-67.6	-178.1	171.9	-176.4	0	109
229	T	25.4	Very low	29.5	Very low	113 Å²	113	149 Å²	149	69%	0.693	74%	0.742	S	S	*	*			cis	-123.9	-117.9	-1.9	-24.1	0	0	0	0	110.7
230	E	21.8	Very low	29.7	Very low	165 Å²	165	142.1 Å²	142.1	77%	0.771	72%	0.719	S	S	*	*			cis	-157	171.2	-3.4	-151.2	118.5	-88	0	0	111.3
231	L	27.4	Very low	30	Very low	159 Å²	159	139.6 Å²	139.6	83%	0.832	71%	0.706	S	S	*	*			trans	-93.4	143.9	-174.4	-82.7	155.6	0	0	0	113.8
232	H	23.1	Very low	30.2	Very low	191 Å²	191	137 Å²	137	88%	0.884	70%	0.698	S	S	*	*			trans	-137.1	160.1	159.9	-78.7	-56.4	0	0	0	112.2
233	K	23.7	Very low	29.9	Very low	190 Å²	190	137.6 Å²	137.6	83%	0.826	69%	0.691	S	S	*	*			trans	-114.6	157.2	-165.5	-78.2	-174.5	173.4	-175.9	0	113.6
234	L	29	Very low	29.4	Very low	165 Å²	165	135.7 Å²	135.7	86%	0.864	68%	0.677	S	S	*	*			trans	60.8	103.1	150.9	-71.3	163.6	0	0	0	118.1
235	I	25.4	Very low	29.7	Very low	100 Å²	100	135 Å²	135	51%	0.513	68%	0.675	S	S	.	*			trans	-139.9	143.6	162	-61.6	-175	0	0	0	107.4	Q239	I235-Q239 HydrophobicContact CG2-CB 3.52Å
236	S	31.6	Very low	29.9	Very low	56 Å²	56	138.9 Å²	138.9	39%	0.392	68%	0.68	S	S	.	*			trans	-100.5	161.1	175.7	86.6	0	0	0	0	112.8	V238 Q239 C240	S236-V238 VanDerWaalsContact C-N 3.25Å; S236-V238 PolarHBondContact O-N 2.96Å; S236-V238 VanDerWaalsContact O-N 3.08Å; S236-Q239 WeakPolarHBondContact O-CB 3.49Å; S236-Q239 PolarHBondContact O-N 3.35Å; S236-C240 PolarHBondContact O-N 2.65Å
237	P	35.3	Very low	29.9	Very low	96 Å²	96	139.5 Å²	139.5	62%	0.623	67%	0.673	S	S	*	*	H	α-helix	trans	-54.6	-34.6	-173.5	-29.2	36.3	0	0	0	115.2	Q239 C240	P237-Q239 PolarHBondContact O-N 2.9Å; P237-C240 PolarHBondContact O-N 3.25Å
238	V	35.3	Very low	30.3	Very low	105 Å²	105	136.4 Å²	136.4	64%	0.636	67%	0.667	S	S	*	*	H	α-helix	trans	-66.9	-24.4	178.4	-178	0	0	0	0	112.4	S236 N242	S236-V238 VanDerWaalsContact C-N 3.25Å; S236-V238 PolarHBondContact O-N 2.96Å; S236-V238 VanDerWaalsContact O-N 3.08Å; V238-N242 PolarHBondContact O-ND2 3.46Å
239	Q	33.5	Very low	30.8	Very low	109 Å²	109	137.9 Å²	137.9	51%	0.509	67%	0.669	S	S	.	*	H	α-helix	trans	-83.9	-28.4	176.8	-66.3	173.1	-44.8	0	0	112.2	I235 S236 P237 N242 H243	I235-Q239 HydrophobicContact CG2-CB 3.52Å; S236-Q239 WeakPolarHBondContact O-CB 3.49Å; S236-Q239 PolarHBondContact O-N 3.35Å; P237-Q239 PolarHBondContact O-N 2.9Å; Q239-N242 PolarHBondContact O-N 3.49Å; Q239-H243 PolarHBondContact O-N 2.86Å
240	C	34.4	Very low	31	Very low	66 Å²	66	142.5 Å²	142.5	45%	0.446	68%	0.682	S	S	.	*	H	α-helix	trans	-60.8	-45.1	175.2	-63.9	0	0	0	0	111.9	S236 P237 N242 H243 V244	S236-C240 PolarHBondContact O-N 2.65Å; P237-C240 PolarHBondContact O-N 3.25Å; C240-N242 VanDerWaalsContact C-N 3.29Å; C240-N242 PolarHBondContact O-N 2.88Å; C240-H243 PolarHBondContact O-N 3.34Å; C240-V244 PolarHBondContact O-N 2.73Å; C240-V244 VanDerWaalsContact O-N 3.11Å
241	L	36	Very low	31.3	Very low	92 Å²	92	137.7 Å²	137.7	48%	0.482	68%	0.678	S	S	.	*	H	α-helix	trans	-54.2	-43.1	174.9	-79.1	157.7	0	0	0	112.4	W245 Y333	L241-W245 PolarHBondContact O-N 3.1Å; L241-Y333 HydrophobicContact CD2-CE1 4.17Å
242	N	33.3	Very low	31.4	Very low	110 Å²	110	137.6 Å²	137.6	59%	0.588	68%	0.678	S	S	*	*	H	α-helix	trans	-71.9	-26.4	176.7	-81.9	-74.5	0	0	0	113.6	V238 Q239 C240	V238-N242 PolarHBondContact O-ND2 3.46Å; Q239-N242 PolarHBondContact O-N 3.49Å; C240-N242 VanDerWaalsContact C-N 3.29Å; C240-N242 PolarHBondContact O-N 2.88Å
243	H	31.6	Very low	31.9	Very low	121 Å²	121	133.7 Å²	133.7	56%	0.56	67%	0.672	S	S	*	*	H	α-helix	trans	-75.4	-39.5	178.4	-162.5	-17.4	0	0	0	112	Q239 C240 K246	Q239-H243 PolarHBondContact O-N 2.86Å; C240-H243 PolarHBondContact O-N 3.34Å; H243-K246 PolarHBondContact O-N 3.3Å
244	V	36.9	Very low	32.2	Very low	70 Å²	70	131.3 Å²	131.3	42%	0.424	67%	0.673	S	S	.	*	H	α-helix	trans	-65.4	-41.7	176.2	178.4	0	0	0	0	110.9	C240 K246 R247	C240-V244 PolarHBondContact O-N 2.73Å; C240-V244 VanDerWaalsContact O-N 3.11Å; V244-K246 PolarHBondContact O-N 2.82Å; V244-K246 VanDerWaalsContact O-N 3.16Å; V244-R247 WeakPolarHBondContact O-CB 3.47Å; V244-R247 PolarHBondContact O-N 2.78Å
245	W	32.3	Very low	32.5	Very low	222 Å²	222	129.2 Å²	129.2	84%	0.841	67%	0.669	S	S	*	*	H	α-helix	trans	-60.3	-28.8	-179.4	-145	-69.6	0	0	0	113.6	L241 R247	L241-W245 PolarHBondContact O-N 3.1Å; W245-R247 VanDerWaalsContact C-N 3.32Å; W245-R247 PolarHBondContact O-N 3.37Å
246	K	30.6	Very low	32.8	Very low	178 Å²	178	132.9 Å²	132.9	77%	0.774	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-77	-10.2	174.6	-77.5	-170	174	-176	0	114.7	H243 V244	H243-K246 PolarHBondContact O-N 3.3Å; V244-K246 PolarHBondContact O-N 2.82Å; V244-K246 VanDerWaalsContact O-N 3.16Å
247	R	28.9	Very low	32.9	Very low	213 Å²	213	135.8 Å²	135.8	80%	0.804	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-84.8	-12.1	-174.4	-128.2	178	-168.8	170.6	4.1	114.5	V244 W245	V244-R247 WeakPolarHBondContact O-CB 3.47Å; V244-R247 PolarHBondContact O-N 2.78Å; W245-R247 VanDerWaalsContact C-N 3.32Å; W245-R247 PolarHBondContact O-N 3.37Å
248	H	34.5	Very low	32.6	Very low	157 Å²	157	139 Å²	139	73%	0.727	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-97.2	1.7	-175.3	-84.2	-77.1	0	0	0	116
249	Y	36.5	Very low	32.3	Very low	218 Å²	218	139.9 Å²	139.9	86%	0.855	71%	0.714	S	S	*	*			trans	-144.2	99.1	171.7	-86.8	-80.1	0	0	0	112.1
250	Q	29.4	Very low	32	Very low	209 Å²	209	142.8 Å²	142.8	98%	0.977	73%	0.732	S	S	*	*			trans	-162.8	145.1	143.7	-115.1	169.5	10.5	0	0	113
251	G	28.5	Very low	31.8	Very low	65 Å²	65	148.2 Å²	148.2	67%	0.67	75%	0.751	S	S	*	*			trans	126.7	104.9	-162.2	0	0	0	0	0	108.1
252	D	30.2	Very low	32.5	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	76%	0.757	S	S	*	*			cis	-135.5	159.6	14.3	-79.7	-47.8	0	0	0	115.2
253	S	33.4	Very low	32.3	Very low	108 Å²	108	152.9 Å²	152.9	76%	0.755	77%	0.772	S	S	*	*			trans	42	123.4	149.9	67.7	0	0	0	0	122.5
254	V	29.3	Very low	33.4	Very low	140 Å²	140	151.7 Å²	151.7	85%	0.848	78%	0.775	S	S	*	*				-170.3	148.9	128	133.2	0	0	0	0	109
255	P	35.3	Very low	33.1	Very low	121 Å²	121	159 Å²	159	79%	0.786	80%	0.796	S	S	*	*			trans	-86.4	176.1	-161.2	33.4	-38.5	0	0	0	117.4
256	Q	31	Very low	32.9	Very low	177 Å²	177	155 Å²	155	83%	0.827	79%	0.791	S	S	*	*			trans	-64.4	167.3	-178.9	-56.3	-174.8	-11.4	0	0	114.4
257	P	34.8	Very low	32.8	Very low	117 Å²	117	154.3 Å²	154.3	76%	0.76	80%	0.795	S	S	*	*				-142.4	146.6	94.2	38.3	-24.6	0	0	0	117.7
258	E	28.6	Very low	32.8	Very low	165 Å²	165	151.5 Å²	151.5	77%	0.771	79%	0.794	S	S	*	*			trans	36.9	112.3	136.8	-59.3	-174.1	144.5	0	0	123.5
259	T	29.8	Very low	33.7	Very low	122 Å²	122	149.3 Å²	149.3	75%	0.748	79%	0.794	S	S	*	*			trans	36.8	128.4	131.1	62.3	0	0	0	0	123
260	L	27.6	Very low	34.5	Very low	170 Å²	170	143.6 Å²	143.6	89%	0.89	78%	0.783	S	S	*	*				-172.1	178.3	106.7	-102.1	166.1	0	0	0	113.7
261	H	30	Very low	34.4	Very low	181 Å²	181	141 Å²	141	84%	0.838	77%	0.771	S	S	*	*			trans	-102.5	172.8	-165.3	-96.4	-56.9	0	0	0	114.9
262	P	50.3	Low	34.4	Very low	93 Å²	93	146.9 Å²	146.9	60%	0.604	78%	0.778	S	S	*	*			trans	-107.5	174.7	-153.1	42.4	-39.3	0	0	0	116.3
263	F	29.5	Very low	35.1	Very low	206 Å²	206	144.4 Å²	144.4	90%	0.904	77%	0.77	S	S	*	*				-177.4	176.2	128	-94	-49.9	0	0	0	111.2
264	P	54.6	Low	35.8	Very low	96 Å²	96	144.2 Å²	144.2	62%	0.623	77%	0.767	S	S	*	*			trans	-115.6	-174.8	-154.6	43.5	-31	0	0	0	114.2
265	Y	29.8	Very low	35.9	Very low	223 Å²	223	144.8 Å²	144.8	88%	0.875	76%	0.764	S	S	*	*			trans	-170.5	159.6	136.2	-96.4	-56	0	0	0	115.2
266	N	28	Very low	35.4	Very low	139 Å²	139	146.3 Å²	146.3	74%	0.743	77%	0.766	S	S	*	*			trans	-75.6	-179	-173.7	-61	-41.2	0	0	0	116.8
267	I	28.3	Very low	35.6	Very low	164 Å²	164	143.1 Å²	143.1	84%	0.841	76%	0.763	S	S	*	*			trans	105.5	147.2	149.2	-66.4	146.8	0	0	0	118.9
268	I	28.9	Very low	36.3	Very low	153 Å²	153	142.7 Å²	142.7	79%	0.785	76%	0.76	S	S	*	*			trans	-146.2	177.9	-175.9	3.5	171.8	0	0	0	107.8
269	P	53.3	Low	36.2	Very low	112 Å²	112	142 Å²	142	73%	0.727	76%	0.761	S	S	*	*			cis	-115.3	-104.4	-22.6	35.2	-14.5	0	0	0	109.4
270	P	53.3	Low	36.1	Very low	97 Å²	97	144.8 Å²	144.8	63%	0.63	77%	0.765	S	S	*	*			cis	-100.9	-144.6	-48.8	14.6	11.6	0	0	0	111.4
271	H	28.3	Very low	36.1	Very low	156 Å²	156	140.7 Å²	140.7	72%	0.722	76%	0.756	S	S	*	*			cis	-157.7	122.3	10.6	-120.5	-51.2	0	0	0	114.2
272	F	28.5	Very low	35.9	Very low	187 Å²	187	140.5 Å²	140.5	82%	0.82	76%	0.757	S	S	*	*			trans	69.9	161.2	130.8	-83.8	-118.1	0	0	0	125
273	P	44.3	Very low	34.8	Very low	105 Å²	105	145.1 Å²	145.1	68%	0.682	77%	0.768	S	S	*	*			trans	-120.6	-147.1	-161.1	47	-32.1	0	0	0	112.7
274	P	48.8	Very low	34.6	Very low	104 Å²	104	143.5 Å²	143.5	68%	0.675	77%	0.768	S	S	*	*			cis	-141.2	-177.8	-9.7	41.8	-21.4	0	0	0	118.7
275	L	30.9	Very low	33.3	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	78%	0.777	S	S	*	*			trans	51.7	133.7	147.6	-101.4	74.7	0	0	0	124.4
276	D	25.7	Very low	33.4	Very low	153 Å²	153	139 Å²	139	82%	0.818	76%	0.764	S	S	*	*				-173.4	179.9	108.9	-105.9	-19.2	0	0	0	113.8
277	S	33.4	Very low	33.4	Very low	110 Å²	110	141 Å²	141	77%	0.769	77%	0.774	S	S	*	*			trans	-153.3	-165.7	-172.3	-57.8	0	0	0	0	111.5
278	P	50.2	Low	33.3	Very low	109 Å²	109	136.1 Å²	136.1	71%	0.708	76%	0.764	S	S	*	*			cis	-136.8	-170.5	-12.8	29.3	-4.1	0	0	0	115.6
279	L	26.6	Very low	33.3	Very low	149 Å²	149	134.8 Å²	134.8	78%	0.78	76%	0.763	S	S	*	*			trans	136.7	113.7	135.2	-68.7	172.5	0	0	0	120.8
280	H	27.9	Very low	32.1	Very low	181 Å²	181	138.9 Å²	138.9	84%	0.838	77%	0.766	S	S	*	*			trans	58.6	126.7	133.7	-91.8	-58.5	0	0	0	129
281	A	27.2	Very low	30.9	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	77%	0.771	S	S	*	*				96.4	92.3	119	0	0	0	0	0	125.9
282	M	25.8	Very low	30.8	Very low	177 Å²	177	142.8 Å²	142.8	87%	0.872	77%	0.773	S	S	*	*				54.3	115.6	113.7	-148.2	-169.4	-148	0	0	124.7
283	K	26.5	Very low	30.7	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.826	77%	0.769	S	S	*	*				153	136.7	121.9	-93.6	-171.5	173.4	178.1	0	115.7
284	L	27	Very low	29.9	Very low	173 Å²	173	138.8 Å²	138.8	91%	0.906	77%	0.771	S	S	*	*			trans	-175.7	-179.5	130.4	-107.3	166.1	0	0	0	112.8
285	N	25.8	Very low	28.7	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	78%	0.776	S	S	*	*			trans	-154.8	149.1	-157.7	-145.8	15.6	0	0	0	116.1
286	A	31.7	Very low	28.3	Very low	74 Å²	74	141.1 Å²	141.1	61%	0.612	77%	0.771	S	S	*	*			trans	70.6	131.6	146.3	0	0	0	0	0	125.5
287	L	29	Very low	28.2	Very low	181 Å²	181	143.1 Å²	143.1	95%	0.948	77%	0.768	S	S	*	*			trans	61.6	150.1	145.5	-58.8	163.9	0	0	0	120.3
288	G	26.2	Very low	27.8	Very low	61 Å²	61	145.9 Å²	145.9	63%	0.629	77%	0.769	S	S	*	*			cis	132.3	138	-6.5	0	0	0	0	0	113.8
289	T	28.5	Very low	26.5	Very low	126 Å²	126	148 Å²	148	77%	0.773	77%	0.774	S	S	*	*			trans	178.8	148	165	32.2	0	0	0	0	117.9
290	Y	27.8	Very low	26.4	Very low	198 Å²	198	146.2 Å²	146.2	78%	0.776	77%	0.774	S	S	*	*			trans	40	150.1	143.5	-64.5	-60.5	0	0	0	124.7
291	F	28	Very low	26.2	Very low	169 Å²	169	145.4 Å²	145.4	74%	0.741	77%	0.771	S	S	*	*			cis	-172.2	172.3	-23.1	-134.9	-140	0	0	0	113.3
292	H	27.5	Very low	26.1	Very low	166 Å²	166	147.8 Å²	147.8	77%	0.769	77%	0.767	S	S	*	*			trans	1.6	155.4	166	-83.3	-60.6	0	0	0	124.8
293	G	25.3	Very low	26.1	Very low	72 Å²	72	148.7 Å²	148.7	74%	0.742	76%	0.761	S	S	*	*			trans	159.6	66.9	141.4	0	0	0	0	0	122.9
294	D	27.3	Very low	25.9	Very low	135 Å²	135	146.2 Å²	146.2	72%	0.722	76%	0.756	S	S	*	*			trans	31.3	128.3	140.7	-76.2	20.2	0	0	0	126.1
295	F	23.8	Very low	25.8	Very low	176 Å²	176	142.1 Å²	142.1	77%	0.772	74%	0.742	S	S	*	*			trans	72.9	144.4	136.4	-85.5	-77.8	0	0	0	125.3
296	N	22.9	Very low	25.7	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	74%	0.741	S	S	*	*			trans	99.4	108.8	139.2	-83.9	-21.9	0	0	0	123.5
297	Y	24.2	Very low	25.5	Very low	196 Å²	196	144.9 Å²	144.9	77%	0.769	76%	0.755	S	S	*	*				95.5	134.1	121.8	-114.8	-117.9	0	0	0	123.2
298	Q	23.7	Very low	25.3	Very low	167 Å²	167	143 Å²	143	78%	0.78	75%	0.745	S	S	*	*			trans	89	124.5	139.8	-127.7	164.3	-2.2	0	0	123.1
299	N	23.5	Very low	25.4	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	76%	0.758	S	S	*	*			trans	-60.8	145	164	-60	-37.5	0	0	0	113.1
300	S	24	Very low	25.2	Very low	112 Å²	112	150 Å²	150	78%	0.783	76%	0.758	S	S	*	*			trans	-165.6	116.2	135.4	2.4	0	0	0	0	107.5
301	E	24.3	Very low	25.2	Very low	164 Å²	164	146 Å²	146	77%	0.766	76%	0.758	S	S	*	*				94.6	109.5	75.1	-84.7	-132.3	128.5	0	0	113.5
302	H	25.9	Very low	25	Very low	134 Å²	134	143.3 Å²	143.3	62%	0.62	76%	0.76	S	S	*	*				65.5	137.6	128.8	-93.2	-35	0	0	0	123.7
303	R	24.8	Very low	24.9	Very low	197 Å²	197	144.9 Å²	144.9	74%	0.743	77%	0.765	S	S	*	*			trans	76.2	153.5	141.8	-65.4	167	-172.2	-120.4	4.4	116.3
304	L	23.5	Very low	25.2	Very low	137 Å²	137	147.4 Å²	147.4	72%	0.717	77%	0.768	S	S	*	*			cis	-155.5	166.7	-6.4	-122.7	165.4	0	0	0	111.4
305	S	23.8	Very low	25.2	Very low	87 Å²	87	152.5 Å²	152.5	61%	0.608	78%	0.777	S	S	*	*			trans	50.7	114.1	149.4	58.9	0	0	0	0	121.1
306	S	24.9	Very low	25.2	Very low	113 Å²	113	149.9 Å²	149.9	79%	0.79	78%	0.779	S	S	*	*				43.1	128	111.2	-41.1	0	0	0	0	120.6
307	L	26.9	Very low	25.4	Very low	170 Å²	170	149.5 Å²	149.5	89%	0.89	78%	0.781	S	S	*	*				-159.6	159.8	118.2	-107.3	167.7	0	0	0	111.3
308	N	25.1	Very low	25.5	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	79%	0.785	S	S	*	*			trans	-97.6	158.4	-174	-61.1	-47.7	0	0	0	112.4
309	L	27.4	Very low	25.7	Very low	169 Å²	169	148.5 Å²	148.5	89%	0.885	79%	0.788	S	S	*	*			trans	-150.6	91.2	141.8	-116.5	139.1	0	0	0	112
310	E	25.1	Very low	25.8	Very low	165 Å²	165	146.4 Å²	146.4	77%	0.771	79%	0.786	S	S	*	*			trans	13.1	124.9	142.9	-52.4	-178.7	139.2	0	0	120
311	C	26.6	Very low	26	Very low	115 Å²	115	147.1 Å²	147.1	78%	0.777	79%	0.785	S	S	*	*				-178.7	123.3	94	-106.8	0	0	0	0	115.1
312	S	24.4	Very low	26.3	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	79%	0.788	S	S	*	*			trans	32.4	102.8	139.3	-48	0	0	0	0	121.7
313	F	26.2	Very low	26.6	Very low	199 Å²	199	148.1 Å²	148.1	87%	0.873	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83.8	152.1	149	-78.2	-92.5	0	0	0	111.2
314	P	30.5	Very low	27	Very low	125 Å²	125	142.4 Å²	142.4	81%	0.812	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-95.1	140	131.5	-20.1	34.9	0	0	0	111.7
315	R	28.3	Very low	28	Very low	241 Å²	241	141.4 Å²	141.4	91%	0.909	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-82.2	147.8	-177.6	-65.5	168.8	169.8	157.1	-6.3	111.9
316	C	23.8	Very low	29.2	Very low	121 Å²	121	143 Å²	143	82%	0.818	79%	0.793	S	S	*	*			trans	-141.7	121.7	134.6	-148.5	0	0	0	0	111.7
317	V	26.9	Very low	30.5	Very low	121 Å²	121	147.4 Å²	147.4	73%	0.733	80%	0.798	S	S	*	*			trans	2.8	110.9	172.4	-170.4	0	0	0	0	118.4
318	N	26.2	Very low	31.9	Very low	160 Å²	160	145 Å²	145	86%	0.856	78%	0.784	S	S	*	*			trans	-73.4	130.4	153.5	-73.2	-11	0	0	0	109.7
319	Q	28.2	Very low	34.6	Very low	182 Å²	182	141 Å²	141	85%	0.85	77%	0.768	S	S	*	*			trans	-105.7	123.1	145.7	-79.1	-169.8	-15.7	0	0	108	V321	Q319-V321 PolarHBondContact O-N 3.15Å
320	S	25.9	Very low	37.2	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	76%	0.763	S	S	*	*			trans	-82	105.9	-174.1	-173.8	0	0	0	0	110.5	K322	S320-K322 PolarHBondContact O-N 2.89Å
321	V	28.4	Very low	39.7	Very low	126 Å²	126	134.9 Å²	134.9	76%	0.764	74%	0.743	S	S	*	*			trans	-73.2	108	162.3	178.1	0	0	0	0	107.2	Q319 T323	Q319-V321 PolarHBondContact O-N 3.15Å; V321-T323 PolarHBondContact O-N 2.86Å
322	K	28.9	Very low	42.3	Very low	190 Å²	190	134 Å²	134	83%	0.826	73%	0.727	S	S	*	*			trans	-68.5	109.3	167.5	-71.7	-175.9	177.9	179.5	0	108.5	S320 S324	S320-K322 PolarHBondContact O-N 2.89Å; K322-S324 PolarHBondContact O-N 3.06Å
323	T	32	Very low	45.2	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	71%	0.71	S	S	*	*			trans	-80.3	87.9	163.7	41.5	0	0	0	0	109.4	V321	V321-T323 PolarHBondContact O-N 2.86Å
324	S	34.7	Very low	47.9	Very low	77 Å²	77	126.6 Å²	126.6	54%	0.538	68%	0.681	S	S	.	*			trans	-67.3	126	157	44.3	0	0	0	0	108.2	K322 D326	K322-S324 PolarHBondContact O-N 3.06Å; S324-D326 WeakPolarHBondContact CB-OD2 3.37Å; S324-D326 PolarHBondContact O-N 2.9Å; S324-D326 PolarHBondContact OG-OD2 3Å
325	S	44.6	Very low	50.6	Low	115 Å²	115	121 Å²	121	80%	0.804	65%	0.645	S	S	*	*			trans	-84.8	63	174.2	48.7	0	0	0	0	109.7	K327	S325-K327 PolarHBondContact O-N 3.08Å; S325-K327 VanDerWaalsContact O-N 3.07Å
326	D	47.5	Very low	53.2	Low	121 Å²	121	114.3 Å²	114.3	65%	0.647	63%	0.627	S	S	*	*			trans	-66.2	109.1	-176.3	-62.7	-48.6	0	0	0	109.8	S324 I328	S324-D326 WeakPolarHBondContact CB-OD2 3.37Å; S324-D326 PolarHBondContact O-N 2.9Å; S324-D326 PolarHBondContact OG-OD2 3Å; D326-I328 VanDerWaalsContact C-N 3.33Å; D326-I328 PolarHBondContact O-N 2.97Å
327	K	52.5	Low	56	Low	205 Å²	205	111.6 Å²	111.6	89%	0.891	61%	0.613	S	S	*	*			trans	-76.3	87.4	175.5	-70.4	-176.4	178	-179	0	108.8	S325 S329	S325-K327 PolarHBondContact O-N 3.08Å; S325-K327 VanDerWaalsContact O-N 3.07Å; K327-S329 PolarHBondContact O-N 3.42Å
328	I	57.5	Low	58.9	Low	120 Å²	120	106.5 Å²	106.5	62%	0.615	58%	0.582	S	S	*	*			trans	-42.3	131.1	168.1	-65.5	173.7	0	0	0	109.1	D326 E332	D326-I328 VanDerWaalsContact C-N 3.33Å; D326-I328 PolarHBondContact O-N 2.97Å; I328-E332 HydrophobicContact CG2-CB 4.14Å; I328-E332 HydrophobicContact CG2-CG 3.92Å
329	S	81.7	Confident	61.8	Low	57 Å²	57	103.3 Å²	103.3	40%	0.399	56%	0.56	S	S	.	*			trans	-76.5	156.3	-174.7	72	0	0	0	0	112	K327 E331 E332 Y333	K327-S329 PolarHBondContact O-N 3.42Å; S329-E331 PolarHBondContact O-N 2.93Å; S329-E332 PolarHBondContact N-OE2 2.68Å; S329-E332 PolarHBondContact O-N 3.5Å; S329-E332 WeakPolarHBondContact OG-CB 3.43Å; S329-E332 PolarHBondContact OG-N 2.73Å; S329-E332 VanDerWaalsContact OG-N 3.15Å; S329-Y333 PolarHBondContact O-N 3.47Å
330	V	80.4	Confident	64.6	Low	129 Å²	129	97.4 Å²	97.4	78%	0.782	55%	0.548	S	S	*	.	H	α-helix	trans	-63.3	-32.7	177.1	-178.9	0	0	0	0	111.3	L334	V330-L334 WeakPolarHBondContact O-CB 3.41Å; V330-L334 PolarHBondContact O-N 2.91Å
331	E	78	Confident	67.6	Low	76 Å²	76	93.3 Å²	93.3	36%	0.355	52%	0.519	S	S	.	.	H	α-helix	trans	-67.7	-42.5	175	-178.6	166.8	-161.1	0	0	111.9	S329 L334 V335 S352 K355	S329-E331 PolarHBondContact O-N 2.93Å; E331-L334 WeakPolarHBondContact O-CB 3.15Å; E331-L334 PolarHBondContact O-N 2.68Å; E331-V335 WeakPolarHBondContact O-CB 3.14Å; E331-V335 WeakPolarHBondContact O-CG2 3.47Å; E331-V335 PolarHBondContact O-N 2.79Å; E331-S352 WeakPolarHBondContact OE1-CB 3.22Å; E331-S352 PolarHBondContact OE1-OG 3.29Å; E331-K355 WeakPolarHBondContact OE1-CD 3.48Å; E331-K355 WeakPolarHBondContact OE1-CE 3.28Å; E331-K355 IonicContact OE1-NZ 2.66Å; E331-K355 PolarHBondContact OE1-NZ 2.92Å; E331-K355 IonicContact OE2-NZ 3.57Å
332	E	82.2	Confident	70.8	Confident	97 Å²	97	87.3 Å²	87.3	45%	0.453	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-42.7	177.4	-176.7	175.1	-155.7	0	0	112	I328 S329 V335 D336	I328-E332 HydrophobicContact CG2-CB 4.14Å; I328-E332 HydrophobicContact CG2-CG 3.92Å; S329-E332 PolarHBondContact N-OE2 2.68Å; S329-E332 PolarHBondContact O-N 3.5Å; S329-E332 WeakPolarHBondContact OG-CB 3.43Å; S329-E332 PolarHBondContact OG-N 2.73Å; S329-E332 VanDerWaalsContact OG-N 3.15Å; E332-V335 PolarHBondContact O-N 2.92Å; E332-D336 PolarHBondContact O-N 3.12Å
333	Y	84.5	Confident	73.9	Confident	104 Å²	104	79.4 Å²	79.4	41%	0.408	45%	0.452	S	S	.	.	H	α-helix	trans	-63.9	-39.8	172.3	-177.5	-95.9	0	0	0	112.7	L241 S329 A337	L241-Y333 HydrophobicContact CD2-CE1 4.17Å; S329-Y333 PolarHBondContact O-N 3.47Å; Y333-A337 WeakPolarHBondContact O-CB 3.38Å; Y333-A337 PolarHBondContact O-N 2.94Å
334	L	83.9	Confident	76.9	Confident	51 Å²	51	77.5 Å²	77.5	27%	0.267	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-43.7	175.7	176	63.3	0	0	0	111.3	V330 E331 A337 L338	V330-L334 WeakPolarHBondContact O-CB 3.41Å; V330-L334 PolarHBondContact O-N 2.91Å; E331-L334 WeakPolarHBondContact O-CB 3.15Å; E331-L334 PolarHBondContact O-N 2.68Å; L334-A337 PolarHBondContact O-N 3.07Å; L334-L338 HydrophobicContact CD1-CD1 3.96Å; L334-L338 HydrophobicContact CD1-CG 4.44Å; L334-L338 HydrophobicContact CG-CD1 3.99Å; L334-L338 WeakPolarHBondContact O-CD1 3.46Å; L334-L338 VanDerWaalsContact O-CG 3.27Å; L334-L338 WeakPolarHBondContact O-CG 3.44Å; L334-L338 PolarHBondContact O-N 3.45Å
335	V	86.3	Confident	79.6	Confident	9 Å²	9	74.9 Å²	74.9	6%	0.055	42%	0.421	C	S	.	.	H	α-helix	trans	-62.7	-47.8	176.9	162.2	0	0	0	0	111.2	E331 E332 A337 L338 K339 T356	E331-V335 WeakPolarHBondContact O-CB 3.14Å; E331-V335 WeakPolarHBondContact O-CG2 3.47Å; E331-V335 PolarHBondContact O-N 2.79Å; E332-V335 PolarHBondContact O-N 2.92Å; V335-A337 PolarHBondContact O-N 2.84Å; V335-L338 PolarHBondContact O-N 2.92Å; V335-K339 HydrophobicContact CG1-CD 4.42Å; V335-K339 HydrophobicContact CG1-CG 4.49Å; V335-K339 WeakPolarHBondContact O-CG 3.35Å; V335-K339 PolarHBondContact O-N 3.38Å; V335-T356 HydrophobicContact CG1-CG2 3.78Å
336	D	83.9	Confident	81.8	Confident	99 Å²	99	74.8 Å²	74.8	53%	0.529	41%	0.408	S	S	.	.	H	α-helix	trans	-65.5	-24.4	177.5	-84.1	5.9	0	0	0	113.7	E332 K339	E332-D336 PolarHBondContact O-N 3.12Å; D336-K339 IonicContact OD1-NZ 3.56Å; D336-K339 PolarHBondContact OD1-NZ 3.39Å
337	A	82.3	Confident	83.9	Confident	65 Å²	65	71 Å²	71	54%	0.537	39%	0.39	S	S	.	.	H	α-helix	trans	-81.4	-12.7	172.9	0	0	0	0	0	114.2	Y333 L334 V335	Y333-A337 WeakPolarHBondContact O-CB 3.38Å; Y333-A337 PolarHBondContact O-N 2.94Å; L334-A337 PolarHBondContact O-N 3.07Å; V335-A337 PolarHBondContact O-N 2.84Å
338	L	87.4	Confident	85.7	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.073	38%	0.376	C	S	.	.	H	α-helix	trans	-104	-28.1	179.6	-70.2	167.5	0	0	0	113.1	L334 V335 S341 S343 N349 L353 V377	L334-L338 HydrophobicContact CD1-CD1 3.96Å; L334-L338 HydrophobicContact CD1-CG 4.44Å; L334-L338 HydrophobicContact CG-CD1 3.99Å; L334-L338 WeakPolarHBondContact O-CD1 3.46Å; L334-L338 VanDerWaalsContact O-CG 3.27Å; L334-L338 WeakPolarHBondContact O-CG 3.44Å; L334-L338 PolarHBondContact O-N 3.45Å; V335-L338 PolarHBondContact O-N 2.92Å; L338-S341 PolarHBondContact O-N 2.77Å; L338-S341 VanDerWaalsContact O-O 3.12Å; L338-S341 PolarHBondContact O-OG 3.16Å; L338-S343 WeakPolarHBondContact CD2-OG 3.33Å; L338-N349 HydrophobicContact CD1-CB 3.98Å; L338-L353 HydrophobicContact CB-CD1 4.24Å; L338-L353 HydrophobicContact CB-CD2 4.29Å; L338-V377 HydrophobicContact CD1-CG2 4.32Å; L338-V377 HydrophobicContact CD2-CG2 4.3Å
339	K	87.1	Confident	87.3	Confident	93 Å²	93	63 Å²	63	40%	0.404	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	140.3	179.7	-81.6	172.1	-176.5	159.2	0	113	V335 D336 S341 L353 E375	V335-K339 HydrophobicContact CG1-CD 4.42Å; V335-K339 HydrophobicContact CG1-CG 4.49Å; V335-K339 WeakPolarHBondContact O-CG 3.35Å; V335-K339 PolarHBondContact O-N 3.38Å; D336-K339 IonicContact OD1-NZ 3.56Å; D336-K339 PolarHBondContact OD1-NZ 3.39Å; K339-S341 PolarHBondContact O-N 2.81Å; K339-L353 HydrophobicContact CG-CD1 4.38Å; K339-E375 VanDerWaalsContact CA-OE2 3.24Å; K339-E375 WeakPolarHBondContact CA-OE2 3.25Å
340	G	85.8	Confident	87.9	Confident	57 Å²	57	60.2 Å²	60.2	59%	0.588	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	20.3	-177.7	0	0	0	0	0	114.8	N374 E375	G340-N374 CarbonylContact C-O 3.53Å; G340-E375 PolarHBondContact N-OE2 2.92Å
341	S	90.6	Very high	88.4	Confident	24 Å²	24	54.8 Å²	54.8	17%	0.168	30%	0.304	C	S	.	.			trans	-145.9	144.9	178.7	75.7	0	0	0	0	113.1	L338 K339 N374 E375 G376	L338-S341 PolarHBondContact O-N 2.77Å; L338-S341 VanDerWaalsContact O-O 3.12Å; L338-S341 PolarHBondContact O-OG 3.16Å; K339-S341 PolarHBondContact O-N 2.81Å; S341-N374 PolarHBondContact N-O 3.4Å; S341-E375 CarbonylContact O-C 3.3Å; S341-E375 VanDerWaalsContact O-CA 3.27Å; S341-E375 WeakPolarHBondContact O-CA 3.4Å; S341-G376 PolarHBondContact O-N 3.46Å
342	V	95.6	Very high	89	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.1	167.8	-171.8	0	0	0	0	109.8	N374 G376 L378 P385 Y388 V456	V342-N374 VanDerWaalsContact CG2-OD1 3.32Å; V342-N374 WeakPolarHBondContact CG2-OD1 3.44Å; V342-G376 WeakPolarHBondContact CA-O 3.23Å; V342-L378 HydrophobicContact CG1-CD1 3.94Å; V342-L378 HydrophobicContact CG1-CG 4.07Å; V342-P385 HydrophobicContact CB-CB 4.11Å; V342-P385 HydrophobicContact CG1-CB 3.98Å; V342-Y388 PolarHBondContact N-O 2.95Å; V342-V456 HydrophobicContact CG1-CG2 3.75Å; V342-V456 HydrophobicContact CG2-CG1 3.72Å; V342-V456 HydrophobicContact CG2-CG2 4.05Å
343	S	93.3	Very high	89.5	Confident	25 Å²	25	47.2 Å²	47.2	18%	0.175	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.3	-179.1	60.5	0	0	0	0	112.1	L338 G376 V377 L378	L338-S343 WeakPolarHBondContact CD2-OG 3.33Å; S343-G376 PolarHBondContact N-O 2.99Å; S343-V377 WeakPolarHBondContact O-CA 3.43Å; S343-L378 PolarHBondContact O-N 2.8Å
344	L	94.3	Very high	89.8	Confident	90 Å²	90	42.2 Å²	42.2	47%	0.471	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.9	160.4	-171.8	81.1	0	0	0	107.8	L378 E381	L344-L378 WeakPolarHBondContact CA-O 3.41Å; L344-L378 HydrophobicContact CD1-CB 4.37Å; L344-L378 WeakPolarHBondContact CD1-O 3.34Å; L344-E381 HydrophobicContact CD2-CG 4.02Å
345	G	91.4	Very high	90.1	Very high	22 Å²	22	43.8 Å²	43.8	23%	0.227	26%	0.255	C	S	.	.			trans	-166.5	-170.1	-175.6	0	0	0	0	0	114.8	L378 L379	G345-L378 PolarHBondContact N-O 3.14Å; G345-L379 VanDerWaalsContact O-CD2 3.25Å; G345-L379 WeakPolarHBondContact O-CD2 3.39Å
346	E	91.6	Very high	90.3	Very high	112 Å²	112	46.4 Å²	46.4	52%	0.523	27%	0.271	S	S	.	.			trans	-86.9	155.3	-175.4	-65.7	-61.7	159.6	0	0	112.6	Q348 N349 L350	E346-Q348 HydrophobicContact CB-CG 3.9Å; E346-Q348 PolarHBondContact O-N 2.78Å; E346-Q348 VanDerWaalsContact O-N 3.14Å; E346-N349 VanDerWaalsContact O-CB 3.31Å; E346-N349 WeakPolarHBondContact O-CB 2.95Å; E346-N349 PolarHBondContact O-N 3.17Å; E346-L350 PolarHBondContact O-N 2.72Å
347	P	91.4	Very high	90.5	Very high	43 Å²	43	41.9 Å²	41.9	28%	0.279	25%	0.247	S	C	.	.	H	α-helix	trans	-56.5	-33.2	-179.9	-24.5	33.5	0	0	0	113.7	N349 L350 A351 L379 A442	P347-N349 VanDerWaalsContact C-N 3.32Å; P347-N349 PolarHBondContact O-N 3.32Å; P347-L350 PolarHBondContact O-N 2.81Å; P347-A351 WeakPolarHBondContact O-CB 3.24Å; P347-A351 PolarHBondContact O-N 2.83Å; P347-L379 HydrophobicContact CB-CD1 4.37Å; P347-L379 HydrophobicContact CG-CD1 4.34Å; P347-L379 HydrophobicContact CG-CD2 4.34Å; P347-A442 HydrophobicContact CB-CB 3.76Å; P347-A442 VanDerWaalsContact CB-O 3.28Å; P347-A442 WeakPolarHBondContact CB-O 3.45Å
348	Q	89.8	Confident	90.2	Very high	126 Å²	126	46.6 Å²	46.6	59%	0.589	25%	0.25	S	S	*	.	H	α-helix	trans	-63.7	-31.7	174.6	66.9	-140	7.4	0	0	113.9	E346 A351 S352	E346-Q348 HydrophobicContact CB-CG 3.9Å; E346-Q348 PolarHBondContact O-N 2.78Å; E346-Q348 VanDerWaalsContact O-N 3.14Å; Q348-A351 PolarHBondContact O-N 2.95Å; Q348-S352 WeakPolarHBondContact O-CB 3.47Å; Q348-S352 PolarHBondContact O-N 3.05Å; Q348-S352 PolarHBondContact O-OG 2.78Å
349	N	92.3	Very high	88.8	Confident	29 Å²	29	48.2 Å²	48.2	16%	0.155	27%	0.27	C	S	.	.	H	α-helix	trans	-69.6	-44.1	177.6	-59.6	8.3	0	0	0	109.2	L338 E346 P347 S352 L353 V377	L338-N349 HydrophobicContact CD1-CB 3.98Å; E346-N349 VanDerWaalsContact O-CB 3.31Å; E346-N349 WeakPolarHBondContact O-CB 2.95Å; E346-N349 PolarHBondContact O-N 3.17Å; P347-N349 VanDerWaalsContact C-N 3.32Å; P347-N349 PolarHBondContact O-N 3.32Å; N349-S352 PolarHBondContact O-N 3.23Å; N349-L353 WeakPolarHBondContact O-CB 3.49Å; N349-L353 PolarHBondContact O-N 3.05Å; N349-V377 HydrophobicContact CB-CG1 4.3Å; N349-V377 HydrophobicContact CB-CG2 4.07Å
350	L	93.6	Very high	86.8	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-45.1	173.5	-174.3	58.2	0	0	0	111.5	E346 P347 S352 L353 A354 W357 V377 L379 L438 L452 A455	E346-L350 PolarHBondContact O-N 2.72Å; P347-L350 PolarHBondContact O-N 2.81Å; L350-S352 VanDerWaalsContact C-N 3.27Å; L350-S352 PolarHBondContact O-N 3.33Å; L350-L353 PolarHBondContact O-N 3.05Å; L350-A354 WeakPolarHBondContact O-CB 3.3Å; L350-A354 PolarHBondContact O-N 3.29Å; L350-W357 HydrophobicContact CD1-CH2 4.05Å; L350-W357 HydrophobicContact CD1-CZ3 4.36Å; L350-V377 HydrophobicContact CB-CB 3.91Å; L350-V377 HydrophobicContact CB-CG1 4.33Å; L350-V377 HydrophobicContact CB-CG2 4.49Å; L350-V377 HydrophobicContact CD1-CB 4.03Å; L350-L379 HydrophobicContact CD2-CD1 4Å; L350-L379 HydrophobicContact CD2-CG 4.35Å; L350-L438 HydrophobicContact CD1-CD1 4.27Å; L350-L438 HydrophobicContact CG-CD1 4.4Å; L350-L452 HydrophobicContact CD2-CD2 3.8Å; L350-A455 HydrophobicContact CD1-CB 4.11Å
351	A	91.4	Very high	84.8	Confident	15 Å²	15	47.5 Å²	47.5	12%	0.124	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-31.8	179.1	0	0	0	0	0	112.9	P347 Q348 K355 T439 A442	P347-A351 WeakPolarHBondContact O-CB 3.24Å; P347-A351 PolarHBondContact O-N 2.83Å; Q348-A351 PolarHBondContact O-N 2.95Å; A351-K355 WeakPolarHBondContact O-CE 3.43Å; A351-K355 WeakPolarHBondContact O-CG 3.42Å; A351-T439 HydrophobicContact CB-CG2 4.08Å; A351-A442 HydrophobicContact CB-CB 4.24Å
352	S	90.9	Very high	82.5	Confident	13 Å²	13	50.4 Å²	50.4	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-75.7	-48.5	175.5	-53.4	0	0	0	0	111.3	E331 Q348 N349 L350 A354 K355	E331-S352 WeakPolarHBondContact OE1-CB 3.22Å; E331-S352 PolarHBondContact OE1-OG 3.29Å; Q348-S352 WeakPolarHBondContact O-CB 3.47Å; Q348-S352 PolarHBondContact O-N 3.05Å; Q348-S352 PolarHBondContact O-OG 2.78Å; N349-S352 PolarHBondContact O-N 3.23Å; L350-S352 VanDerWaalsContact C-N 3.27Å; L350-S352 PolarHBondContact O-N 3.33Å; S352-A354 PolarHBondContact O-N 3.03Å; S352-K355 WeakPolarHBondContact O-CB 3.32Å; S352-K355 PolarHBondContact O-N 2.66Å
353	L	92.2	Very high	80	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-37.7	179.1	-174.1	64.6	0	0	0	112.5	L338 K339 N349 L350 K355 T356 W357 V377	L338-L353 HydrophobicContact CB-CD1 4.24Å; L338-L353 HydrophobicContact CB-CD2 4.29Å; K339-L353 HydrophobicContact CG-CD1 4.38Å; N349-L353 WeakPolarHBondContact O-CB 3.49Å; N349-L353 PolarHBondContact O-N 3.05Å; L350-L353 PolarHBondContact O-N 3.05Å; L353-K355 PolarHBondContact O-N 3.3Å; L353-K355 VanDerWaalsContact O-N 3.15Å; L353-T356 PolarHBondContact O-N 2.96Å; L353-T356 PolarHBondContact O-OG1 2.88Å; L353-W357 HydrophobicContact CD2-CH2 4.5Å; L353-W357 HydrophobicContact CD2-CZ2 3.68Å; L353-W357 HydrophobicContact CG-CZ2 3.84Å; L353-V377 HydrophobicContact CD2-CG2 4.3Å
354	A	91.6	Very high	77.8	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.3	176.3	0	0	0	0	0	113.3	L350 S352 T356 W357 F433 A435 L438	L350-A354 WeakPolarHBondContact O-CB 3.3Å; L350-A354 PolarHBondContact O-N 3.29Å; S352-A354 PolarHBondContact O-N 3.03Å; A354-T356 VanDerWaalsContact C-N 3.29Å; A354-T356 PolarHBondContact O-N 2.91Å; A354-W357 HydrophobicContact CB-CE3 4.25Å; A354-W357 PolarHBondContact O-N 3.27Å; A354-F433 HydrophobicContact CB-CE1 4.49Å; A354-F433 HydrophobicContact CB-CZ 4.28Å; A354-A435 VanDerWaalsContact O-CB 3.31Å; A354-A435 WeakPolarHBondContact O-CB 3.4Å; A354-L438 HydrophobicContact CB-CB 4Å; A354-L438 HydrophobicContact CB-CD1 3.96Å
355	K	90.3	Very high	75.3	Confident	83 Å²	83	63.5 Å²	63.5	36%	0.361	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.6	177.1	-64.5	164.4	-172.3	174.1	0	113.3	E331 A351 S352 L353 R358	E331-K355 WeakPolarHBondContact OE1-CD 3.48Å; E331-K355 WeakPolarHBondContact OE1-CE 3.28Å; E331-K355 IonicContact OE1-NZ 2.66Å; E331-K355 PolarHBondContact OE1-NZ 2.92Å; E331-K355 IonicContact OE2-NZ 3.57Å; A351-K355 WeakPolarHBondContact O-CE 3.43Å; A351-K355 WeakPolarHBondContact O-CG 3.42Å; S352-K355 WeakPolarHBondContact O-CB 3.32Å; S352-K355 PolarHBondContact O-N 2.66Å; L353-K355 PolarHBondContact O-N 3.3Å; L353-K355 VanDerWaalsContact O-N 3.15Å; K355-R358 PolarHBondContact O-NE 3.24Å; K355-R358 PolarHBondContact O-NH2 2.87Å
356	T	89.7	Confident	73.2	Confident	65 Å²	65	67 Å²	67	40%	0.399	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-17.3	172.7	41.8	0	0	0	0	113.3	V335 L353 A354 R358	V335-T356 HydrophobicContact CG1-CG2 3.78Å; L353-T356 PolarHBondContact O-N 2.96Å; L353-T356 PolarHBondContact O-OG1 2.88Å; A354-T356 VanDerWaalsContact C-N 3.29Å; A354-T356 PolarHBondContact O-N 2.91Å; T356-R358 PolarHBondContact O-N 2.94Å
357	W	88.6	Confident	71	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.015	37%	0.365	C	S	.	.			trans	-76.3	85.2	173.5	-59	-15.1	0	0	0	110.9	L350 L353 A354 E375 F433 L438 A455 K457 V462	L350-W357 HydrophobicContact CD1-CH2 4.05Å; L350-W357 HydrophobicContact CD1-CZ3 4.36Å; L353-W357 HydrophobicContact CD2-CH2 4.5Å; L353-W357 HydrophobicContact CD2-CZ2 3.68Å; L353-W357 HydrophobicContact CG-CZ2 3.84Å; A354-W357 HydrophobicContact CB-CE3 4.25Å; A354-W357 PolarHBondContact O-N 3.27Å; W357-E375 HydrophobicContact CZ2-CG 4.47Å; W357-E375 WeakPolarHBondContact CZ2-O 3.38Å; W357-E375 PolarHBondContact NE1-OE1 3.43Å; W357-F433 HydrophobicContact CB-CD1 3.99Å; W357-F433 HydrophobicContact CB-CE1 3.87Å; W357-F433 HydrophobicContact CE3-CE1 4.06Å; W357-F433 HydrophobicContact CE3-CZ 4.1Å; W357-F433 WeakPolarHBondContact O-CD1 3.45Å; W357-L438 HydrophobicContact CE3-CD1 4.2Å; W357-L438 HydrophobicContact CZ3-CD1 3.67Å; W357-A455 HydrophobicContact CH2-CB 4.28Å; W357-A455 HydrophobicContact CZ3-CB 3.98Å; W357-K457 HydrophobicContact CD2-CB 4.21Å; W357-K457 HydrophobicContact CG-CD 4.27Å; W357-K457 HydrophobicContact CZ2-CB 3.97Å; W357-V462 HydrophobicContact CD2-CG2 4.46Å; W357-V462 HydrophobicContact CE3-CG1 3.8Å; W357-V462 HydrophobicContact CE3-CG2 4.01Å; W357-V462 HydrophobicContact CZ3-CG1 3.69Å
358	R	75	Confident	68.7	Low	163 Å²	163	71.7 Å²	71.7	62%	0.615	39%	0.389	S	S	*	.			trans	-125.9	146.6	171.4	-55.5	-173.8	-163.6	-94.1	1.2	109.8	K355 T356 G360	K355-R358 PolarHBondContact O-NE 3.24Å; K355-R358 PolarHBondContact O-NH2 2.87Å; T356-R358 PolarHBondContact O-N 2.94Å; R358-G360 PolarHBondContact O-N 2.98Å
359	G	58.8	Low	66.6	Low	48 Å²	48	72.6 Å²	72.6	50%	0.495	39%	0.394	S	S	.	.			trans	-67.3	75.8	166.8	0	0	0	0	0	111.8	V430	G359-V430 PolarHBondContact N-O 3.43Å
360	G	44.1	Very low	64.7	Low	47 Å²	47	72.9 Å²	72.9	49%	0.485	39%	0.394	S	S	.	.			trans	-72.4	135.6	169.5	0	0	0	0	0	110.7	R358 L362	R358-G360 PolarHBondContact O-N 2.98Å; G360-L362 PolarHBondContact O-N 2.94Å
361	G	45.4	Very low	62.8	Low	89 Å²	89	76.1 Å²	76.1	92%	0.918	42%	0.421	S	S	*	.			trans	-74.2	71.9	174.1	0	0	0	0	0	111.8
362	L	40.8	Very low	61.5	Low	84 Å²	84	80.8 Å²	80.8	44%	0.44	44%	0.444	S	S	.	.			trans	-84.6	150.8	-175.7	-63.4	-177.4	0	0	0	113.2	G360 E366 Q367	G360-L362 PolarHBondContact O-N 2.94Å; L362-E366 HydrophobicContact CB-CB 4.41Å; L362-Q367 PolarHBondContact O-NE2 3.33Å; L362-Q367 VanDerWaalsContact O-NE2 3.07Å
363	D	44.7	Very low	61	Low	102 Å²	102	83.5 Å²	83.5	55%	0.545	46%	0.455	S	S	.	.			trans	-67.4	155.9	-170.3	-170.4	16.8	0	0	0	111.9	K365 E366	D363-K365 PolarHBondContact O-N 3.32Å; D363-E366 PolarHBondContact O-N 2.9Å
364	L	45.4	Very low	61.1	Low	124 Å²	124	83.8 Å²	83.8	65%	0.649	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-10.3	-174.1	-80.6	165.2	0	0	0	114.8
365	K	42.4	Very low	61.2	Low	165 Å²	165	84.5 Å²	84.5	72%	0.717	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-34.6	173.4	-70.3	174.2	-178.8	164.8	0	113.3	D363	D363-K365 PolarHBondContact O-N 3.32Å
366	E	46.5	Very low	61.5	Low	94 Å²	94	80.5 Å²	80.5	44%	0.439	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-26.3	-176.6	-67	175.7	153.3	0	0	111.2	L362 D363 F368 Q369 E370	L362-E366 HydrophobicContact CB-CB 4.41Å; D363-E366 PolarHBondContact O-N 2.9Å; E366-F368 PolarHBondContact O-N 3.13Å; E366-F368 VanDerWaalsContact O-N 3.07Å; E366-Q369 WeakPolarHBondContact O-CA 3.45Å; E366-Q369 PolarHBondContact O-N 2.78Å; E366-E370 PolarHBondContact O-N 3.09Å
367	Q	45.1	Very low	61.8	Low	76 Å²	76	77.4 Å²	77.4	36%	0.355	42%	0.423	S	S	.	.	H	α-helix	trans	-61.1	-16.8	174.5	-61.5	-178.8	23.8	0	0	114.3	L362	L362-Q367 PolarHBondContact O-NE2 3.33Å; L362-Q367 VanDerWaalsContact O-NE2 3.07Å
368	F	44.2	Very low	62.2	Low	179 Å²	179	77.2 Å²	77.2	79%	0.785	42%	0.423	S	S	*	.	H	α-helix	trans	-87.3	-15.2	171.2	-81.7	-83.8	0	0	0	113.7	E366	E366-F368 PolarHBondContact O-N 3.13Å; E366-F368 VanDerWaalsContact O-N 3.07Å
369	Q	46.3	Very low	63.2	Low	145 Å²	145	71.6 Å²	71.6	68%	0.678	41%	0.405	S	S	*	.	H	α-helix	trans	-93.4	-41.4	171.7	-66.4	-177.1	-110.6	0	0	110.7	E366 A371 D372	E366-Q369 WeakPolarHBondContact O-CA 3.45Å; E366-Q369 PolarHBondContact O-N 2.78Å; Q369-A371 PolarHBondContact O-N 3.28Å; Q369-A371 VanDerWaalsContact O-N 3.08Å; Q369-D372 PolarHBondContact O-N 3.09Å
370	E	51.2	Low	64.9	Low	34 Å²	34	70.6 Å²	70.6	16%	0.159	39%	0.388	C	S	.	.	H	α-helix	trans	-50	-36.9	172.4	-79.5	-158.2	107.1	0	0	112.4	E366 D372 E373 K457 G459	E366-E370 PolarHBondContact O-N 3.09Å; E370-D372 PolarHBondContact O-N 3.02Å; E370-D372 VanDerWaalsContact O-N 3.09Å; E370-E373 WeakPolarHBondContact O-CB 3.33Å; E370-E373 PolarHBondContact O-N 2.78Å; E370-E373 VanDerWaalsContact O-N 3.16Å; E370-K457 IonicContact OE1-NZ 3.32Å; E370-G459 WeakPolarHBondContact O-CA 3.46Å
371	A	53.5	Low	67.4	Low	68 Å²	68	75.5 Å²	75.5	56%	0.562	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.4	-174	0	0	0	0	0	114.7	Q369	Q369-A371 PolarHBondContact O-N 3.28Å; Q369-A371 VanDerWaalsContact O-N 3.08Å
372	D	64.6	Low	69.8	Low	114 Å²	114	76.7 Å²	76.7	61%	0.61	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-7.2	179.9	-144.7	-4.8	0	0	0	112.9	Q369 E370 N374 R391	Q369-D372 PolarHBondContact O-N 3.09Å; E370-D372 PolarHBondContact O-N 3.02Å; E370-D372 VanDerWaalsContact O-N 3.09Å; D372-N374 PolarHBondContact O-N 2.93Å; D372-R391 PolarHBondContact O-NH1 3.15Å; D372-R391 VanDerWaalsContact O-NH1 3.13Å; D372-R391 PolarHBondContact O-NH2 3.38Å; D372-R391 IonicContact OD1-CZ 3.78Å; D372-R391 IonicContact OD1-NH1 3.36Å; D372-R391 IonicContact OD1-NH2 3.89Å; D372-R391 PolarHBondContact OD1-NH2 2.98Å
373	E	81.6	Confident	72.5	Confident	69 Å²	69	72.7 Å²	72.7	32%	0.322	36%	0.357	S	S	.	.			trans	-61.3	124.8	179.7	-73.4	176.5	-172.5	0	0	111.9	E370 K457 E458 G459	E370-E373 WeakPolarHBondContact O-CB 3.33Å; E370-E373 PolarHBondContact O-N 2.78Å; E370-E373 VanDerWaalsContact O-N 3.16Å; E373-K457 IonicContact OE2-NZ 3.74Å; E373-K457 PolarHBondContact OE2-NZ 2.88Å; E373-E458 WeakPolarHBondContact O-CA 3.38Å; E373-G459 PolarHBondContact O-N 2.86Å
374	N	92.8	Very high	74.7	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.032	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	106.9	172.1	-172.3	-118.6	0	0	0	109.3	G340 S341 V342 D372 E389 Y390 R391 V456 K457	G340-N374 CarbonylContact C-O 3.53Å; S341-N374 PolarHBondContact N-O 3.4Å; V342-N374 VanDerWaalsContact CG2-OD1 3.32Å; V342-N374 WeakPolarHBondContact CG2-OD1 3.44Å; D372-N374 PolarHBondContact O-N 2.93Å; N374-E389 WeakPolarHBondContact OD1-CA 3.34Å; N374-Y390 PolarHBondContact ND2-O 3.01Å; N374-Y390 PolarHBondContact OD1-N 2.89Å; N374-Y390 PolarHBondContact OD1-O 3.16Å; N374-R391 HydrophobicContact CB-CG 4.23Å; N374-V456 WeakPolarHBondContact ND2-CG1 3.32Å; N374-K457 WeakPolarHBondContact CA-O 3.4Å
375	E	94.9	Very high	76.9	Confident	15 Å²	15	68.1 Å²	68.1	7%	0.07	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.9	-174.9	62.9	172.5	-141	0	0	112.7	K339 G340 S341 W357 V456 K457	K339-E375 VanDerWaalsContact CA-OE2 3.24Å; K339-E375 WeakPolarHBondContact CA-OE2 3.25Å; G340-E375 PolarHBondContact N-OE2 2.92Å; S341-E375 CarbonylContact O-C 3.3Å; S341-E375 VanDerWaalsContact O-CA 3.27Å; S341-E375 WeakPolarHBondContact O-CA 3.4Å; W357-E375 HydrophobicContact CZ2-CG 4.47Å; W357-E375 WeakPolarHBondContact CZ2-O 3.38Å; W357-E375 PolarHBondContact NE1-OE1 3.43Å; E375-V456 CarbonylContact O-C 3.53Å; E375-V456 WeakPolarHBondContact O-CA 3.2Å; E375-K457 HydrophobicContact CG-CB 4Å; E375-K457 HydrophobicContact CG-CD 4.33Å; E375-K457 PolarHBondContact N-O 3.37Å; E375-K457 PolarHBondContact O-N 2.8Å
376	G	96.1	Very high	79.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	177.9	-177	0	0	0	0	0	115.7	S341 V342 S343 A455	S341-G376 PolarHBondContact O-N 3.46Å; V342-G376 WeakPolarHBondContact CA-O 3.23Å; S343-G376 PolarHBondContact N-O 2.99Å; G376-A455 WeakPolarHBondContact CA-O 3.09Å
377	V	96.6	Very high	81.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	121.5	176.1	-176.9	0	0	0	0	109.1	L338 S343 N349 L350 L353 L379 G454 A455	L338-V377 HydrophobicContact CD1-CG2 4.32Å; L338-V377 HydrophobicContact CD2-CG2 4.3Å; S343-V377 WeakPolarHBondContact O-CA 3.43Å; N349-V377 HydrophobicContact CB-CG1 4.3Å; N349-V377 HydrophobicContact CB-CG2 4.07Å; L350-V377 HydrophobicContact CB-CB 3.91Å; L350-V377 HydrophobicContact CB-CG1 4.33Å; L350-V377 HydrophobicContact CB-CG2 4.49Å; L350-V377 HydrophobicContact CD1-CB 4.03Å; L353-V377 HydrophobicContact CD2-CG2 4.3Å; V377-L379 HydrophobicContact CG1-CD2 3.94Å; V377-G454 WeakPolarHBondContact O-CA 3.31Å; V377-A455 PolarHBondContact N-O 3.25Å; V377-A455 VanDerWaalsContact N-O 3.09Å; V377-A455 PolarHBondContact O-N 2.84Å; V377-A455 VanDerWaalsContact O-N 3.09Å
378	L	97.3	Very high	83.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	137.6	171.3	-62.6	171.3	0	0	0	108.7	V342 S343 L344 G345 L383 P385 Y390 V456 F465	V342-L378 HydrophobicContact CG1-CD1 3.94Å; V342-L378 HydrophobicContact CG1-CG 4.07Å; S343-L378 PolarHBondContact O-N 2.8Å; L344-L378 WeakPolarHBondContact CA-O 3.41Å; L344-L378 HydrophobicContact CD1-CB 4.37Å; L344-L378 WeakPolarHBondContact CD1-O 3.34Å; G345-L378 PolarHBondContact N-O 3.14Å; L378-L383 HydrophobicContact CD1-CB 4.05Å; L378-L383 HydrophobicContact CD2-CB 4.14Å; L378-L383 HydrophobicContact CD2-CD1 4.08Å; L378-L383 HydrophobicContact CG-CB 4.49Å; L378-P385 HydrophobicContact CD1-CG 4.4Å; L378-Y390 HydrophobicContact CD1-CD1 4.12Å; L378-Y390 HydrophobicContact CD1-CD2 4.19Å; L378-Y390 HydrophobicContact CD1-CE1 4.43Å; L378-Y390 HydrophobicContact CD1-CG 3.99Å; L378-Y390 HydrophobicContact CD2-CD1 4.34Å; L378-Y390 HydrophobicContact CD2-CE1 4.4Å; L378-V456 HydrophobicContact CD2-CG2 4.24Å; L378-F465 HydrophobicContact CD2-CD2 3.92Å; L378-F465 HydrophobicContact CD2-CE2 4.28Å
379	L	95.6	Very high	85.8	Confident	45 Å²	45	63.1 Å²	63.1	24%	0.236	32%	0.315	C	S	.	.			trans	-110.6	6.3	-174	-52.7	179.2	0	0	0	112.3	G345 P347 L350 V377 L452 Y453	G345-L379 VanDerWaalsContact O-CD2 3.25Å; G345-L379 WeakPolarHBondContact O-CD2 3.39Å; P347-L379 HydrophobicContact CB-CD1 4.37Å; P347-L379 HydrophobicContact CG-CD1 4.34Å; P347-L379 HydrophobicContact CG-CD2 4.34Å; L350-L379 HydrophobicContact CD2-CD1 4Å; L350-L379 HydrophobicContact CD2-CG 4.35Å; V377-L379 HydrophobicContact CG1-CD2 3.94Å; L379-L452 HydrophobicContact CD1-CD2 3.84Å; L379-L452 HydrophobicContact CD1-CG 4.03Å; L379-Y453 PolarHBondContact N-O 2.9Å
380	N	94.8	Very high	88.1	Confident	26 Å²	26	56.2 Å²	56.2	14%	0.139	28%	0.283	C	S	.	.	S	Bend	trans	-141.2	116.7	-173	180	-11.4	0	0	0	109.5	K382 L383 Y453	N380-K382 PolarHBondContact O-N 3.34Å; N380-K382 WeakPolarHBondContact OD1-CB 3.46Å; N380-K382 WeakPolarHBondContact OD1-CG 3.5Å; N380-K382 PolarHBondContact OD1-N 3.42Å; N380-K382 VanDerWaalsContact OD1-N 3.15Å; N380-L383 PolarHBondContact O-N 3.03Å; N380-Y453 HydrophobicContact CB-CD1 3.96Å; N380-Y453 HydrophobicContact CB-CG 4.01Å; N380-Y453 VanDerWaalsContact ND2-CD1 3.28Å; N380-Y453 WeakPolarHBondContact ND2-CD1 3.39Å; N380-Y453 WeakPolarHBondContact ND2-CD2 3.31Å; N380-Y453 VanDerWaalsContact ND2-CE1 3.3Å; N380-Y453 WeakPolarHBondContact ND2-CE1 3.27Å; N380-Y453 WeakPolarHBondContact ND2-CE2 3.36Å
381	E	94.9	Very high	90.2	Very high	151 Å²	151	56 Å²	56	71%	0.706	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-13.6	-177.7	-61.8	178.9	173.8	0	0	115.1	L344 K384	L344-E381 HydrophobicContact CD2-CG 4.02Å; E381-K384 WeakPolarHBondContact O-CE 3.17Å; E381-K384 WeakPolarHBondContact O-CG 3.23Å
382	K	96.3	Very high	92.2	Very high	113 Å²	113	54.7 Å²	54.7	49%	0.491	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-15.7	176.1	-57.7	-175.3	-177.3	-174.6	0	114	N380 T419 F421	N380-K382 PolarHBondContact O-N 3.34Å; N380-K382 WeakPolarHBondContact OD1-CB 3.46Å; N380-K382 WeakPolarHBondContact OD1-CG 3.5Å; N380-K382 PolarHBondContact OD1-N 3.42Å; N380-K382 VanDerWaalsContact OD1-N 3.15Å; K382-T419 WeakPolarHBondContact O-CB 2.95Å; K382-T419 VanDerWaalsContact O-CG2 3.29Å; K382-T419 WeakPolarHBondContact O-CG2 3.46Å; K382-T419 PolarHBondContact O-OG1 3.08Å; K382-F421 HydrophobicContact CB-CB 3.84Å; K382-F421 HydrophobicContact CB-CD1 3.36Å; K382-F421 HydrophobicContact CB-CD2 4.22Å; K382-F421 HydrophobicContact CB-CE1 3.92Å; K382-F421 HydrophobicContact CB-CG 3.53Å; K382-F421 HydrophobicContact CD-CD1 4.05Å; K382-F421 HydrophobicContact CD-CD2 3.55Å; K382-F421 HydrophobicContact CD-CE1 4.11Å; K382-F421 HydrophobicContact CD-CE2 3.63Å; K382-F421 HydrophobicContact CD-CG 3.77Å; K382-F421 HydrophobicContact CD-CZ 3.91Å; K382-F421 HydrophobicContact CG-CD1 4.37Å; K382-F421 HydrophobicContact CG-CG 4.29Å
383	L	97	Very high	93.6	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.257	C	S	.	.	S	Bend	trans	-100.2	117.5	167.8	-54.6	179.8	0	0	0	106.9	L378 N380 D416 F421 F465	L378-L383 HydrophobicContact CD1-CB 4.05Å; L378-L383 HydrophobicContact CD2-CB 4.14Å; L378-L383 HydrophobicContact CD2-CD1 4.08Å; L378-L383 HydrophobicContact CG-CB 4.49Å; N380-L383 PolarHBondContact O-N 3.03Å; L383-D416 WeakPolarHBondContact CA-OD2 3.41Å; L383-D416 HydrophobicContact CD2-CB 4.26Å; L383-F421 HydrophobicContact CD2-CD1 3.83Å; L383-F421 HydrophobicContact CD2-CE1 4.39Å; L383-F421 HydrophobicContact CG-CD1 4.43Å; L383-F465 HydrophobicContact CD1-CB 3.72Å; L383-F465 HydrophobicContact CD1-CD1 4.45Å; L383-F465 HydrophobicContact CD1-CG 4.03Å
384	K	91.7	Very high	94.2	Very high	90 Å²	90	55 Å²	55	39%	0.391	27%	0.267	S	S	.	.			trans	-118.7	115	-167.6	-70	-169.5	178.7	-179.4	0	112.4	E381 Y390 D416 T419	E381-K384 WeakPolarHBondContact O-CE 3.17Å; E381-K384 WeakPolarHBondContact O-CG 3.23Å; K384-Y390 WeakPolarHBondContact O-CD2 3.35Å; K384-D416 PolarHBondContact N-OD2 2.82Å; K384-T419 HydrophobicContact CB-CG2 4.43Å; K384-T419 HydrophobicContact CD-CG2 3.56Å; K384-T419 HydrophobicContact CG-CG2 3.79Å
385	P	92.2	Very high	94.4	Very high	39 Å²	39	56 Å²	56	25%	0.253	27%	0.271	S	S	.	.			trans	-71.6	143	169.5	31.1	-29.2	0	0	0	109.6	V342 L378 E389	V342-P385 HydrophobicContact CB-CB 4.11Å; V342-P385 HydrophobicContact CG1-CB 3.98Å; L378-P385 HydrophobicContact CD1-CG 4.4Å; P385-E389 CarbonylContact C-O 3.6Å; P385-E389 WeakPolarHBondContact CA-O 3.1Å; P385-E389 WeakPolarHBondContact CB-O 3.39Å
386	V	89.6	Confident	94.5	Very high	47 Å²	47	55.3 Å²	55.3	29%	0.285	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-117.1	126.8	178.4	-177.4	0	0	0	0	107.8	Y388 E389	V386-Y388 PolarHBondContact O-N 3.02Å; V386-E389 PolarHBondContact N-O 3.36Å; V386-E389 PolarHBondContact O-N 3.22Å
387	D	90.1	Very high	94.4	Very high	149 Å²	149	56.9 Å²	56.9	80%	0.797	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	36.2	-175.5	-62.8	-34.3	0	0	0	114
388	Y	91.2	Very high	94.3	Very high	144 Å²	144	60 Å²	60	57%	0.565	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	18.1	-175.9	-49.4	-84.2	0	0	0	116.2	V342 V386	V342-Y388 PolarHBondContact N-O 2.95Å; V386-Y388 PolarHBondContact O-N 3.02Å
389	E	92.6	Very high	93.7	Very high	69 Å²	69	62.1 Å²	62.1	32%	0.322	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-114.8	153.5	172.6	-62.7	-159.9	154.5	0	0	113.3	N374 P385 V386 R391 H395	N374-E389 WeakPolarHBondContact OD1-CA 3.34Å; P385-E389 CarbonylContact C-O 3.6Å; P385-E389 WeakPolarHBondContact CA-O 3.1Å; P385-E389 WeakPolarHBondContact CB-O 3.39Å; V386-E389 PolarHBondContact N-O 3.36Å; V386-E389 PolarHBondContact O-N 3.22Å; E389-R391 IonicContact OE1-CZ 3.11Å; E389-R391 IonicContact OE1-NE 2.81Å; E389-R391 PolarHBondContact OE1-NE 3.34Å; E389-R391 VanDerWaalsContact OE1-NE 3.16Å; E389-R391 IonicContact OE1-NH2 3.15Å; E389-R391 PolarHBondContact OE1-NH2 3.37Å; E389-R391 WeakPolarHBondContact OE2-CD 3.34Å; E389-R391 IonicContact OE2-CZ 2.8Å; E389-R391 IonicContact OE2-NE 3.72Å; E389-R391 PolarHBondContact OE2-NE 3.23Å; E389-R391 IonicContact OE2-NH2 3.41Å; E389-H395 IonicContact OE2-CE1 2.65Å
390	Y	96.4	Very high	92.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.323	C	S	.	.			trans	-149.5	100.1	167.4	-161.9	-109	0	0	0	109.5	N374 L378 K384 H395 W396 V456 F465	N374-Y390 PolarHBondContact ND2-O 3.01Å; N374-Y390 PolarHBondContact OD1-N 2.89Å; N374-Y390 PolarHBondContact OD1-O 3.16Å; L378-Y390 HydrophobicContact CD1-CD1 4.12Å; L378-Y390 HydrophobicContact CD1-CD2 4.19Å; L378-Y390 HydrophobicContact CD1-CE1 4.43Å; L378-Y390 HydrophobicContact CD1-CG 3.99Å; L378-Y390 HydrophobicContact CD2-CD1 4.34Å; L378-Y390 HydrophobicContact CD2-CE1 4.4Å; K384-Y390 WeakPolarHBondContact O-CD2 3.35Å; Y390-H395 HydrophobicContact CD2-CB 3.76Å; Y390-H395 HydrophobicContact CE2-CB 4.15Å; Y390-H395 HydrophobicContact CG-CB 4.35Å; Y390-W396 AromaticContact CD1-CD1 3.51Å; Y390-W396 AromaticContact CD1-NE1 3.8Å; Y390-W396 HydrophobicContact CE1-CB 4.35Å; Y390-W396 AromaticContact CE1-CD1 3.24Å; Y390-W396 AromaticContact CE1-CG 3.92Å; Y390-W396 HydrophobicContact CE1-CG 3.92Å; Y390-W396 AromaticContact CE1-NE1 3.8Å; Y390-W396 AromaticContact CZ-CD1 3.6Å; Y390-V456 HydrophobicContact CD1-CG2 4.26Å; Y390-F465 HydrophobicContact CD1-CE2 4.02Å; Y390-F465 AromaticContact CD1-CZ 3.88Å; Y390-F465 HydrophobicContact CD1-CZ 3.88Å; Y390-F465 AromaticContact CE1-CE1 3.91Å; Y390-F465 HydrophobicContact CE1-CE1 3.91Å; Y390-F465 AromaticContact CE1-CE2 3.92Å; Y390-F465 HydrophobicContact CE1-CE2 3.92Å; Y390-F465 AromaticContact CE1-CZ 3.55Å; Y390-F465 HydrophobicContact CE1-CZ 3.55Å
391	R	95.2	Very high	91.5	Very high	30 Å²	30	69.8 Å²	69.8	11%	0.113	35%	0.35	C	S	.	.			trans	-124.4	147	-166.9	-66.7	-172.9	-170.6	-98.8	5.2	112.1	D372 N374 E389 V394 H395 W396 E458	D372-R391 PolarHBondContact O-NH1 3.15Å; D372-R391 VanDerWaalsContact O-NH1 3.13Å; D372-R391 PolarHBondContact O-NH2 3.38Å; D372-R391 IonicContact OD1-CZ 3.78Å; D372-R391 IonicContact OD1-NH1 3.36Å; D372-R391 IonicContact OD1-NH2 3.89Å; D372-R391 PolarHBondContact OD1-NH2 2.98Å; N374-R391 HydrophobicContact CB-CG 4.23Å; E389-R391 IonicContact OE1-CZ 3.11Å; E389-R391 IonicContact OE1-NE 2.81Å; E389-R391 PolarHBondContact OE1-NE 3.34Å; E389-R391 VanDerWaalsContact OE1-NE 3.16Å; E389-R391 IonicContact OE1-NH2 3.15Å; E389-R391 PolarHBondContact OE1-NH2 3.37Å; E389-R391 WeakPolarHBondContact OE2-CD 3.34Å; E389-R391 IonicContact OE2-CZ 2.8Å; E389-R391 IonicContact OE2-NE 3.72Å; E389-R391 PolarHBondContact OE2-NE 3.23Å; E389-R391 IonicContact OE2-NH2 3.41Å; R391-V394 HydrophobicContact CB-CB 4.16Å; R391-V394 HydrophobicContact CB-CG2 4.3Å; R391-V394 PolarHBondContact O-N 3.07Å; R391-H395 PolarHBondContact N-ND1 3.32Å; R391-H395 VanDerWaalsContact N-ND1 3.12Å; R391-H395 PolarHBondContact O-N 3Å; R391-W396 PolarHBondContact O-N 3.25Å; R391-E458 VanDerWaalsContact CB-OE1 3.22Å; R391-E458 WeakPolarHBondContact CB-OE1 3.45Å; R391-E458 VanDerWaalsContact CG-OE1 3.25Å; R391-E458 WeakPolarHBondContact CG-OE1 3.49Å; R391-E458 IonicContact NH1-OE1 2.8Å
392	E	94.7	Very high	90.8	Very high	41 Å²	41	64.8 Å²	64.8	19%	0.192	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-61.5	143.3	173.8	-165.9	173.2	142.7	0	0	110.9	V394 W396 K398 K427 E458	E392-V394 PolarHBondContact O-N 3.07Å; E392-W396 HydrophobicContact CB-CH2 3.81Å; E392-W396 HydrophobicContact CB-CZ2 3.57Å; E392-W396 HydrophobicContact CB-CZ3 4.38Å; E392-W396 HydrophobicContact CG-CE3 4.27Å; E392-W396 HydrophobicContact CG-CH2 3.54Å; E392-W396 HydrophobicContact CG-CZ2 3.87Å; E392-W396 HydrophobicContact CG-CZ3 3.76Å; E392-W396 VanDerWaalsContact OE2-CH2 3.28Å; E392-W396 WeakPolarHBondContact OE2-CH2 3.37Å; E392-K398 WeakPolarHBondContact OE1-CE 3.34Å; E392-K398 IonicContact OE1-NZ 2.66Å; E392-K398 PolarHBondContact OE1-NZ 3.01Å; E392-K398 IonicContact OE2-NZ 2.72Å; E392-K427 VanDerWaalsContact OE2-CD 3.27Å; E392-K427 WeakPolarHBondContact OE2-CD 3.42Å; E392-K427 WeakPolarHBondContact OE2-CE 3.39Å; E392-K427 IonicContact OE2-NZ 3.3Å; E392-K427 PolarHBondContact OE2-NZ 2.84Å; E392-E458 PolarHBondContact N-OE2 3Å
393	E	94	Very high	90.1	Very high	102 Å²	102	62.6 Å²	62.6	48%	0.477	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	-9.2	-175	-60.4	-49.5	116.2	0	0	117.3	W396 T397 K417	E393-W396 WeakPolarHBondContact CA-O 3.22Å; E393-W396 PolarHBondContact N-O 3.12Å; E393-T397 WeakPolarHBondContact OE1-CG2 3.47Å; E393-T397 WeakPolarHBondContact OE2-CG2 3.17Å; E393-K417 PolarHBondContact O-NZ 2.94Å
394	V	94.4	Very high	89.2	Confident	88 Å²	88	63.8 Å²	63.8	53%	0.533	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-53.4	172.5	-174	0	0	0	0	111.4	R391 E392	R391-V394 HydrophobicContact CB-CB 4.16Å; R391-V394 HydrophobicContact CB-CG2 4.3Å; R391-V394 PolarHBondContact O-N 3.07Å; E392-V394 PolarHBondContact O-N 3.07Å
395	H	96.3	Very high	88.5	Confident	26 Å²	26	65.1 Å²	65.1	12%	0.12	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-30.5	-171.6	-61.9	105.4	0	0	0	112.5	E389 Y390 R391 K417	E389-H395 IonicContact OE2-CE1 2.65Å; Y390-H395 HydrophobicContact CD2-CB 3.76Å; Y390-H395 HydrophobicContact CE2-CB 4.15Å; Y390-H395 HydrophobicContact CG-CB 4.35Å; R391-H395 PolarHBondContact N-ND1 3.32Å; R391-H395 VanDerWaalsContact N-ND1 3.12Å; R391-H395 PolarHBondContact O-N 3Å; H395-K417 WeakPolarHBondContact O-CB 3.33Å; H395-K417 PolarHBondContact O-N 2.82Å
396	W	96.8	Very high	87.3	Confident	1 Å²	1	64.3 Å²	64.3	0%	0.004	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	165.3	172.8	58.6	-86.1	0	0	0	110.8	Y390 R391 E392 E393 K398 I414 E415 K427 T463 F465	Y390-W396 AromaticContact CD1-CD1 3.51Å; Y390-W396 AromaticContact CD1-NE1 3.8Å; Y390-W396 HydrophobicContact CE1-CB 4.35Å; Y390-W396 AromaticContact CE1-CD1 3.24Å; Y390-W396 AromaticContact CE1-CG 3.92Å; Y390-W396 HydrophobicContact CE1-CG 3.92Å; Y390-W396 AromaticContact CE1-NE1 3.8Å; Y390-W396 AromaticContact CZ-CD1 3.6Å; R391-W396 PolarHBondContact O-N 3.25Å; E392-W396 HydrophobicContact CB-CH2 3.81Å; E392-W396 HydrophobicContact CB-CZ2 3.57Å; E392-W396 HydrophobicContact CB-CZ3 4.38Å; E392-W396 HydrophobicContact CG-CE3 4.27Å; E392-W396 HydrophobicContact CG-CH2 3.54Å; E392-W396 HydrophobicContact CG-CZ2 3.87Å; E392-W396 HydrophobicContact CG-CZ3 3.76Å; E392-W396 VanDerWaalsContact OE2-CH2 3.28Å; E392-W396 WeakPolarHBondContact OE2-CH2 3.37Å; E393-W396 WeakPolarHBondContact CA-O 3.22Å; E393-W396 PolarHBondContact N-O 3.12Å; W396-K398 HydrophobicContact CZ3-CG 4.27Å; W396-I414 HydrophobicContact CB-CD1 4.02Å; W396-I414 HydrophobicContact CD2-CD1 4.37Å; W396-I414 HydrophobicContact CE3-CB 3.84Å; W396-I414 HydrophobicContact CE3-CD1 4.17Å; W396-I414 HydrophobicContact CE3-CG1 4.31Å; W396-I414 HydrophobicContact CE3-CG2 3.8Å; W396-I414 HydrophobicContact CG-CD1 4.36Å; W396-I414 HydrophobicContact CZ3-CB 4.22Å; W396-I414 HydrophobicContact CZ3-CG2 3.64Å; W396-E415 CarbonylContact C-O 3.48Å; W396-E415 VanDerWaalsContact CA-O 3.24Å; W396-E415 WeakPolarHBondContact CA-O 3.5Å; W396-E415 WeakPolarHBondContact CB-O 3.38Å; W396-K427 HydrophobicContact CH2-CD 4.42Å; W396-T463 HydrophobicContact CH2-CG2 3.98Å; W396-T463 HydrophobicContact CZ2-CG2 3.84Å; W396-F465 HydrophobicContact CD2-CE1 4.16Å; W396-F465 HydrophobicContact CD2-CZ 4.43Å; W396-F465 AromaticContact CE2-CE1 3.97Å; W396-F465 AromaticContact CE2-CZ 3.82Å; W396-F465 HydrophobicContact CZ2-CE1 4.26Å; W396-F465 HydrophobicContact CZ2-CZ 4.08Å; W396-F465 AromaticContact NE1-CZ 3.76Å
397	T	95.3	Very high	86.1	Confident	33 Å²	33	63.8 Å²	63.8	20%	0.202	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.9	-175.6	1.5	0	0	0	0	111.2	E393 I414 E415 K417	E393-T397 WeakPolarHBondContact OE1-CG2 3.47Å; E393-T397 WeakPolarHBondContact OE2-CG2 3.17Å; T397-I414 CarbonylContact O-C 3.43Å; T397-I414 WeakPolarHBondContact O-CA 3.24Å; T397-I414 WeakPolarHBondContact O-CB 3.25Å; T397-E415 PolarHBondContact N-O 2.87Å; T397-E415 PolarHBondContact O-N 2.9Å; T397-K417 WeakPolarHBondContact OG1-CE 3.12Å; T397-K417 WeakPolarHBondContact OG1-CG 3.43Å
398	K	94.3	Very high	85.3	Confident	65 Å²	65	58.5 Å²	58.5	28%	0.283	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.5	165.6	-71	164.3	173.8	161.3	0	109.7	E392 W396 Y412 I414	E392-K398 WeakPolarHBondContact OE1-CE 3.34Å; E392-K398 IonicContact OE1-NZ 2.66Å; E392-K398 PolarHBondContact OE1-NZ 3.01Å; E392-K398 IonicContact OE2-NZ 2.72Å; W396-K398 HydrophobicContact CZ3-CG 4.27Å; K398-Y412 HydrophobicContact CD-CD1 4.01Å; K398-Y412 HydrophobicContact CD-CD2 4.45Å; K398-Y412 HydrophobicContact CD-CE1 4.23Å; K398-Y412 HydrophobicContact CD-CG 4.13Å; K398-Y412 VanDerWaalsContact CE-CE2 3.48Å; K398-Y412 HydrophobicContact CG-CD1 4.32Å; K398-Y412 HydrophobicContact CG-CG 4.11Å; K398-I414 HydrophobicContact CG-CG2 4.32Å
399	C	83.6	Confident	84.7	Confident	44 Å²	44	52.4 Å²	52.4	30%	0.297	30%	0.301	S	S	.	.			trans	-82.1	-32.3	-176	-54.6	0	0	0	0	113.3	K413 I414 E415	C399-K413 HydrophobicContact CB-CG 4.31Å; C399-K413 PolarHBondContact N-O 3.08Å; C399-I414 VanDerWaalsContact SG-C 3.55Å; C399-E415 VanDerWaalsContact SG-CB 3.56Å
400	H	72.3	Confident	84.5	Confident	132 Å²	132	53.1 Å²	53.1	61%	0.611	30%	0.304	S	S	*	.	S	Bend	trans	-150.8	177	-166.3	-74	81	0	0	0	110.3
401	S	72.1	Confident	84.3	Confident	101 Å²	101	54.6 Å²	54.6	71%	0.706	31%	0.313	S	S	*	.	S	Bend	trans	-53.7	159.1	164.6	52	0	0	0	0	112.6	L403	S401-L403 PolarHBondContact O-N 3.49Å
402	S	80	Confident	84.2	Confident	46 Å²	46	54.7 Å²	54.7	32%	0.322	31%	0.314	S	S	.	.			trans	-48.5	135.6	177.2	-179.3	0	0	0	0	112.8	G404 V411	S402-G404 VanDerWaalsContact C-N 3.3Å; S402-G404 PolarHBondContact OG-N 2.61Å; S402-G404 PolarHBondContact OG-O 2.66Å; S402-G404 VanDerWaalsContact OG-O 3.08Å; S402-V411 PolarHBondContact OG-O 2.92Å
403	L	81.9	Confident	84.2	Confident	66 Å²	66	54 Å²	54	35%	0.346	31%	0.31	S	S	.	.	S	Bend	trans	-75	-23.3	173	-63.9	177.1	0	0	0	111.8	S401 V411 K413 L468 Q476	S401-L403 PolarHBondContact O-N 3.49Å; L403-V411 WeakPolarHBondContact CB-O 3.32Å; L403-V411 HydrophobicContact CD1-CG1 4.39Å; L403-V411 PolarHBondContact N-O 2.64Å; L403-K413 HydrophobicContact CD1-CB 4.05Å; L403-K413 HydrophobicContact CD2-CB 4.16Å; L403-K413 HydrophobicContact CG-CB 4.24Å; L403-L468 HydrophobicContact CD1-CD1 3.73Å; L403-Q476 PolarHBondContact O-NE2 2.96Å
404	G	78.9	Confident	84.3	Confident	27 Å²	27	49.1 Å²	49.1	28%	0.278	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	169.8	-178	0	0	0	0	0	112.8	S402 V411	S402-G404 VanDerWaalsContact C-N 3.3Å; S402-G404 PolarHBondContact OG-N 2.61Å; S402-G404 PolarHBondContact OG-O 2.66Å; S402-G404 VanDerWaalsContact OG-O 3.08Å; G404-V411 PolarHBondContact O-N 2.89Å
405	V	76.3	Confident	84.4	Confident	118 Å²	118	48 Å²	48	72%	0.715	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.3	173.7	-174.7	0	0	0	0	107.7	E410	V405-E410 HydrophobicContact CG2-CG 4.45Å
406	G	68.1	Low	84.5	Confident	21 Å²	21	46.8 Å²	46.8	22%	0.216	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-178.9	172.2	0	0	0	0	0	111.5	F408 G409	G406-F408 PolarHBondContact O-N 3.36Å; G406-G409 WeakPolarHBondContact CA-O 3.44Å; G406-G409 PolarHBondContact N-O 2.53Å
407	S	64.4	Low	84.5	Confident	37 Å²	37	51.6 Å²	51.6	26%	0.259	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.7	-169.3	-62.7	0	0	0	0	115	D512 D531 H534	S407-D512 PolarHBondContact OG-OD2 2.97Å; S407-D531 PolarHBondContact N-OD2 3.05Å; S407-D531 PolarHBondContact OG-OD2 3.43Å; S407-H534 WeakPolarHBondContact CB-NE2 3.35Å; S407-H534 PolarHBondContact OG-NE2 2.98Å
408	F	71.5	Confident	84.4	Confident	38 Å²	38	55.6 Å²	55.6	17%	0.167	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.7	9.4	-174	-53.3	-79.9	0	0	0	113.5	G406 V428 H534	G406-F408 PolarHBondContact O-N 3.36Å; F408-V428 HydrophobicContact CB-CG1 4.01Å; F408-V428 HydrophobicContact CB-CG2 4.44Å; F408-H534 AromaticContact CE2-CD2 3.99Å; F408-H534 AromaticContact CE2-NE2 3.93Å; F408-H534 AromaticContact CZ-CE1 3.87Å
409	G	79.8	Confident	84.6	Confident	16 Å²	16	55 Å²	55	17%	0.165	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.9	162.3	-172	0	0	0	0	0	115.5	G406 K427	G406-G409 WeakPolarHBondContact CA-O 3.44Å; G406-G409 PolarHBondContact N-O 2.53Å; G409-K427 WeakPolarHBondContact CA-O 3.28Å
410	E	88	Confident	85.1	Confident	83 Å²	83	54.9 Å²	54.9	39%	0.388	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	147.4	176.5	-59.6	-162.6	151.1	0	0	111.8	V405 Y412 K426 K427	V405-E410 HydrophobicContact CG2-CG 4.45Å; E410-Y412 HydrophobicContact CB-CE1 4.34Å; E410-Y412 HydrophobicContact CB-CE2 3.93Å; E410-Y412 VanDerWaalsContact OE2-CZ 3.27Å; E410-Y412 PolarHBondContact OE2-OH 2.86Å; E410-K426 CarbonylContact O-C 3.52Å; E410-K426 WeakPolarHBondContact O-CA 3.27Å; E410-K427 PolarHBondContact N-O 3.08Å; E410-K427 PolarHBondContact O-N 2.99Å
411	V	91.8	Very high	86.3	Confident	31 Å²	31	50.5 Å²	50.5	19%	0.188	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.5	179.4	-171.2	0	0	0	0	110	S402 L403 G404 A424 A425 K426	S402-V411 PolarHBondContact OG-O 2.92Å; L403-V411 WeakPolarHBondContact CB-O 3.32Å; L403-V411 HydrophobicContact CD1-CG1 4.39Å; L403-V411 PolarHBondContact N-O 2.64Å; G404-V411 PolarHBondContact O-N 2.89Å; V411-A424 HydrophobicContact CG1-CB 4.37Å; V411-A425 CarbonylContact C-O 3.51Å; V411-A425 WeakPolarHBondContact CA-O 3.27Å; V411-K426 HydrophobicContact CG2-CB 4.15Å; V411-K426 HydrophobicContact CG2-CG 4.14Å
412	Y	93	Very high	87.5	Confident	33 Å²	33	49.3 Å²	49.3	13%	0.129	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.9	-179	-49.2	-86.4	0	0	0	111.6	K398 E410 A424 A425 K427	K398-Y412 HydrophobicContact CD-CD1 4.01Å; K398-Y412 HydrophobicContact CD-CD2 4.45Å; K398-Y412 HydrophobicContact CD-CE1 4.23Å; K398-Y412 HydrophobicContact CD-CG 4.13Å; K398-Y412 VanDerWaalsContact CE-CE2 3.48Å; K398-Y412 HydrophobicContact CG-CD1 4.32Å; K398-Y412 HydrophobicContact CG-CG 4.11Å; E410-Y412 HydrophobicContact CB-CE1 4.34Å; E410-Y412 HydrophobicContact CB-CE2 3.93Å; E410-Y412 VanDerWaalsContact OE2-CZ 3.27Å; E410-Y412 PolarHBondContact OE2-OH 2.86Å; Y412-A424 WeakPolarHBondContact O-CA 3.34Å; Y412-A425 PolarHBondContact N-O 2.92Å; Y412-A425 PolarHBondContact O-N 2.66Å; Y412-K427 HydrophobicContact CD2-CG 4.28Å; Y412-K427 HydrophobicContact CE2-CB 4.2Å; Y412-K427 HydrophobicContact CE2-CD 4.14Å; Y412-K427 HydrophobicContact CE2-CG 3.92Å
413	K	95.1	Very high	88.3	Confident	26 Å²	26	47.1 Å²	47.1	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.2	160	-178	163.5	-177.6	164.7	0	108.2	C399 L403 L468 E470	C399-K413 HydrophobicContact CB-CG 4.31Å; C399-K413 PolarHBondContact N-O 3.08Å; L403-K413 HydrophobicContact CD1-CB 4.05Å; L403-K413 HydrophobicContact CD2-CB 4.16Å; L403-K413 HydrophobicContact CG-CB 4.24Å; K413-L468 HydrophobicContact CD-CD2 3.6Å; K413-L468 HydrophobicContact CG-CD2 3.88Å; K413-E470 IonicContact NZ-OE1 2.74Å; K413-E470 PolarHBondContact NZ-OE1 3.43Å; K413-E470 IonicContact NZ-OE2 3.16Å; K413-E470 PolarHBondContact NZ-OE2 2.85Å
414	I	96.1	Very high	89	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158.2	-176.9	75.4	99	0	0	0	111.3	W396 T397 K398 C399 Q422 C423 A425 F465	W396-I414 HydrophobicContact CB-CD1 4.02Å; W396-I414 HydrophobicContact CD2-CD1 4.37Å; W396-I414 HydrophobicContact CE3-CB 3.84Å; W396-I414 HydrophobicContact CE3-CD1 4.17Å; W396-I414 HydrophobicContact CE3-CG1 4.31Å; W396-I414 HydrophobicContact CE3-CG2 3.8Å; W396-I414 HydrophobicContact CG-CD1 4.36Å; W396-I414 HydrophobicContact CZ3-CB 4.22Å; W396-I414 HydrophobicContact CZ3-CG2 3.64Å; T397-I414 CarbonylContact O-C 3.43Å; T397-I414 WeakPolarHBondContact O-CA 3.24Å; T397-I414 WeakPolarHBondContact O-CB 3.25Å; K398-I414 HydrophobicContact CG-CG2 4.32Å; C399-I414 VanDerWaalsContact SG-C 3.55Å; I414-Q422 CarbonylContact O-C 3.36Å; I414-Q422 WeakPolarHBondContact O-CA 3.21Å; I414-C423 VanDerWaalsContact CD1-SG 3.58Å; I414-C423 VanDerWaalsContact CG1-SG 3.59Å; I414-C423 PolarHBondContact N-O 2.84Å; I414-C423 PolarHBondContact O-N 2.95Å; I414-A425 HydrophobicContact CG1-CB 4.03Å; I414-A425 HydrophobicContact CG2-CB 3.73Å; I414-F465 HydrophobicContact CD1-CD1 4.14Å; I414-F465 HydrophobicContact CD1-CE1 4.08Å; I414-F465 HydrophobicContact CG1-CD1 4.4Å; I414-F465 HydrophobicContact CG1-CE1 4.46Å
415	E	96.8	Very high	89.8	Confident	64 Å²	64	43 Å²	43	30%	0.299	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.5	176.4	-172.8	170.4	110.1	0	0	110.4	W396 T397 C399 F421 Q422	W396-E415 CarbonylContact C-O 3.48Å; W396-E415 VanDerWaalsContact CA-O 3.24Å; W396-E415 WeakPolarHBondContact CA-O 3.5Å; W396-E415 WeakPolarHBondContact CB-O 3.38Å; T397-E415 PolarHBondContact N-O 2.87Å; T397-E415 PolarHBondContact O-N 2.9Å; C399-E415 VanDerWaalsContact SG-CB 3.56Å; E415-F421 WeakPolarHBondContact CA-O 3.28Å; E415-Q422 HydrophobicContact CB-CG 4.1Å; E415-Q422 HydrophobicContact CG-CG 4.06Å; E415-Q422 WeakPolarHBondContact OE2-CG 3.5Å; E415-Q422 PolarHBondContact OE2-NE2 3.35Å
416	D	97.9	Very high	90.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.7	167.7	175.3	-56.6	0	0	0	109.5	L383 K384 Q418 T419 G420 F421	L383-D416 WeakPolarHBondContact CA-OD2 3.41Å; L383-D416 HydrophobicContact CD2-CB 4.26Å; K384-D416 PolarHBondContact N-OD2 2.82Å; D416-Q418 VanDerWaalsContact C-N 3.3Å; D416-Q418 PolarHBondContact O-N 3.1Å; D416-Q418 WeakPolarHBondContact OD1-CA 3.47Å; D416-Q418 WeakPolarHBondContact OD1-CB 3.46Å; D416-Q418 PolarHBondContact OD1-N 2.98Å; D416-T419 WeakPolarHBondContact CB-OG1 3.34Å; D416-T419 PolarHBondContact OD1-N 3.09Å; D416-T419 PolarHBondContact OD1-OG1 2.84Å; D416-G420 WeakPolarHBondContact O-CA 3.13Å; D416-G420 PolarHBondContact O-N 3.31Å; D416-F421 PolarHBondContact N-O 3.2Å; D416-F421 VanDerWaalsContact N-O 3.07Å
417	K	96.4	Very high	91.8	Very high	101 Å²	101	37.5 Å²	37.5	44%	0.439	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.5	-173.4	-66.9	-173.1	179.4	-174	0	114.2	E393 H395 T397	E393-K417 PolarHBondContact O-NZ 2.94Å; H395-K417 WeakPolarHBondContact O-CB 3.33Å; H395-K417 PolarHBondContact O-N 2.82Å; T397-K417 WeakPolarHBondContact OG1-CE 3.12Å; T397-K417 WeakPolarHBondContact OG1-CG 3.43Å
418	Q	94.8	Very high	93.1	Very high	118 Å²	118	35.7 Å²	35.7	55%	0.551	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-32.9	178.6	-170.3	-178.3	93.8	0	0	112	D416	D416-Q418 VanDerWaalsContact C-N 3.3Å; D416-Q418 PolarHBondContact O-N 3.1Å; D416-Q418 WeakPolarHBondContact OD1-CA 3.47Å; D416-Q418 WeakPolarHBondContact OD1-CB 3.46Å; D416-Q418 PolarHBondContact OD1-N 2.98Å
419	T	96.8	Very high	93.9	Very high	51 Å²	51	35.3 Å²	35.3	31%	0.313	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-17.4	-175.9	70.7	0	0	0	0	114.3	K382 K384 D416 F421	K382-T419 WeakPolarHBondContact O-CB 2.95Å; K382-T419 VanDerWaalsContact O-CG2 3.29Å; K382-T419 WeakPolarHBondContact O-CG2 3.46Å; K382-T419 PolarHBondContact O-OG1 3.08Å; K384-T419 HydrophobicContact CB-CG2 4.43Å; K384-T419 HydrophobicContact CD-CG2 3.56Å; K384-T419 HydrophobicContact CG-CG2 3.79Å; D416-T419 WeakPolarHBondContact CB-OG1 3.34Å; D416-T419 PolarHBondContact OD1-N 3.09Å; D416-T419 PolarHBondContact OD1-OG1 2.84Å; T419-F421 PolarHBondContact O-N 3.18Å; T419-F421 WeakPolarHBondContact OG1-CB 3.15Å; T419-F421 PolarHBondContact OG1-N 3.39Å; T419-F421 VanDerWaalsContact OG1-N 3.1Å
420	G	96.1	Very high	94.4	Very high	42 Å²	42	34.9 Å²	34.9	43%	0.433	18%	0.177	S	C	.	.			trans	66.5	14.9	-169.1	0	0	0	0	0	113.2	D416 Q422	D416-G420 WeakPolarHBondContact O-CA 3.13Å; D416-G420 PolarHBondContact O-N 3.31Å; G420-Q422 PolarHBondContact O-N 3.18Å
421	F	97.5	Very high	94.2	Very high	40 Å²	40	35.4 Å²	35.4	18%	0.175	18%	0.18	C	C	.	.			trans	-79.8	122.3	-177.7	-179.5	-120.4	0	0	0	111.3	K382 L383 E415 D416 T419 C423 Y453	K382-F421 HydrophobicContact CB-CB 3.84Å; K382-F421 HydrophobicContact CB-CD1 3.36Å; K382-F421 HydrophobicContact CB-CD2 4.22Å; K382-F421 HydrophobicContact CB-CE1 3.92Å; K382-F421 HydrophobicContact CB-CG 3.53Å; K382-F421 HydrophobicContact CD-CD1 4.05Å; K382-F421 HydrophobicContact CD-CD2 3.55Å; K382-F421 HydrophobicContact CD-CE1 4.11Å; K382-F421 HydrophobicContact CD-CE2 3.63Å; K382-F421 HydrophobicContact CD-CG 3.77Å; K382-F421 HydrophobicContact CD-CZ 3.91Å; K382-F421 HydrophobicContact CG-CD1 4.37Å; K382-F421 HydrophobicContact CG-CG 4.29Å; L383-F421 HydrophobicContact CD2-CD1 3.83Å; L383-F421 HydrophobicContact CD2-CE1 4.39Å; L383-F421 HydrophobicContact CG-CD1 4.43Å; E415-F421 WeakPolarHBondContact CA-O 3.28Å; D416-F421 PolarHBondContact N-O 3.2Å; D416-F421 VanDerWaalsContact N-O 3.07Å; T419-F421 PolarHBondContact O-N 3.18Å; T419-F421 WeakPolarHBondContact OG1-CB 3.15Å; T419-F421 PolarHBondContact OG1-N 3.39Å; T419-F421 VanDerWaalsContact OG1-N 3.1Å; F421-C423 HydrophobicContact CE1-CB 4.11Å; F421-Y453 AromaticContact CE1-CD2 3.97Å; F421-Y453 HydrophobicContact CE1-CD2 3.97Å; F421-Y453 AromaticContact CE1-CE2 3.62Å; F421-Y453 HydrophobicContact CE1-CE2 3.62Å; F421-Y453 HydrophobicContact CZ-CD2 4.43Å; F421-Y453 AromaticContact CZ-CE2 3.63Å; F421-Y453 HydrophobicContact CZ-CE2 3.63Å
422	Q	96.4	Very high	93.8	Very high	76 Å²	76	38.7 Å²	38.7	36%	0.355	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132.5	178.2	-66	179.8	-3.2	0	0	111.9	I414 E415 G420	I414-Q422 CarbonylContact O-C 3.36Å; I414-Q422 WeakPolarHBondContact O-CA 3.21Å; E415-Q422 HydrophobicContact CB-CG 4.1Å; E415-Q422 HydrophobicContact CG-CG 4.06Å; E415-Q422 WeakPolarHBondContact OE2-CG 3.5Å; E415-Q422 PolarHBondContact OE2-NE2 3.35Å; G420-Q422 PolarHBondContact O-N 3.18Å
423	C	96.8	Very high	93.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	-176.5	174.5	80.6	0	0	0	0	111.6	I414 F421 Y453 M466	I414-C423 VanDerWaalsContact CD1-SG 3.58Å; I414-C423 VanDerWaalsContact CG1-SG 3.59Å; I414-C423 PolarHBondContact N-O 2.84Å; I414-C423 PolarHBondContact O-N 2.95Å; F421-C423 HydrophobicContact CE1-CB 4.11Å; C423-Y453 HydrophobicContact CB-CD2 3.86Å; C423-Y453 HydrophobicContact CB-CE2 4.02Å; C423-M466 WeakPolarHBondContact CB-O 3.37Å
424	A	96.1	Very high	92.9	Very high	6 Å²	6	40.3 Å²	40.3	5%	0.05	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.3	173.1	0	0	0	0	0	110.2	V411 Y412 F465 M466 L468	V411-A424 HydrophobicContact CG1-CB 4.37Å; Y412-A424 WeakPolarHBondContact O-CA 3.34Å; A424-F465 WeakPolarHBondContact O-CA 3.42Å; A424-M466 HydrophobicContact CB-CG 3.9Å; A424-M466 PolarHBondContact N-O 2.96Å; A424-M466 PolarHBondContact O-N 2.66Å; A424-L468 HydrophobicContact CB-CB 4.42Å; A424-L468 HydrophobicContact CB-CD1 4.12Å
425	A	95.4	Very high	92.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.9	175.6	0	0	0	0	0	111.6	V411 Y412 I414 T463 I464 F465	V411-A425 CarbonylContact C-O 3.51Å; V411-A425 WeakPolarHBondContact CA-O 3.27Å; Y412-A425 PolarHBondContact N-O 2.92Å; Y412-A425 PolarHBondContact O-N 2.66Å; I414-A425 HydrophobicContact CG1-CB 4.03Å; I414-A425 HydrophobicContact CG2-CB 3.73Å; A425-T463 HydrophobicContact CB-CG2 3.81Å; A425-I464 CarbonylContact C-O 3.57Å; A425-I464 WeakPolarHBondContact CA-O 3.32Å; A425-F465 HydrophobicContact CB-CD1 3.88Å; A425-F465 HydrophobicContact CB-CE1 3.98Å
426	K	94	Very high	91.7	Very high	4 Å²	4	42 Å²	42	2%	0.017	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.5	171.4	-176.9	-168.1	-174.8	-170.5	0	108.5	E410 V411 V428 E437 I464 M466 D531	E410-K426 CarbonylContact O-C 3.52Å; E410-K426 WeakPolarHBondContact O-CA 3.27Å; V411-K426 HydrophobicContact CG2-CB 4.15Å; V411-K426 HydrophobicContact CG2-CG 4.14Å; K426-V428 HydrophobicContact CD-CG2 4.01Å; K426-V428 HydrophobicContact CG-CG2 3.93Å; K426-E437 IonicContact NZ-OE1 2.73Å; K426-E437 PolarHBondContact NZ-OE1 3.39Å; K426-E437 IonicContact NZ-OE2 3.83Å; K426-E437 PolarHBondContact NZ-OE2 3.36Å; K426-I464 HydrophobicContact CB-CB 4.37Å; K426-I464 HydrophobicContact CD-CD1 4.5Å; K426-I464 PolarHBondContact N-O 2.84Å; K426-I464 PolarHBondContact O-N 3.23Å; K426-M466 HydrophobicContact CB-CE 3.88Å; K426-D531 VanDerWaalsContact NZ-CG 3.29Å; K426-D531 IonicContact NZ-OD1 3.17Å; K426-D531 PolarHBondContact NZ-OD1 2.88Å; K426-D531 IonicContact NZ-OD2 2.89Å; K426-D531 PolarHBondContact NZ-OD2 2.65Å
427	K	93	Very high	91.1	Very high	20 Å²	20	42.3 Å²	42.3	9%	0.087	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.1	174.8	-68.1	-155.6	76.8	169	0	110.8	E392 W396 G409 E410 Y412 W461 T463	E392-K427 VanDerWaalsContact OE2-CD 3.27Å; E392-K427 WeakPolarHBondContact OE2-CD 3.42Å; E392-K427 WeakPolarHBondContact OE2-CE 3.39Å; E392-K427 IonicContact OE2-NZ 3.3Å; E392-K427 PolarHBondContact OE2-NZ 2.84Å; W396-K427 HydrophobicContact CH2-CD 4.42Å; G409-K427 WeakPolarHBondContact CA-O 3.28Å; E410-K427 PolarHBondContact N-O 3.08Å; E410-K427 PolarHBondContact O-N 2.99Å; Y412-K427 HydrophobicContact CD2-CG 4.28Å; Y412-K427 HydrophobicContact CE2-CB 4.2Å; Y412-K427 HydrophobicContact CE2-CD 4.14Å; Y412-K427 HydrophobicContact CE2-CG 3.92Å; K427-W461 HydrophobicContact CB-CE3 4.35Å; K427-T463 WeakPolarHBondContact CE-OG1 3.47Å; K427-T463 HydrophobicContact CG-CG2 4.11Å
428	V	91.5	Very high	90.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.4	179.6	-176.9	0	0	0	0	108.4	F408 K426 H432 F433 W461 V462	F408-V428 HydrophobicContact CB-CG1 4.01Å; F408-V428 HydrophobicContact CB-CG2 4.44Å; K426-V428 HydrophobicContact CD-CG2 4.01Å; K426-V428 HydrophobicContact CG-CG2 3.93Å; V428-H432 HydrophobicContact CG1-CB 4.29Å; V428-F433 HydrophobicContact CG1-CB 3.96Å; V428-F433 HydrophobicContact CG1-CD2 4.49Å; V428-W461 CarbonylContact O-C 3.45Å; V428-W461 WeakPolarHBondContact O-CA 3.47Å; V428-V462 PolarHBondContact N-O 3.35Å; V428-V462 PolarHBondContact O-N 3.07Å
429	Q	89.9	Confident	90.2	Very high	30 Å²	30	33.4 Å²	33.4	14%	0.14	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	144.2	171.1	-66.8	179.9	-3	0	0	110.3	E431 H432 F433 P460 W461 R845	Q429-E431 PolarHBondContact O-N 3.46Å; Q429-H432 CarbonylContact O-C 3.53Å; Q429-H432 PolarHBondContact O-N 3.45Å; Q429-H432 PolarHBondContact OE1-ND1 3.29Å; Q429-F433 PolarHBondContact O-N 3.39Å; Q429-P460 WeakPolarHBondContact CA-O 3.24Å; Q429-W461 HydrophobicContact CG-CD2 4.41Å; Q429-W461 HydrophobicContact CG-CE3 3.77Å; Q429-W461 HydrophobicContact CG-CH2 3.75Å; Q429-W461 HydrophobicContact CG-CZ2 4.36Å; Q429-W461 HydrophobicContact CG-CZ3 3.42Å; Q429-W461 VanDerWaalsContact CG-CZ3 3.42Å; Q429-R845 PolarHBondContact NE2-O 3.21Å; Q429-R845 PolarHBondContact OE1-O 2.87Å
430	V	88.4	Confident	89.6	Confident	7 Å²	7	31 Å²	31	4%	0.042	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.9	-179.2	171.1	0	0	0	0	113.4	G359 K457 P460 V462	G359-V430 PolarHBondContact N-O 3.43Å; V430-K457 HydrophobicContact CG2-CG 4.37Å; V430-P460 WeakPolarHBondContact CG2-O 3.44Å; V430-P460 PolarHBondContact N-O 2.94Å; V430-V462 HydrophobicContact CG2-CG2 3.83Å
431	E	84.9	Confident	89	Confident	93 Å²	93	30.1 Å²	30.1	44%	0.435	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-27.8	174.4	-76	160.9	-162.4	0	0	114.4	Q429 R845	Q429-E431 PolarHBondContact O-N 3.46Å; E431-R845 WeakPolarHBondContact OE1-CD 3.39Å; E431-R845 IonicContact OE1-CZ 2.66Å; E431-R845 IonicContact OE1-NE 3.56Å; E431-R845 PolarHBondContact OE1-NE 2.73Å; E431-R845 IonicContact OE1-NH1 2.6Å; E431-R845 PolarHBondContact OE1-NH1 2.75Å; E431-R845 WeakPolarHBondContact OE2-CD 3.45Å
432	H	83.5	Confident	88.4	Confident	101 Å²	101	29.1 Å²	29.1	47%	0.468	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-8.5	177.6	-62.3	103.2	0	0	0	112.1	V428 Q429	V428-H432 HydrophobicContact CG1-CB 4.29Å; Q429-H432 CarbonylContact O-C 3.53Å; Q429-H432 PolarHBondContact O-N 3.45Å; Q429-H432 PolarHBondContact OE1-ND1 3.29Å
433	F	85.4	Confident	87.6	Confident	16 Å²	16	28.1 Å²	28.1	7%	0.07	15%	0.147	C	C	.	.			trans	-71.7	137.9	179.5	176.6	-103.8	0	0	0	111.5	A354 W357 V428 Q429 A435 L438 V462 I464	A354-F433 HydrophobicContact CB-CE1 4.49Å; A354-F433 HydrophobicContact CB-CZ 4.28Å; W357-F433 HydrophobicContact CB-CD1 3.99Å; W357-F433 HydrophobicContact CB-CE1 3.87Å; W357-F433 HydrophobicContact CE3-CE1 4.06Å; W357-F433 HydrophobicContact CE3-CZ 4.1Å; W357-F433 WeakPolarHBondContact O-CD1 3.45Å; V428-F433 HydrophobicContact CG1-CB 3.96Å; V428-F433 HydrophobicContact CG1-CD2 4.49Å; Q429-F433 PolarHBondContact O-N 3.39Å; F433-A435 HydrophobicContact CE1-CB 4.31Å; F433-L438 HydrophobicContact CE2-CD1 3.88Å; F433-L438 HydrophobicContact CE2-CG 3.92Å; F433-L438 HydrophobicContact CZ-CB 4.43Å; F433-L438 HydrophobicContact CZ-CD1 3.63Å; F433-L438 HydrophobicContact CZ-CG 3.87Å; F433-V462 HydrophobicContact CB-CG2 4.14Å; F433-V462 HydrophobicContact CD1-CG2 4.09Å; F433-V462 HydrophobicContact CD2-CB 3.97Å; F433-V462 HydrophobicContact CD2-CG1 3.96Å; F433-V462 HydrophobicContact CD2-CG2 4.03Å; F433-V462 HydrophobicContact CE2-CB 4.44Å; F433-V462 HydrophobicContact CE2-CG1 3.92Å; F433-V462 HydrophobicContact CG-CB 4.23Å; F433-V462 HydrophobicContact CG-CG2 3.78Å; F433-V462 HydrophobicContact CZ-CG1 4.46Å; F433-I464 HydrophobicContact CE2-CD1 4.17Å
434	R	83.6	Confident	87	Confident	77 Å²	77	29 Å²	29	29%	0.291	15%	0.151	S	C	.	.			trans	-118.5	119.1	174.9	-71.5	177.2	171.8	-178.9	-2.7	108.3	E436 E437 G533 Y552	R434-E436 HydrophobicContact CB-CB 4.48Å; R434-E436 PolarHBondContact O-N 2.72Å; R434-E436 VanDerWaalsContact O-N 3.14Å; R434-E437 WeakPolarHBondContact O-CB 3.17Å; R434-E437 PolarHBondContact O-N 3.43Å; R434-G533 VanDerWaalsContact CD-O 3.29Å; R434-G533 WeakPolarHBondContact CD-O 3.44Å; R434-G533 PolarHBondContact NH1-O 3.04Å; R434-G533 VanDerWaalsContact NH1-O 3.07Å; R434-Y552 PolarHBondContact NH1-OH 3.43Å
435	A	85.4	Confident	86.4	Confident	7 Å²	7	34.6 Å²	34.6	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-54.9	-32.9	176.5	0	0	0	0	0	111.1	A354 F433 E437 L438 T439	A354-A435 VanDerWaalsContact O-CB 3.31Å; A354-A435 WeakPolarHBondContact O-CB 3.4Å; F433-A435 HydrophobicContact CE1-CB 4.31Å; A435-E437 PolarHBondContact O-N 2.86Å; A435-L438 PolarHBondContact O-N 2.76Å; A435-T439 WeakPolarHBondContact O-CG2 3.45Å; A435-T439 PolarHBondContact O-N 3.39Å; A435-T439 PolarHBondContact O-OG1 3.42Å
436	E	81.1	Confident	86.1	Confident	93 Å²	93	35.5 Å²	35.5	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-51.7	-36.4	174.5	-65.4	73.3	-164.7	0	0	113.1	R434 L438 T439 T440	R434-E436 HydrophobicContact CB-CB 4.48Å; R434-E436 PolarHBondContact O-N 2.72Å; R434-E436 VanDerWaalsContact O-N 3.14Å; E436-L438 PolarHBondContact O-N 3.05Å; E436-T439 WeakPolarHBondContact CA-OG1 3.39Å; E436-T439 PolarHBondContact O-OG1 3.14Å; E436-T440 WeakPolarHBondContact O-CB 3.37Å; E436-T440 PolarHBondContact O-N 3.18Å; E436-T440 PolarHBondContact O-OG1 3.15Å
437	E	85.3	Confident	85.8	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.028	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-45.1	177.3	-175.2	172.1	175.5	0	0	110.7	K426 R434 A435 C441 I464 F532	K426-E437 IonicContact NZ-OE1 2.73Å; K426-E437 PolarHBondContact NZ-OE1 3.39Å; K426-E437 IonicContact NZ-OE2 3.83Å; K426-E437 PolarHBondContact NZ-OE2 3.36Å; R434-E437 WeakPolarHBondContact O-CB 3.17Å; R434-E437 PolarHBondContact O-N 3.43Å; A435-E437 PolarHBondContact O-N 2.86Å; E437-C441 VanDerWaalsContact O-CB 3.31Å; E437-C441 WeakPolarHBondContact O-CB 3.13Å; E437-C441 PolarHBondContact O-N 2.6Å; E437-C441 VanDerWaalsContact O-N 3.09Å; E437-C441 PolarHBondContact O-SG 3.19Å; E437-I464 HydrophobicContact CG-CD1 4.4Å; E437-F532 HydrophobicContact CG-CB 4.1Å
438	L	87.8	Confident	85.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-79.7	-39.8	-179.7	-67.8	-175	0	0	0	112.9	L350 A354 W357 F433 A435 E436 T440 C441 A442 L452 A455 I464	L350-L438 HydrophobicContact CD1-CD1 4.27Å; L350-L438 HydrophobicContact CG-CD1 4.4Å; A354-L438 HydrophobicContact CB-CB 4Å; A354-L438 HydrophobicContact CB-CD1 3.96Å; W357-L438 HydrophobicContact CE3-CD1 4.2Å; W357-L438 HydrophobicContact CZ3-CD1 3.67Å; F433-L438 HydrophobicContact CE2-CD1 3.88Å; F433-L438 HydrophobicContact CE2-CG 3.92Å; F433-L438 HydrophobicContact CZ-CB 4.43Å; F433-L438 HydrophobicContact CZ-CD1 3.63Å; F433-L438 HydrophobicContact CZ-CG 3.87Å; A435-L438 PolarHBondContact O-N 2.76Å; E436-L438 PolarHBondContact O-N 3.05Å; L438-T440 VanDerWaalsContact C-N 3.26Å; L438-T440 PolarHBondContact O-N 3.43Å; L438-C441 PolarHBondContact O-N 2.66Å; L438-A442 WeakPolarHBondContact O-CB 3.3Å; L438-A442 PolarHBondContact O-N 3.27Å; L438-L452 HydrophobicContact CD2-CD1 4.04Å; L438-L452 HydrophobicContact CD2-CD2 4.25Å; L438-A455 HydrophobicContact CD1-CB 3.55Å; L438-A455 HydrophobicContact CD2-CB 4.09Å; L438-I464 HydrophobicContact CD2-CD1 3.95Å; L438-I464 HydrophobicContact CD2-CG1 4.05Å; L438-I464 HydrophobicContact CD2-CG2 3.77Å; L438-I464 HydrophobicContact CG-CD1 4.38Å
439	T	85.8	Confident	86	Confident	32 Å²	32	39.8 Å²	39.8	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-37.4	177.5	59.7	0	0	0	0	111.4	A351 A435 E436 A443	A351-T439 HydrophobicContact CB-CG2 4.08Å; A435-T439 WeakPolarHBondContact O-CG2 3.45Å; A435-T439 PolarHBondContact O-N 3.39Å; A435-T439 PolarHBondContact O-OG1 3.42Å; E436-T439 WeakPolarHBondContact CA-OG1 3.39Å; E436-T439 PolarHBondContact O-OG1 3.14Å; T439-A443 PolarHBondContact O-N 3.47Å
440	T	84.1	Confident	86.2	Confident	1 Å²	1	39 Å²	39	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-71.5	-50.9	177.3	-55.2	0	0	0	0	110.5	E436 L438 A442 A443 I444 I508 F532 S535	E436-T440 WeakPolarHBondContact O-CB 3.37Å; E436-T440 PolarHBondContact O-N 3.18Å; E436-T440 PolarHBondContact O-OG1 3.15Å; L438-T440 VanDerWaalsContact C-N 3.26Å; L438-T440 PolarHBondContact O-N 3.43Å; T440-A442 VanDerWaalsContact C-N 3.28Å; T440-A442 PolarHBondContact O-N 3.31Å; T440-A443 PolarHBondContact O-N 2.66Å; T440-A443 VanDerWaalsContact O-N 3.14Å; T440-I444 HydrophobicContact CG2-CD1 3.79Å; T440-I444 VanDerWaalsContact O-CD1 3.31Å; T440-I444 WeakPolarHBondContact O-CD1 3.49Å; T440-I444 WeakPolarHBondContact O-CG1 3.25Å; T440-I444 PolarHBondContact O-N 2.81Å; T440-I508 HydrophobicContact CG2-CD1 4.13Å; T440-I508 HydrophobicContact CG2-CG1 4.39Å; T440-I508 HydrophobicContact CG2-CG2 3.55Å; T440-F532 HydrophobicContact CG2-CD1 3.93Å; T440-S535 PolarHBondContact OG1-OG 3.4Å
441	C	83.8	Confident	86.4	Confident	24 Å²	24	41.4 Å²	41.4	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-36.9	177.2	-71.1	0	0	0	0	113.3	E437 L438 A443 I444 L452 F532	E437-C441 VanDerWaalsContact O-CB 3.31Å; E437-C441 WeakPolarHBondContact O-CB 3.13Å; E437-C441 PolarHBondContact O-N 2.6Å; E437-C441 VanDerWaalsContact O-N 3.09Å; E437-C441 PolarHBondContact O-SG 3.19Å; L438-C441 PolarHBondContact O-N 2.66Å; C441-A443 VanDerWaalsContact C-N 3.29Å; C441-A443 PolarHBondContact O-N 2.59Å; C441-I444 PolarHBondContact O-N 3.21Å; C441-L452 HydrophobicContact CB-CB 4.4Å; C441-L452 HydrophobicContact CB-CD2 3.91Å; C441-F532 WeakPolarHBondContact SG-CD2 3.41Å
442	A	83.5	Confident	86.9	Confident	18 Å²	18	38.2 Å²	38.2	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-68.4	-24.6	179.2	0	0	0	0	0	113.8	P347 A351 L438 T440	P347-A442 HydrophobicContact CB-CB 3.76Å; P347-A442 VanDerWaalsContact CB-O 3.28Å; P347-A442 WeakPolarHBondContact CB-O 3.45Å; A351-A442 HydrophobicContact CB-CB 4.24Å; L438-A442 WeakPolarHBondContact O-CB 3.3Å; L438-A442 PolarHBondContact O-N 3.27Å; T440-A442 VanDerWaalsContact C-N 3.28Å; T440-A442 PolarHBondContact O-N 3.31Å
443	A	80.6	Confident	87.5	Confident	55 Å²	55	35.3 Å²	35.3	46%	0.455	20%	0.204	S	C	.	.	H	α-helix	trans	-89.2	-16.6	179.3	0	0	0	0	0	113.7	T439 T440 C441	T439-A443 PolarHBondContact O-N 3.47Å; T440-A443 PolarHBondContact O-N 2.66Å; T440-A443 VanDerWaalsContact O-N 3.14Å; C441-A443 VanDerWaalsContact C-N 3.29Å; C441-A443 PolarHBondContact O-N 2.59Å
444	I	84.8	Confident	88	Confident	18 Å²	18	34.6 Å²	34.6	9%	0.092	20%	0.2	C	C	.	.			trans	-90.2	129.9	-174.5	-64.9	157.3	0	0	0	110.8	T440 C441 V449 L503 I508 F532	T440-I444 HydrophobicContact CG2-CD1 3.79Å; T440-I444 VanDerWaalsContact O-CD1 3.31Å; T440-I444 WeakPolarHBondContact O-CD1 3.49Å; T440-I444 WeakPolarHBondContact O-CG1 3.25Å; T440-I444 PolarHBondContact O-N 2.81Å; C441-I444 PolarHBondContact O-N 3.21Å; I444-V449 HydrophobicContact CG2-CB 4Å; I444-V449 HydrophobicContact CG2-CG1 4.05Å; I444-V449 HydrophobicContact CG2-CG2 3.96Å; I444-L503 HydrophobicContact CD1-CD2 3.37Å; I444-L503 HydrophobicContact CG1-CD2 3.79Å; I444-L503 HydrophobicContact CG2-CD2 4.25Å; I444-I508 HydrophobicContact CD1-CD1 4.16Å; I444-I508 HydrophobicContact CG1-CD1 3.82Å; I444-F532 HydrophobicContact CD1-CD1 4.09Å; I444-F532 HydrophobicContact CD1-CE1 3.55Å; I444-F532 HydrophobicContact CD1-CZ 3.99Å
445	T	83.3	Confident	88.7	Confident	125 Å²	125	30.9 Å²	30.9	77%	0.767	19%	0.186	S	C	*	.			trans	-129.3	86.5	170	-62	0	0	0	0	109.2	H502	T445-H502 PolarHBondContact O-CE1 2.89Å
446	S	88	Confident	89.2	Confident	19 Å²	19	30.7 Å²	30.7	13%	0.133	18%	0.184	C	C	.	.			trans	-132.4	138.6	-176.4	174.8	0	0	0	0	112.2	K448 V449	S446-K448 PolarHBondContact O-N 3.13Å; S446-K448 PolarHBondContact OG-N 3.23Å; S446-V449 PolarHBondContact O-N 2.78Å
447	P	88.2	Confident	89.9	Confident	80 Å²	80	26.8 Å²	26.8	52%	0.519	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6.4	174.1	31.4	-36.4	0	0	0	113.9	R526	P447-R526 PolarHBondContact O-NH2 3.43Å
448	K	93.6	Very high	90.3	Very high	24 Å²	24	28.4 Å²	28.4	10%	0.104	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	7	178.3	-61.8	-57.7	-168.2	-170.7	0	114	S446 Q495 E498 L528 L529	S446-K448 PolarHBondContact O-N 3.13Å; S446-K448 PolarHBondContact OG-N 3.23Å; K448-Q495 HydrophobicContact CD-CB 4.38Å; K448-E498 WeakPolarHBondContact CE-OE1 3.44Å; K448-E498 WeakPolarHBondContact CE-OE2 3.39Å; K448-E498 HydrophobicContact CG-CB 4.11Å; K448-E498 HydrophobicContact CG-CG 4.02Å; K448-E498 IonicContact NZ-OE2 3.91Å; K448-E498 PolarHBondContact NZ-OE2 2.9Å; K448-L528 CarbonylContact O-C 3.5Å; K448-L528 VanDerWaalsContact O-CA 3.29Å; K448-L528 WeakPolarHBondContact O-CA 3.3Å; K448-L529 PolarHBondContact O-N 3.22Å
449	V	94.1	Very high	90.3	Very high	9 Å²	9	28.5 Å²	28.5	6%	0.055	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-117.3	140.4	172.5	173.5	0	0	0	0	108.4	I444 S446 P451 L503 L529 F532	I444-V449 HydrophobicContact CG2-CB 4Å; I444-V449 HydrophobicContact CG2-CG1 4.05Å; I444-V449 HydrophobicContact CG2-CG2 3.96Å; S446-V449 PolarHBondContact O-N 2.78Å; V449-P451 VanDerWaalsContact O-CD 3.25Å; V449-P451 WeakPolarHBondContact O-CD 3.49Å; V449-L503 HydrophobicContact CG2-CD2 4.41Å; V449-L529 HydrophobicContact CG2-CB 4.47Å; V449-F532 HydrophobicContact CG1-CE2 3.64Å; V449-F532 HydrophobicContact CG1-CZ 3.58Å; V449-F532 HydrophobicContact CG2-CZ 4.11Å
450	V	94.7	Very high	90.5	Very high	13 Å²	13	28.8 Å²	28.8	8%	0.079	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-65.2	119.5	179.4	174.6	0	0	0	0	109.8	L452 M466 K467 M469 L519 L528 L529 C530	V450-L452 PolarHBondContact O-N 3.08Å; V450-M466 HydrophobicContact CG1-CB 4.19Å; V450-M466 HydrophobicContact CG1-CG 4.29Å; V450-M466 HydrophobicContact CG1-SD 4.41Å; V450-K467 HydrophobicContact CG1-CB 4.17Å; V450-K467 WeakPolarHBondContact CG1-O 3.29Å; V450-M469 HydrophobicContact CG2-CG 4.4Å; V450-L519 HydrophobicContact CG2-CB 4.36Å; V450-L519 HydrophobicContact CG2-CD1 4.06Å; V450-L519 HydrophobicContact CG2-CG 4.34Å; V450-L528 HydrophobicContact CG2-CB 3.76Å; V450-L528 HydrophobicContact CG2-CD2 4.32Å; V450-L529 WeakPolarHBondContact CG2-O 3.44Å; V450-L529 PolarHBondContact N-O 3.22Å; V450-C530 HydrophobicContact CB-CB 4.2Å; V450-C530 HydrophobicContact CG2-CB 3.89Å
451	P	93.6	Very high	90.9	Very high	59 Å²	59	32.9 Å²	32.9	38%	0.383	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-61.7	129	-178.1	-26.8	35.7	0	0	0	113.2	V449 Y453 M466 K467	V449-P451 VanDerWaalsContact O-CD 3.25Å; V449-P451 WeakPolarHBondContact O-CD 3.49Å; P451-Y453 HydrophobicContact CB-CE1 4.2Å; P451-M466 CarbonylContact O-C 3.58Å; P451-M466 WeakPolarHBondContact O-CA 3.42Å; P451-K467 HydrophobicContact CB-CB 4.29Å; P451-K467 HydrophobicContact CG-CB 4.33Å; P451-K467 HydrophobicContact CG-CD 4.35Å; P451-K467 PolarHBondContact O-N 2.94Å
452	L	94.8	Very high	91.4	Very high	26 Å²	26	31.7 Å²	31.7	14%	0.136	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.7	168.8	-175.2	68.3	0	0	0	109.8	L350 L379 L438 C441 V450 I464 F465	L350-L452 HydrophobicContact CD2-CD2 3.8Å; L379-L452 HydrophobicContact CD1-CD2 3.84Å; L379-L452 HydrophobicContact CD1-CG 4.03Å; L438-L452 HydrophobicContact CD2-CD1 4.04Å; L438-L452 HydrophobicContact CD2-CD2 4.25Å; C441-L452 HydrophobicContact CB-CB 4.4Å; C441-L452 HydrophobicContact CB-CD2 3.91Å; V450-L452 PolarHBondContact O-N 3.08Å; L452-I464 HydrophobicContact CD1-CG2 3.56Å; L452-F465 WeakPolarHBondContact CD1-O 3.37Å
453	Y	96.4	Very high	92	Very high	40 Å²	40	31 Å²	31	16%	0.157	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-4	174.9	-66.6	-19.3	0	0	0	113.2	L379 N380 F421 C423 P451 F465 K467	L379-Y453 PolarHBondContact N-O 2.9Å; N380-Y453 HydrophobicContact CB-CD1 3.96Å; N380-Y453 HydrophobicContact CB-CG 4.01Å; N380-Y453 VanDerWaalsContact ND2-CD1 3.28Å; N380-Y453 WeakPolarHBondContact ND2-CD1 3.39Å; N380-Y453 WeakPolarHBondContact ND2-CD2 3.31Å; N380-Y453 VanDerWaalsContact ND2-CE1 3.3Å; N380-Y453 WeakPolarHBondContact ND2-CE1 3.27Å; N380-Y453 WeakPolarHBondContact ND2-CE2 3.36Å; F421-Y453 AromaticContact CE1-CD2 3.97Å; F421-Y453 HydrophobicContact CE1-CD2 3.97Å; F421-Y453 AromaticContact CE1-CE2 3.62Å; F421-Y453 HydrophobicContact CE1-CE2 3.62Å; F421-Y453 HydrophobicContact CZ-CD2 4.43Å; F421-Y453 AromaticContact CZ-CE2 3.63Å; F421-Y453 HydrophobicContact CZ-CE2 3.63Å; C423-Y453 HydrophobicContact CB-CD2 3.86Å; C423-Y453 HydrophobicContact CB-CE2 4.02Å; P451-Y453 HydrophobicContact CB-CE1 4.2Å; Y453-F465 WeakPolarHBondContact CA-O 3.46Å; Y453-F465 PolarHBondContact N-O 2.57Å; Y453-K467 HydrophobicContact CE1-CB 4.27Å; Y453-K467 HydrophobicContact CE2-CB 4.14Å
454	G	96.3	Very high	92.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.5	-177.7	173.5	0	0	0	0	0	112.5	V377 F465	V377-G454 WeakPolarHBondContact O-CA 3.31Å; G454-F465 PolarHBondContact N-O 3.17Å; G454-F465 PolarHBondContact O-N 2.75Å
455	A	97.2	Very high	93.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	155.2	164.3	0	0	0	0	0	111.5	L350 W357 G376 V377 L438 V462 T463 I464	L350-A455 HydrophobicContact CD1-CB 4.11Å; W357-A455 HydrophobicContact CH2-CB 4.28Å; W357-A455 HydrophobicContact CZ3-CB 3.98Å; G376-A455 WeakPolarHBondContact CA-O 3.09Å; V377-A455 PolarHBondContact N-O 3.25Å; V377-A455 VanDerWaalsContact N-O 3.09Å; V377-A455 PolarHBondContact O-N 2.84Å; V377-A455 VanDerWaalsContact O-N 3.09Å; L438-A455 HydrophobicContact CD1-CB 3.55Å; L438-A455 HydrophobicContact CD2-CB 4.09Å; A455-V462 HydrophobicContact CB-CG1 4.31Å; A455-T463 CarbonylContact C-O 3.56Å; A455-T463 WeakPolarHBondContact CA-O 3.44Å; A455-T463 WeakPolarHBondContact CB-O 3.37Å; A455-I464 HydrophobicContact CB-CB 4.45Å; A455-I464 HydrophobicContact CB-CG1 4.19Å
456	V	97.1	Very high	93.9	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.018	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	129.2	179.5	176.3	0	0	0	0	109.7	V342 N374 E375 L378 Y390 T463 F465	V342-V456 HydrophobicContact CG1-CG2 3.75Å; V342-V456 HydrophobicContact CG2-CG1 3.72Å; V342-V456 HydrophobicContact CG2-CG2 4.05Å; N374-V456 WeakPolarHBondContact ND2-CG1 3.32Å; E375-V456 CarbonylContact O-C 3.53Å; E375-V456 WeakPolarHBondContact O-CA 3.2Å; L378-V456 HydrophobicContact CD2-CG2 4.24Å; Y390-V456 HydrophobicContact CD1-CG2 4.26Å; V456-T463 PolarHBondContact N-O 2.79Å; V456-T463 PolarHBondContact O-N 2.89Å; V456-F465 HydrophobicContact CB-CE2 4.14Å; V456-F465 HydrophobicContact CG2-CE2 3.97Å
457	K	95.3	Very high	94.2	Very high	11 Å²	11	24.8 Å²	24.8	5%	0.048	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	126.2	163.7	-177.8	-177.4	-171.3	-72.1	0	108.4	W357 E370 E373 N374 E375 V430 G459 W461	W357-K457 HydrophobicContact CD2-CB 4.21Å; W357-K457 HydrophobicContact CG-CD 4.27Å; W357-K457 HydrophobicContact CZ2-CB 3.97Å; E370-K457 IonicContact OE1-NZ 3.32Å; E373-K457 IonicContact OE2-NZ 3.74Å; E373-K457 PolarHBondContact OE2-NZ 2.88Å; N374-K457 WeakPolarHBondContact CA-O 3.4Å; E375-K457 HydrophobicContact CG-CB 4Å; E375-K457 HydrophobicContact CG-CD 4.33Å; E375-K457 PolarHBondContact N-O 3.37Å; E375-K457 PolarHBondContact O-N 2.8Å; V430-K457 HydrophobicContact CG2-CG 4.37Å; K457-G459 WeakPolarHBondContact CE-O 3.13Å; K457-G459 WeakPolarHBondContact CG-O 3.4Å; K457-G459 PolarHBondContact NZ-O 2.82Å; K457-W461 CarbonylContact C-O 3.43Å; K457-W461 VanDerWaalsContact CA-O 3.3Å; K457-W461 WeakPolarHBondContact CA-O 3.36Å
458	E	93.1	Very high	94.6	Very high	40 Å²	40	22 Å²	22	19%	0.187	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	99.3	169.1	-173.6	167.1	-161.3	0	0	107.8	E373 R391 E392 W461	E373-E458 WeakPolarHBondContact O-CA 3.38Å; R391-E458 VanDerWaalsContact CB-OE1 3.22Å; R391-E458 WeakPolarHBondContact CB-OE1 3.45Å; R391-E458 VanDerWaalsContact CG-OE1 3.25Å; R391-E458 WeakPolarHBondContact CG-OE1 3.49Å; R391-E458 IonicContact NH1-OE1 2.8Å; E392-E458 PolarHBondContact N-OE2 3Å; E458-W461 PolarHBondContact N-O 2.88Å; E458-W461 PolarHBondContact O-N 2.88Å; E458-W461 VanDerWaalsContact O-N 3.1Å
459	G	88.6	Confident	94.6	Very high	2 Å²	2	21.4 Å²	21.4	2%	0.021	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	-117.3	-168	0	0	0	0	0	113.8	E370 E373 K457 W461	E370-G459 WeakPolarHBondContact O-CA 3.46Å; E373-G459 PolarHBondContact O-N 2.86Å; K457-G459 WeakPolarHBondContact CE-O 3.13Å; K457-G459 WeakPolarHBondContact CG-O 3.4Å; K457-G459 PolarHBondContact NZ-O 2.82Å; G459-W461 VanDerWaalsContact C-N 3.25Å; G459-W461 PolarHBondContact O-N 3.4Å
460	P	89.6	Confident	94.6	Very high	38 Å²	38	26.2 Å²	26.2	25%	0.247	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.8	-177.5	35.3	-36.7	0	0	0	114.3	Q429 V430	Q429-P460 WeakPolarHBondContact CA-O 3.24Å; V430-P460 WeakPolarHBondContact CG2-O 3.44Å; V430-P460 PolarHBondContact N-O 2.94Å
461	W	92.2	Very high	94.5	Very high	86 Å²	86	26.2 Å²	26.2	33%	0.326	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.7	-179.5	-61	96.8	0	0	0	112	K427 V428 Q429 K457 E458 G459	K427-W461 HydrophobicContact CB-CE3 4.35Å; V428-W461 CarbonylContact O-C 3.45Å; V428-W461 WeakPolarHBondContact O-CA 3.47Å; Q429-W461 HydrophobicContact CG-CD2 4.41Å; Q429-W461 HydrophobicContact CG-CE3 3.77Å; Q429-W461 HydrophobicContact CG-CH2 3.75Å; Q429-W461 HydrophobicContact CG-CZ2 4.36Å; Q429-W461 HydrophobicContact CG-CZ3 3.42Å; Q429-W461 VanDerWaalsContact CG-CZ3 3.42Å; K457-W461 CarbonylContact C-O 3.43Å; K457-W461 VanDerWaalsContact CA-O 3.3Å; K457-W461 WeakPolarHBondContact CA-O 3.36Å; E458-W461 PolarHBondContact N-O 2.88Å; E458-W461 PolarHBondContact O-N 2.88Å; E458-W461 VanDerWaalsContact O-N 3.1Å; G459-W461 VanDerWaalsContact C-N 3.25Å; G459-W461 PolarHBondContact O-N 3.4Å
462	V	94.3	Very high	94.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124	161.4	-176.2	0	0	0	0	108.2	W357 V428 V430 F433 A455 I464	W357-V462 HydrophobicContact CD2-CG2 4.46Å; W357-V462 HydrophobicContact CE3-CG1 3.8Å; W357-V462 HydrophobicContact CE3-CG2 4.01Å; W357-V462 HydrophobicContact CZ3-CG1 3.69Å; V428-V462 PolarHBondContact N-O 3.35Å; V428-V462 PolarHBondContact O-N 3.07Å; V430-V462 HydrophobicContact CG2-CG2 3.83Å; F433-V462 HydrophobicContact CB-CG2 4.14Å; F433-V462 HydrophobicContact CD1-CG2 4.09Å; F433-V462 HydrophobicContact CD2-CB 3.97Å; F433-V462 HydrophobicContact CD2-CG1 3.96Å; F433-V462 HydrophobicContact CD2-CG2 4.03Å; F433-V462 HydrophobicContact CE2-CB 4.44Å; F433-V462 HydrophobicContact CE2-CG1 3.92Å; F433-V462 HydrophobicContact CG-CB 4.23Å; F433-V462 HydrophobicContact CG-CG2 3.78Å; F433-V462 HydrophobicContact CZ-CG1 4.46Å; A455-V462 HydrophobicContact CB-CG1 4.31Å; V462-I464 HydrophobicContact CG1-CG1 4.14Å
463	T	95.9	Very high	94.6	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.012	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.3	174.7	-52.8	0	0	0	0	109	W396 A425 K427 A455 V456 F465	W396-T463 HydrophobicContact CH2-CG2 3.98Å; W396-T463 HydrophobicContact CZ2-CG2 3.84Å; A425-T463 HydrophobicContact CB-CG2 3.81Å; K427-T463 WeakPolarHBondContact CE-OG1 3.47Å; K427-T463 HydrophobicContact CG-CG2 4.11Å; A455-T463 CarbonylContact C-O 3.56Å; A455-T463 WeakPolarHBondContact CA-O 3.44Å; A455-T463 WeakPolarHBondContact CB-O 3.37Å; V456-T463 PolarHBondContact N-O 2.79Å; V456-T463 PolarHBondContact O-N 2.89Å; T463-F465 HydrophobicContact CG2-CD1 4.33Å; T463-F465 HydrophobicContact CG2-CE1 3.65Å; T463-F465 HydrophobicContact CG2-CE2 3.97Å; T463-F465 HydrophobicContact CG2-CZ 3.43Å; T463-F465 VanDerWaalsContact CG2-CZ 3.43Å
464	I	95.8	Very high	94.6	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.015	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.1	-179	-53.6	178.6	0	0	0	108.7	A425 K426 F433 E437 L438 L452 A455 V462 M466	A425-I464 CarbonylContact C-O 3.57Å; A425-I464 WeakPolarHBondContact CA-O 3.32Å; K426-I464 HydrophobicContact CB-CB 4.37Å; K426-I464 HydrophobicContact CD-CD1 4.5Å; K426-I464 PolarHBondContact N-O 2.84Å; K426-I464 PolarHBondContact O-N 3.23Å; F433-I464 HydrophobicContact CE2-CD1 4.17Å; E437-I464 HydrophobicContact CG-CD1 4.4Å; L438-I464 HydrophobicContact CD2-CD1 3.95Å; L438-I464 HydrophobicContact CD2-CG1 4.05Å; L438-I464 HydrophobicContact CD2-CG2 3.77Å; L438-I464 HydrophobicContact CG-CD1 4.38Å; L452-I464 HydrophobicContact CD1-CG2 3.56Å; A455-I464 HydrophobicContact CB-CB 4.45Å; A455-I464 HydrophobicContact CB-CG1 4.19Å; V462-I464 HydrophobicContact CG1-CG1 4.14Å; I464-M466 HydrophobicContact CB-CE 4.4Å; I464-M466 HydrophobicContact CG2-CE 3.93Å
465	F	96.6	Very high	94.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.1	-179.9	-56.9	-80.2	0	0	0	110.4	L378 L383 Y390 W396 I414 A424 A425 L452 Y453 G454 V456 T463	L378-F465 HydrophobicContact CD2-CD2 3.92Å; L378-F465 HydrophobicContact CD2-CE2 4.28Å; L383-F465 HydrophobicContact CD1-CB 3.72Å; L383-F465 HydrophobicContact CD1-CD1 4.45Å; L383-F465 HydrophobicContact CD1-CG 4.03Å; Y390-F465 HydrophobicContact CD1-CE2 4.02Å; Y390-F465 AromaticContact CD1-CZ 3.88Å; Y390-F465 HydrophobicContact CD1-CZ 3.88Å; Y390-F465 AromaticContact CE1-CE1 3.91Å; Y390-F465 HydrophobicContact CE1-CE1 3.91Å; Y390-F465 AromaticContact CE1-CE2 3.92Å; Y390-F465 HydrophobicContact CE1-CE2 3.92Å; Y390-F465 AromaticContact CE1-CZ 3.55Å; Y390-F465 HydrophobicContact CE1-CZ 3.55Å; W396-F465 HydrophobicContact CD2-CE1 4.16Å; W396-F465 HydrophobicContact CD2-CZ 4.43Å; W396-F465 AromaticContact CE2-CE1 3.97Å; W396-F465 AromaticContact CE2-CZ 3.82Å; W396-F465 HydrophobicContact CZ2-CE1 4.26Å; W396-F465 HydrophobicContact CZ2-CZ 4.08Å; W396-F465 AromaticContact NE1-CZ 3.76Å; I414-F465 HydrophobicContact CD1-CD1 4.14Å; I414-F465 HydrophobicContact CD1-CE1 4.08Å; I414-F465 HydrophobicContact CG1-CD1 4.4Å; I414-F465 HydrophobicContact CG1-CE1 4.46Å; A424-F465 WeakPolarHBondContact O-CA 3.42Å; A425-F465 HydrophobicContact CB-CD1 3.88Å; A425-F465 HydrophobicContact CB-CE1 3.98Å; L452-F465 WeakPolarHBondContact CD1-O 3.37Å; Y453-F465 WeakPolarHBondContact CA-O 3.46Å; Y453-F465 PolarHBondContact N-O 2.57Å; G454-F465 PolarHBondContact N-O 3.17Å; G454-F465 PolarHBondContact O-N 2.75Å; V456-F465 HydrophobicContact CB-CE2 4.14Å; V456-F465 HydrophobicContact CG2-CE2 3.97Å; T463-F465 HydrophobicContact CG2-CD1 4.33Å; T463-F465 HydrophobicContact CG2-CE1 3.65Å; T463-F465 HydrophobicContact CG2-CE2 3.97Å; T463-F465 HydrophobicContact CG2-CZ 3.43Å; T463-F465 VanDerWaalsContact CG2-CZ 3.43Å
466	M	95.7	Very high	94.5	Very high	24 Å²	24	24.8 Å²	24.8	12%	0.118	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	166.9	-176.2	66.7	-170.5	71.7	0	0	111.8	C423 A424 K426 V450 P451 I464 L468	C423-M466 WeakPolarHBondContact CB-O 3.37Å; A424-M466 HydrophobicContact CB-CG 3.9Å; A424-M466 PolarHBondContact N-O 2.96Å; A424-M466 PolarHBondContact O-N 2.66Å; K426-M466 HydrophobicContact CB-CE 3.88Å; V450-M466 HydrophobicContact CG1-CB 4.19Å; V450-M466 HydrophobicContact CG1-CG 4.29Å; V450-M466 HydrophobicContact CG1-SD 4.41Å; P451-M466 CarbonylContact O-C 3.58Å; P451-M466 WeakPolarHBondContact O-CA 3.42Å; I464-M466 HydrophobicContact CB-CE 4.4Å; I464-M466 HydrophobicContact CG2-CE 3.93Å; M466-L468 PolarHBondContact O-N 2.78Å
467	K	95.7	Very high	94.4	Very high	61 Å²	61	24.8 Å²	24.8	27%	0.265	13%	0.126	S	C	.	.			trans	-58.9	125.3	176.6	-175	-169	173	-157	0	111.1	V450 P451 Y453 M469	V450-K467 HydrophobicContact CG1-CB 4.17Å; V450-K467 WeakPolarHBondContact CG1-O 3.29Å; P451-K467 HydrophobicContact CB-CB 4.29Å; P451-K467 HydrophobicContact CG-CB 4.33Å; P451-K467 HydrophobicContact CG-CD 4.35Å; P451-K467 PolarHBondContact O-N 2.94Å; Y453-K467 HydrophobicContact CE1-CB 4.27Å; Y453-K467 HydrophobicContact CE2-CB 4.14Å; K467-M469 HydrophobicContact CD-SD 3.85Å; K467-M469 HydrophobicContact CG-SD 4.45Å; K467-M469 PolarHBondContact NZ-SD 2.87Å
468	L	95.4	Very high	94.5	Very high	22 Å²	22	24.3 Å²	24.3	12%	0.115	12%	0.124	C	C	.	.			trans	-69.3	137.1	168.2	-176.9	63.7	0	0	0	111.3	L403 K413 A424 M466 E470	L403-L468 HydrophobicContact CD1-CD1 3.73Å; K413-L468 HydrophobicContact CD-CD2 3.6Å; K413-L468 HydrophobicContact CG-CD2 3.88Å; A424-L468 HydrophobicContact CB-CB 4.42Å; A424-L468 HydrophobicContact CB-CD1 4.12Å; M466-L468 PolarHBondContact O-N 2.78Å; L468-E470 HydrophobicContact CD2-CG 4.45Å; L468-E470 VanDerWaalsContact CD2-OE1 3.23Å; L468-E470 WeakPolarHBondContact CD2-OE1 3.13Å; L468-E470 HydrophobicContact CG-CG 4.42Å
469	M	95.1	Very high	94.5	Very high	11 Å²	11	28.6 Å²	28.6	5%	0.054	14%	0.142	C	C	.	.			trans	-125.7	94.6	-179.4	-68.1	-67.1	-64.8	0	0	108	V450 K467 G471 G472 L519 L520 L528	V450-M469 HydrophobicContact CG2-CG 4.4Å; K467-M469 HydrophobicContact CD-SD 3.85Å; K467-M469 HydrophobicContact CG-SD 4.45Å; K467-M469 PolarHBondContact NZ-SD 2.87Å; M469-G471 PolarHBondContact O-N 3.2Å; M469-G471 VanDerWaalsContact O-N 3.08Å; M469-G472 PolarHBondContact O-N 3.09Å; M469-G472 VanDerWaalsContact O-N 3.13Å; M469-L519 HydrophobicContact CB-CB 3.73Å; M469-L519 HydrophobicContact CB-CD1 4.08Å; M469-L519 HydrophobicContact CG-CB 3.94Å; M469-L519 HydrophobicContact CG-CD1 4.19Å; M469-L520 CarbonylContact C-O 3.56Å; M469-L520 WeakPolarHBondContact CB-O 3.24Å; M469-L528 HydrophobicContact CE-CD1 3.8Å; M469-L528 HydrophobicContact CE-CD2 4.18Å; M469-L528 HydrophobicContact CE-CG 4.41Å; M469-L528 HydrophobicContact SD-CD2 4.2Å
470	E	92.9	Very high	94.7	Very high	109 Å²	109	34.4 Å²	34.4	51%	0.509	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.7	-167.5	-56.3	-79.1	-160.2	0	0	114.2	K413 L468 G472 D522	K413-E470 IonicContact NZ-OE1 2.74Å; K413-E470 PolarHBondContact NZ-OE1 3.43Å; K413-E470 IonicContact NZ-OE2 3.16Å; K413-E470 PolarHBondContact NZ-OE2 2.85Å; L468-E470 HydrophobicContact CD2-CG 4.45Å; L468-E470 VanDerWaalsContact CD2-OE1 3.23Å; L468-E470 WeakPolarHBondContact CD2-OE1 3.13Å; L468-E470 HydrophobicContact CG-CG 4.42Å; E470-G472 VanDerWaalsContact C-N 3.25Å; E470-G472 PolarHBondContact O-N 2.66Å; E470-D522 HydrophobicContact CB-CB 4.14Å
471	G	93.3	Very high	94.8	Very high	13 Å²	13	33.1 Å²	33.1	13%	0.134	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-11.4	171.6	0	0	0	0	0	114.2	M469 L520 S521	M469-G471 PolarHBondContact O-N 3.2Å; M469-G471 VanDerWaalsContact O-N 3.08Å; G471-L520 VanDerWaalsContact CA-O 3.24Å; G471-L520 WeakPolarHBondContact CA-O 3.43Å; G471-L520 PolarHBondContact N-O 3.28Å; G471-S521 WeakPolarHBondContact CA-O 3.44Å
472	G	93.9	Very high	94.9	Very high	20 Å²	20	29.2 Å²	29.2	21%	0.206	15%	0.147	C	C	.	.			trans	77.6	-165.3	-174.2	0	0	0	0	0	112.7	M469 E470 L519 L520	M469-G472 PolarHBondContact O-N 3.09Å; M469-G472 VanDerWaalsContact O-N 3.13Å; E470-G472 VanDerWaalsContact C-N 3.25Å; E470-G472 PolarHBondContact O-N 2.66Å; G472-L519 WeakPolarHBondContact O-CA 3.34Å; G472-L520 PolarHBondContact O-N 3.41Å
473	S	96	Very high	94.9	Very high	9 Å²	9	30 Å²	30	6%	0.063	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-85.7	152.8	172.6	78.9	0	0	0	0	112.3	G475 Q476 L477 D516 V518	S473-G475 PolarHBondContact O-N 3.09Å; S473-G475 PolarHBondContact OG-N 3.24Å; S473-Q476 WeakPolarHBondContact O-CA 3.49Å; S473-Q476 WeakPolarHBondContact O-CB 3.46Å; S473-Q476 PolarHBondContact O-N 3.49Å; S473-Q476 WeakPolarHBondContact OG-CG 3.31Å; S473-Q476 PolarHBondContact OG-N 3.36Å; S473-L477 PolarHBondContact O-N 3.03Å; S473-D516 WeakPolarHBondContact CB-O 3.46Å; S473-V518 CarbonylContact C-O 3.59Å; S473-V518 VanDerWaalsContact CA-O 3.31Å; S473-V518 WeakPolarHBondContact CA-O 3.45Å
474	L	97.4	Very high	95	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.7	-33	171.5	175.2	62.3	0	0	0	111.2	L477 I478 L484 Y492 A515 V518 L520 M582 M586	L474-L477 PolarHBondContact O-N 3.44Å; L474-I478 WeakPolarHBondContact O-CG1 3.05Å; L474-I478 PolarHBondContact O-N 2.89Å; L474-L484 HydrophobicContact CD1-CD1 3.65Å; L474-Y492 HydrophobicContact CD1-CD2 3.4Å; L474-Y492 HydrophobicContact CD1-CE2 3.75Å; L474-Y492 HydrophobicContact CD1-CG 4.08Å; L474-A515 CarbonylContact C-O 3.58Å; L474-A515 HydrophobicContact CB-CB 4.44Å; L474-A515 WeakPolarHBondContact CB-O 2.83Å; L474-A515 HydrophobicContact CD2-CB 4.43Å; L474-A515 HydrophobicContact CG-CB 4.14Å; L474-A515 PolarHBondContact N-O 3.06Å; L474-V518 HydrophobicContact CB-CB 3.98Å; L474-V518 HydrophobicContact CB-CG1 4.09Å; L474-V518 HydrophobicContact CD2-CB 4.02Å; L474-V518 HydrophobicContact CD2-CG1 3.92Å; L474-V518 HydrophobicContact CD2-CG2 4.46Å; L474-V518 PolarHBondContact N-O 3.23Å; L474-L520 HydrophobicContact CB-CD2 4.48Å; L474-L520 HydrophobicContact CD1-CD1 4.46Å; L474-M582 HydrophobicContact CD2-SD 4.15Å; L474-M586 HydrophobicContact CD1-CG 4.44Å; L474-M586 HydrophobicContact CD1-SD 4.02Å; L474-M586 HydrophobicContact CD2-CG 4.36Å; L474-M586 HydrophobicContact CD2-SD 3.73Å; L474-M586 HydrophobicContact CG-CG 4.49Å; L474-M586 HydrophobicContact CG-SD 4.26Å
475	G	96	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-37.6	171.9	0	0	0	0	0	113.3	S473 K479 A515 D516	S473-G475 PolarHBondContact O-N 3.09Å; S473-G475 PolarHBondContact OG-N 3.24Å; G475-K479 WeakPolarHBondContact O-CB 3.4Å; G475-K479 WeakPolarHBondContact O-CD 3.48Å; G475-K479 WeakPolarHBondContact O-CG 3.47Å; G475-K479 PolarHBondContact O-N 3.14Å; G475-K479 VanDerWaalsContact O-N 3.08Å; G475-A515 VanDerWaalsContact N-C 3.3Å; G475-A515 PolarHBondContact N-O 2.99Å; G475-D516 WeakPolarHBondContact CA-OD1 3.43Å
476	Q	94.4	Very high	95	Very high	66 Å²	66	32.8 Å²	32.8	31%	0.308	17%	0.167	S	C	.	.	H	α-helix	trans	-65.4	-40.3	169.6	-71.4	166.6	-18.4	0	0	111.4	L403 S473 K479 Q480	L403-Q476 PolarHBondContact O-NE2 2.96Å; S473-Q476 WeakPolarHBondContact O-CA 3.49Å; S473-Q476 WeakPolarHBondContact O-CB 3.46Å; S473-Q476 PolarHBondContact O-N 3.49Å; S473-Q476 WeakPolarHBondContact OG-CG 3.31Å; S473-Q476 PolarHBondContact OG-N 3.36Å; Q476-K479 PolarHBondContact O-N 2.71Å; Q476-Q480 WeakPolarHBondContact O-CB 3.33Å; Q476-Q480 VanDerWaalsContact O-CG 3.27Å; Q476-Q480 WeakPolarHBondContact O-CG 3.45Å; Q476-Q480 PolarHBondContact O-N 2.81Å
477	L	95.8	Very high	95.1	Very high	4 Å²	4	32 Å²	32	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-40.5	176.9	-175.4	65.8	0	0	0	112.4	S473 L474 Q480 S481 L484 Y492 L520 W662 K663	S473-L477 PolarHBondContact O-N 3.03Å; L474-L477 PolarHBondContact O-N 3.44Å; L477-Q480 PolarHBondContact O-N 3.31Å; L477-S481 VanDerWaalsContact O-CB 3.27Å; L477-S481 WeakPolarHBondContact O-CB 3.13Å; L477-S481 PolarHBondContact O-N 3.15Å; L477-S481 PolarHBondContact O-OG 3.39Å; L477-L484 HydrophobicContact CD2-CD2 4.23Å; L477-L484 HydrophobicContact CG-CD2 4.11Å; L477-Y492 HydrophobicContact CD2-CE2 3.9Å; L477-L520 HydrophobicContact CB-CD1 4.11Å; L477-L520 HydrophobicContact CD2-CD1 3.58Å; L477-L520 HydrophobicContact CG-CD1 4.43Å; L477-W662 HydrophobicContact CD1-CE3 4.38Å; L477-W662 HydrophobicContact CD2-CE3 4.3Å; L477-K663 HydrophobicContact CD1-CG 4.01Å
478	I	96.1	Very high	95.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-60.5	-50.7	172.6	-64	163.5	0	0	0	109.6	L474 Q480 S481 G482 L484 A515 M586	L474-I478 WeakPolarHBondContact O-CG1 3.05Å; L474-I478 PolarHBondContact O-N 2.89Å; I478-Q480 PolarHBondContact O-N 2.99Å; I478-S481 PolarHBondContact O-N 3.47Å; I478-S481 VanDerWaalsContact O-N 3.13Å; I478-G482 CarbonylContact O-C 3.52Å; I478-G482 WeakPolarHBondContact O-CA 3.48Å; I478-G482 PolarHBondContact O-N 3.2Å; I478-L484 HydrophobicContact CG1-CD1 4.12Å; I478-L484 HydrophobicContact CG1-CG 4.11Å; I478-A515 HydrophobicContact CD1-CB 3.59Å; I478-M586 HydrophobicContact CD1-CB 4.47Å; I478-M586 HydrophobicContact CD1-CG 3.86Å; I478-M586 HydrophobicContact CG1-CG 4.39Å
479	K	93.4	Very high	95.3	Very high	130 Å²	130	29.9 Å²	29.9	57%	0.565	15%	0.152	S	C	*	.	H	α-helix	trans	-58.9	-31.1	179.1	-68.7	158.1	-166.8	159.5	0	112.9	G475 Q476 D516	G475-K479 WeakPolarHBondContact O-CB 3.4Å; G475-K479 WeakPolarHBondContact O-CD 3.48Å; G475-K479 WeakPolarHBondContact O-CG 3.47Å; G475-K479 PolarHBondContact O-N 3.14Å; G475-K479 VanDerWaalsContact O-N 3.08Å; Q476-K479 PolarHBondContact O-N 2.71Å; K479-D516 VanDerWaalsContact NZ-CG 3.31Å; K479-D516 IonicContact NZ-OD1 2.78Å; K479-D516 PolarHBondContact NZ-OD1 2.97Å; K479-D516 IonicContact NZ-OD2 2.66Å; K479-D516 PolarHBondContact NZ-OD2 3.25Å; K479-D516 VanDerWaalsContact NZ-OD2 3.08Å
480	Q	92.9	Very high	95.5	Very high	124 Å²	124	29.3 Å²	29.3	58%	0.579	15%	0.149	S	C	*	.	H	α-helix	trans	-81.3	-35.6	175.5	-71.4	169.5	22.5	0	0	113.6	Q476 L477 I478	Q476-Q480 WeakPolarHBondContact O-CB 3.33Å; Q476-Q480 VanDerWaalsContact O-CG 3.27Å; Q476-Q480 WeakPolarHBondContact O-CG 3.45Å; Q476-Q480 PolarHBondContact O-N 2.81Å; L477-Q480 PolarHBondContact O-N 3.31Å; I478-Q480 PolarHBondContact O-N 2.99Å
481	S	92.5	Very high	95.7	Very high	11 Å²	11	25 Å²	25	8%	0.077	13%	0.131	C	C	.	.	H	α-helix	trans	-93.5	-10.1	-175.1	-46.8	0	0	0	0	113.4	L477 I478 C483 R667	L477-S481 VanDerWaalsContact O-CB 3.27Å; L477-S481 WeakPolarHBondContact O-CB 3.13Å; L477-S481 PolarHBondContact O-N 3.15Å; L477-S481 PolarHBondContact O-OG 3.39Å; I478-S481 PolarHBondContact O-N 3.47Å; I478-S481 VanDerWaalsContact O-N 3.13Å; S481-C483 PolarHBondContact O-N 3.31Å; S481-R667 PolarHBondContact O-N 3.25Å
482	G	94.1	Very high	96	Very high	4 Å²	4	24.5 Å²	24.5	4%	0.041	13%	0.125	C	C	.	.	S	Bend	trans	76.1	-67.2	-168.2	0	0	0	0	0	111.5	I478 G589 R667	I478-G482 CarbonylContact O-C 3.52Å; I478-G482 WeakPolarHBondContact O-CA 3.48Å; I478-G482 PolarHBondContact O-N 3.2Å; G482-G589 WeakPolarHBondContact O-CA 3.24Å; G482-R667 CarbonylContact C-O 3.52Å; G482-R667 VanDerWaalsContact CA-O 3.26Å; G482-R667 WeakPolarHBondContact CA-O 3.47Å
483	C	94.8	Very high	96.2	Very high	17 Å²	17	23.5 Å²	23.5	12%	0.115	12%	0.115	C	C	.	.	S	Bend	trans	-142.1	165.5	166.7	71.2	0	0	0	0	111.9	S481 R667	S481-C483 PolarHBondContact O-N 3.31Å; C483-R667 PolarHBondContact N-O 2.83Å; C483-R667 VanDerWaalsContact SG-CB 3.53Å
484	L	96.4	Very high	96.3	Very high	7 Å²	7	23.7 Å²	23.7	4%	0.037	12%	0.118	C	C	.	.			trans	-99.5	146.6	-176.9	-55.8	-172.6	0	0	0	112	L474 L477 I478 Y492 M586	L474-L484 HydrophobicContact CD1-CD1 3.65Å; L477-L484 HydrophobicContact CD2-CD2 4.23Å; L477-L484 HydrophobicContact CG-CD2 4.11Å; I478-L484 HydrophobicContact CG1-CD1 4.12Å; I478-L484 HydrophobicContact CG1-CG 4.11Å; L484-Y492 HydrophobicContact CD1-CD2 4.02Å; L484-Y492 HydrophobicContact CD1-CE2 4.08Å; L484-M586 HydrophobicContact CB-CB 4.43Å; L484-M586 HydrophobicContact CD1-CB 4.1Å; L484-M586 HydrophobicContact CD1-CG 3.84Å; L484-M586 HydrophobicContact CD1-SD 3.96Å; L484-M586 HydrophobicContact CG-CB 4.43Å; L484-M586 PolarHBondContact N-O 3.34Å
485	P	95.9	Very high	96.4	Very high	17 Å²	17	24.8 Å²	24.8	11%	0.11	12%	0.123	C	C	.	.			trans	-66.8	154.4	169.1	28.9	-32.3	0	0	0	111.3	D487 R488 A489 S660	P485-D487 VanDerWaalsContact C-N 3.35Å; P485-D487 WeakPolarHBondContact CB-OD1 3.49Å; P485-D487 PolarHBondContact O-N 3.17Å; P485-R488 HydrophobicContact CG-CB 3.96Å; P485-R488 HydrophobicContact CG-CG 3.87Å; P485-R488 PolarHBondContact O-N 3.18Å; P485-R488 VanDerWaalsContact O-N 3.15Å; P485-A489 PolarHBondContact O-N 3.16Å; P485-S660 WeakPolarHBondContact CB-OG 3.2Å; P485-S660 VanDerWaalsContact CG-CB 3.44Å; P485-S660 VanDerWaalsContact CG-OG 3.3Å; P485-S660 WeakPolarHBondContact CG-OG 3.12Å
486	E	97.4	Very high	96.5	Very high	38 Å²	38	24.9 Å²	24.9	18%	0.178	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-39.4	-172.7	-177.3	168	-164.2	0	0	113.6	R488 A489 L490 L587 C619 N620 T623 V655	E486-R488 PolarHBondContact O-N 3.02Å; E486-A489 PolarHBondContact O-N 3.02Å; E486-L490 HydrophobicContact CG-CD1 3.96Å; E486-L490 HydrophobicContact CG-CG 4.4Å; E486-L490 WeakPolarHBondContact O-CB 3.42Å; E486-L490 VanDerWaalsContact O-CG 3.3Å; E486-L490 WeakPolarHBondContact O-CG 3.34Å; E486-L490 PolarHBondContact O-N 3.42Å; E486-L587 HydrophobicContact CB-CD2 4.47Å; E486-C619 WeakPolarHBondContact OE1-CA 3.39Å; E486-C619 WeakPolarHBondContact OE1-CB 3.42Å; E486-C619 WeakPolarHBondContact OE2-CA 3.39Å; E486-N620 WeakPolarHBondContact OE1-CB 3.11Å; E486-N620 PolarHBondContact OE1-N 2.95Å; E486-N620 PolarHBondContact OE2-N 2.84Å; E486-T623 HydrophobicContact CG-CG2 4.29Å; E486-T623 WeakPolarHBondContact OE1-CB 3.41Å; E486-T623 WeakPolarHBondContact OE1-CG2 3.49Å; E486-T623 PolarHBondContact OE1-OG1 3.32Å; E486-V655 HydrophobicContact CG-CG1 4.43Å
487	D	97.3	Very high	96.7	Very high	9 Å²	9	21.8 Å²	21.8	5%	0.048	11%	0.11	C	C	.	.	H	α-helix	trans	-63.1	-39.5	177.1	70.2	-53	0	0	0	112.4	P485 S491 L652 V655 G657 V658 T659 S660	P485-D487 VanDerWaalsContact C-N 3.35Å; P485-D487 WeakPolarHBondContact CB-OD1 3.49Å; P485-D487 PolarHBondContact O-N 3.17Å; D487-S491 VanDerWaalsContact O-CB 3.26Å; D487-S491 WeakPolarHBondContact O-CB 3.37Å; D487-S491 PolarHBondContact O-N 3.37Å; D487-L652 HydrophobicContact CB-CD1 4.24Å; D487-L652 WeakPolarHBondContact O-CD1 3.31Å; D487-V655 HydrophobicContact CB-CG2 4.12Å; D487-G657 WeakPolarHBondContact CB-O 3.45Å; D487-V658 WeakPolarHBondContact OD2-CA 3.3Å; D487-T659 PolarHBondContact OD2-N 3.11Å; D487-S660 VanDerWaalsContact OD1-CB 3.27Å; D487-S660 WeakPolarHBondContact OD1-CB 3.5Å; D487-S660 PolarHBondContact OD1-OG 2.89Å; D487-S660 WeakPolarHBondContact OD2-CB 3.48Å; D487-S660 PolarHBondContact OD2-N 2.73Å; D487-S660 PolarHBondContact OD2-OG 2.72Å
488	R	97.1	Very high	96.8	Very high	37 Å²	37	25.1 Å²	25.1	14%	0.14	13%	0.125	C	C	.	.	H	α-helix	trans	-72.6	-40.2	174.8	-71	-72.9	175.9	178.4	-5.9	112	P485 E486 S491 Y492 G524 S660	P485-R488 HydrophobicContact CG-CB 3.96Å; P485-R488 HydrophobicContact CG-CG 3.87Å; P485-R488 PolarHBondContact O-N 3.18Å; P485-R488 VanDerWaalsContact O-N 3.15Å; E486-R488 PolarHBondContact O-N 3.02Å; R488-S491 PolarHBondContact O-N 3.25Å; R488-Y492 HydrophobicContact CB-CE2 4.3Å; R488-Y492 WeakPolarHBondContact O-CD2 2.95Å; R488-Y492 PolarHBondContact O-N 2.75Å; R488-G524 PolarHBondContact NH1-O 2.77Å; R488-S660 VanDerWaalsContact CZ-O 3.28Å; R488-S660 PolarHBondContact NE-O 2.95Å; R488-S660 PolarHBondContact NH2-O 3.49Å
489	A	98.3	Very high	96.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-46.3	177	0	0	0	0	0	111.5	P485 E486 L493 M583 M586 L587	P485-A489 PolarHBondContact O-N 3.16Å; E486-A489 PolarHBondContact O-N 3.02Å; A489-L493 VanDerWaalsContact O-CB 3.24Å; A489-L493 WeakPolarHBondContact O-CB 3.47Å; A489-L493 PolarHBondContact O-N 3.21Å; A489-M583 HydrophobicContact CB-CE 3.88Å; A489-M583 HydrophobicContact CB-SD 3.73Å; A489-M586 HydrophobicContact CB-CB 3.96Å; A489-M586 HydrophobicContact CB-CE 4.26Å; A489-M586 HydrophobicContact CB-SD 4.24Å; A489-M586 VanDerWaalsContact O-CE 3.29Å; A489-M586 WeakPolarHBondContact O-CE 3.43Å; A489-L587 HydrophobicContact CB-CD2 3.87Å; A489-L587 HydrophobicContact CB-CG 4.28Å
490	L	98.7	Very high	97.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-44.3	172.9	-74.5	167.8	0	0	0	111.9	E486 L493 G494 M583 T623 I626 T648 A651 L652 V655	E486-L490 HydrophobicContact CG-CD1 3.96Å; E486-L490 HydrophobicContact CG-CG 4.4Å; E486-L490 WeakPolarHBondContact O-CB 3.42Å; E486-L490 VanDerWaalsContact O-CG 3.3Å; E486-L490 WeakPolarHBondContact O-CG 3.34Å; E486-L490 PolarHBondContact O-N 3.42Å; L490-L493 PolarHBondContact O-N 3.46Å; L490-G494 PolarHBondContact O-N 2.88Å; L490-M583 HydrophobicContact CD2-CE 3.77Å; L490-M583 HydrophobicContact CG-CE 3.88Å; L490-T623 HydrophobicContact CD2-CG2 4.09Å; L490-T623 HydrophobicContact CG-CG2 4.48Å; L490-I626 HydrophobicContact CD2-CD1 4.16Å; L490-T648 HydrophobicContact CB-CG2 4.38Å; L490-T648 HydrophobicContact CD2-CG2 3.98Å; L490-T648 VanDerWaalsContact O-CG2 3.24Å; L490-T648 WeakPolarHBondContact O-CG2 3.46Å; L490-A651 HydrophobicContact CD1-CB 4.21Å; L490-A651 HydrophobicContact CD2-CB 4Å; L490-L652 HydrophobicContact CB-CB 4.25Å; L490-L652 HydrophobicContact CB-CD1 4.12Å; L490-V655 HydrophobicContact CD1-CG1 4.31Å; L490-V655 HydrophobicContact CD1-CG2 3.91Å
491	S	98.4	Very high	97.3	Very high	18 Å²	18	15.3 Å²	15.3	13%	0.126	8%	0.082	C	C	.	.	H	α-helix	trans	-60.4	-47.7	178.5	-173.4	0	0	0	0	112.7	D487 R488 G494 Q495	D487-S491 VanDerWaalsContact O-CB 3.26Å; D487-S491 WeakPolarHBondContact O-CB 3.37Å; D487-S491 PolarHBondContact O-N 3.37Å; R488-S491 PolarHBondContact O-N 3.25Å; S491-G494 PolarHBondContact O-N 2.67Å; S491-Q495 WeakPolarHBondContact O-CG 3.36Å; S491-Q495 PolarHBondContact O-N 3.42Å; S491-Q495 VanDerWaalsContact O-N 3.16Å
492	Y	98.6	Very high	97.4	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.008	9%	0.09	C	C	.	.	H	α-helix	trans	-70.8	-37.1	178.4	-61.5	-40.6	0	0	0	112.3	L474 L477 L484 R488 Q495 A496 L520 G524 A527 M586	L474-Y492 HydrophobicContact CD1-CD2 3.4Å; L474-Y492 HydrophobicContact CD1-CE2 3.75Å; L474-Y492 HydrophobicContact CD1-CG 4.08Å; L477-Y492 HydrophobicContact CD2-CE2 3.9Å; L484-Y492 HydrophobicContact CD1-CD2 4.02Å; L484-Y492 HydrophobicContact CD1-CE2 4.08Å; R488-Y492 HydrophobicContact CB-CE2 4.3Å; R488-Y492 WeakPolarHBondContact O-CD2 2.95Å; R488-Y492 PolarHBondContact O-N 2.75Å; Y492-Q495 PolarHBondContact O-N 2.85Å; Y492-A496 WeakPolarHBondContact O-CB 3.27Å; Y492-A496 PolarHBondContact O-N 2.99Å; Y492-L520 HydrophobicContact CD1-CD2 4.01Å; Y492-L520 HydrophobicContact CE1-CD2 3.72Å; Y492-G524 PolarHBondContact OH-O 3.4Å; Y492-A527 HydrophobicContact CD1-CB 3.95Å; Y492-M586 HydrophobicContact CD2-SD 4.23Å
493	L	98.8	Very high	97.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.8	-48	172.7	178.2	63.9	0	0	0	111.3	A489 L490 Q495 A496 L497 M583 M586 I626 T648	A489-L493 VanDerWaalsContact O-CB 3.24Å; A489-L493 WeakPolarHBondContact O-CB 3.47Å; A489-L493 PolarHBondContact O-N 3.21Å; L490-L493 PolarHBondContact O-N 3.46Å; L493-Q495 VanDerWaalsContact C-N 3.34Å; L493-Q495 PolarHBondContact O-N 3.06Å; L493-A496 PolarHBondContact O-N 3.33Å; L493-L497 HydrophobicContact CD1-CD1 3.94Å; L493-L497 HydrophobicContact CD1-CG 4.1Å; L493-L497 HydrophobicContact CD2-CD1 4.38Å; L493-L497 HydrophobicContact CG-CD1 3.75Å; L493-L497 HydrophobicContact CG-CG 4.34Å; L493-L497 WeakPolarHBondContact O-CB 3.35Å; L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.27Å; L493-L497 PolarHBondContact O-N 3.33Å; L493-M583 HydrophobicContact CB-SD 4.12Å; L493-M583 HydrophobicContact CD2-CB 4.17Å; L493-M583 HydrophobicContact CD2-CE 4.28Å; L493-M583 HydrophobicContact CD2-CG 3.95Å; L493-M583 HydrophobicContact CD2-SD 3.84Å; L493-M586 HydrophobicContact CB-CE 4.17Å; L493-I626 HydrophobicContact CD2-CG2 3.99Å; L493-T648 HydrophobicContact CB-CG2 4.37Å; L493-T648 HydrophobicContact CD2-CG2 4.26Å; L493-T648 HydrophobicContact CG-CG2 4.32Å
494	G	98.5	Very high	97.4	Very high	12 Å²	12	17.7 Å²	17.7	12%	0.124	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-41	179.5	0	0	0	0	0	112.7	L490 S491 L497 E498	L490-G494 PolarHBondContact O-N 2.88Å; S491-G494 PolarHBondContact O-N 2.67Å; G494-L497 PolarHBondContact O-N 3.3Å; G494-E498 PolarHBondContact O-N 3.32Å
495	Q	98.5	Very high	97.2	Very high	23 Å²	23	21.3 Å²	21.3	11%	0.107	12%	0.12	C	C	.	.	H	α-helix	trans	-69.7	-35.5	176	-68.2	-166.3	67.1	0	0	113.3	K448 S491 Y492 L493 G499 S525 A527	K448-Q495 HydrophobicContact CD-CB 4.38Å; S491-Q495 WeakPolarHBondContact O-CG 3.36Å; S491-Q495 PolarHBondContact O-N 3.42Å; S491-Q495 VanDerWaalsContact O-N 3.16Å; Y492-Q495 PolarHBondContact O-N 2.85Å; L493-Q495 VanDerWaalsContact C-N 3.34Å; L493-Q495 PolarHBondContact O-N 3.06Å; Q495-G499 PolarHBondContact O-N 3.03Å; Q495-S525 PolarHBondContact NE2-O 3.08Å; Q495-A527 HydrophobicContact CB-CB 4.07Å; Q495-A527 VanDerWaalsContact OE1-N 3.16Å
496	A	98.6	Very high	97	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-66.9	-41.9	172.2	0	0	0	0	0	111.3	Y492 L493 E498 G499 L500 L529 M582	Y492-A496 WeakPolarHBondContact O-CB 3.27Å; Y492-A496 PolarHBondContact O-N 2.99Å; L493-A496 PolarHBondContact O-N 3.33Å; A496-E498 PolarHBondContact O-N 3.2Å; A496-G499 CarbonylContact O-C 3.59Å; A496-G499 WeakPolarHBondContact O-CA 3.44Å; A496-G499 PolarHBondContact O-N 2.85Å; A496-G499 VanDerWaalsContact O-N 3.08Å; A496-L500 WeakPolarHBondContact O-CG 3.37Å; A496-L500 PolarHBondContact O-N 2.97Å; A496-L529 HydrophobicContact CB-CD2 4.45Å; A496-M582 HydrophobicContact CB-CE 3.9Å
497	L	98.6	Very high	96.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-33.7	176.8	-71.4	168.2	0	0	0	113	L493 G494 G499 L500 E501 A641 L644 K645	L493-L497 HydrophobicContact CD1-CD1 3.94Å; L493-L497 HydrophobicContact CD1-CG 4.1Å; L493-L497 HydrophobicContact CD2-CD1 4.38Å; L493-L497 HydrophobicContact CG-CD1 3.75Å; L493-L497 HydrophobicContact CG-CG 4.34Å; L493-L497 WeakPolarHBondContact O-CB 3.35Å; L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.27Å; L493-L497 PolarHBondContact O-N 3.33Å; G494-L497 PolarHBondContact O-N 3.3Å; L497-G499 VanDerWaalsContact C-N 3.31Å; L497-L500 HydrophobicContact CD2-CD1 4.32Å; L497-L500 PolarHBondContact O-N 2.95Å; L497-E501 VanDerWaalsContact O-CB 3.29Å; L497-E501 WeakPolarHBondContact O-CB 3.3Å; L497-E501 PolarHBondContact O-N 2.99Å; L497-A641 HydrophobicContact CD2-CB 4.28Å; L497-L644 HydrophobicContact CD1-CB 4.07Å; L497-L644 HydrophobicContact CD1-CD2 4.06Å; L497-L644 HydrophobicContact CD1-CG 3.96Å; L497-L644 HydrophobicContact CD2-CB 4.39Å; L497-L644 HydrophobicContact CD2-CD2 4.09Å; L497-K645 HydrophobicContact CB-CB 3.91Å; L497-K645 HydrophobicContact CB-CG 4.36Å
498	E	98.1	Very high	96.3	Very high	74 Å²	74	25.7 Å²	25.7	35%	0.346	14%	0.141	S	C	.	.	H	α-helix	trans	-63.6	-36.1	169.3	-170.2	-166.9	138.2	0	0	111.7	K448 G494 A496 H502 K645	K448-E498 WeakPolarHBondContact CE-OE1 3.44Å; K448-E498 WeakPolarHBondContact CE-OE2 3.39Å; K448-E498 HydrophobicContact CG-CB 4.11Å; K448-E498 HydrophobicContact CG-CG 4.02Å; K448-E498 IonicContact NZ-OE2 3.91Å; K448-E498 PolarHBondContact NZ-OE2 2.9Å; G494-E498 PolarHBondContact O-N 3.32Å; A496-E498 PolarHBondContact O-N 3.2Å; E498-H502 PolarHBondContact O-N 3.32Å; E498-K645 HydrophobicContact CB-CD 4.03Å; E498-K645 HydrophobicContact CG-CD 4.41Å
499	G	97.1	Very high	96	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-47.6	170.4	0	0	0	0	0	112.9	Q495 A496 L497 H502 L503	Q495-G499 PolarHBondContact O-N 3.03Å; A496-G499 CarbonylContact O-C 3.59Å; A496-G499 WeakPolarHBondContact O-CA 3.44Å; A496-G499 PolarHBondContact O-N 2.85Å; A496-G499 VanDerWaalsContact O-N 3.08Å; L497-G499 VanDerWaalsContact C-N 3.31Å; G499-H502 WeakPolarHBondContact O-CB 3.37Å; G499-H502 PolarHBondContact O-N 3.15Å; G499-L503 WeakPolarHBondContact O-CG 3.21Å; G499-L503 PolarHBondContact O-N 3.46Å
500	L	97.8	Very high	95.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-40.8	178.8	-66.8	178.4	0	0	0	112.3	A496 L497 H502 L503 H504 H510 V513 L529 D575 A641	A496-L500 WeakPolarHBondContact O-CG 3.37Å; A496-L500 PolarHBondContact O-N 2.97Å; L497-L500 HydrophobicContact CD2-CD1 4.32Å; L497-L500 PolarHBondContact O-N 2.95Å; L500-H502 VanDerWaalsContact C-N 3.27Å; L500-H502 PolarHBondContact O-N 2.86Å; L500-L503 HydrophobicContact CD2-CD1 4.31Å; L500-L503 PolarHBondContact O-N 3.4Å; L500-L503 VanDerWaalsContact O-N 3.15Å; L500-H504 WeakPolarHBondContact O-CB 3.5Å; L500-H504 PolarHBondContact O-CD2 2.98Å; L500-H504 VanDerWaalsContact O-CD2 3.28Å; L500-H504 PolarHBondContact O-N 2.96Å; L500-H510 HydrophobicContact CD2-CB 4.13Å; L500-V513 HydrophobicContact CD1-CG1 4.37Å; L500-V513 HydrophobicContact CD1-CG2 4.24Å; L500-V513 HydrophobicContact CD2-CG2 3.77Å; L500-L529 HydrophobicContact CD2-CD1 3.97Å; L500-L529 HydrophobicContact CG-CD1 4.2Å; L500-D575 HydrophobicContact CD1-CB 4.03Å; L500-D575 HydrophobicContact CD2-CB 3.94Å; L500-A641 HydrophobicContact CB-CB 4.05Å
501	E	97	Very high	95.4	Very high	50 Å²	50	24.3 Å²	24.3	23%	0.234	14%	0.138	C	C	.	.	H	α-helix	trans	-55	-42.3	174.7	-179.8	-174.5	-108.4	0	0	112	L497 A505 A641 S642 K645	L497-E501 VanDerWaalsContact O-CB 3.29Å; L497-E501 WeakPolarHBondContact O-CB 3.3Å; L497-E501 PolarHBondContact O-N 2.99Å; E501-A505 WeakPolarHBondContact O-CB 3.37Å; E501-A505 PolarHBondContact O-N 2.8Å; E501-A641 HydrophobicContact CB-CB 4.37Å; E501-S642 WeakPolarHBondContact OE1-CA 3.4Å; E501-S642 WeakPolarHBondContact OE1-CB 3.19Å; E501-S642 PolarHBondContact OE1-OG 3.02Å; E501-K645 WeakPolarHBondContact OE1-CE 3.43Å; E501-K645 IonicContact OE1-NZ 2.66Å; E501-K645 PolarHBondContact OE1-NZ 3.1Å; E501-K645 IonicContact OE2-NZ 3.76Å; E501-K645 PolarHBondContact OE2-NZ 2.81Å
502	H	95.5	Very high	95.2	Very high	55 Å²	55	23.6 Å²	23.6	26%	0.255	13%	0.133	S	C	.	.	H	α-helix	trans	-64.7	-46	175.6	-176.2	102.9	0	0	0	112.3	T445 E498 G499 L500 A505 Q506	T445-H502 PolarHBondContact O-CE1 2.89Å; E498-H502 PolarHBondContact O-N 3.32Å; G499-H502 WeakPolarHBondContact O-CB 3.37Å; G499-H502 PolarHBondContact O-N 3.15Å; L500-H502 VanDerWaalsContact C-N 3.27Å; L500-H502 PolarHBondContact O-N 2.86Å; H502-A505 PolarHBondContact O-N 3.49Å; H502-Q506 PolarHBondContact O-N 3.38Å
503	L	94.1	Very high	95.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.4	-45.3	177.5	-62	179.6	0	0	0	111.2	I444 V449 G499 L500 A505 Q506 N507 I508 H510 L529 F532	I444-L503 HydrophobicContact CD1-CD2 3.37Å; I444-L503 HydrophobicContact CG1-CD2 3.79Å; I444-L503 HydrophobicContact CG2-CD2 4.25Å; V449-L503 HydrophobicContact CG2-CD2 4.41Å; G499-L503 WeakPolarHBondContact O-CG 3.21Å; G499-L503 PolarHBondContact O-N 3.46Å; L500-L503 HydrophobicContact CD2-CD1 4.31Å; L500-L503 PolarHBondContact O-N 3.4Å; L500-L503 VanDerWaalsContact O-N 3.15Å; L503-A505 VanDerWaalsContact C-N 3.34Å; L503-A505 PolarHBondContact O-N 3.32Å; L503-Q506 CarbonylContact O-C 3.53Å; L503-Q506 WeakPolarHBondContact O-CA 3.38Å; L503-Q506 WeakPolarHBondContact O-CB 3.4Å; L503-Q506 PolarHBondContact O-N 3.37Å; L503-N507 PolarHBondContact O-N 2.85Å; L503-I508 CarbonylContact C-O 3.44Å; L503-I508 HydrophobicContact CB-CB 4.14Å; L503-I508 HydrophobicContact CB-CG2 4.32Å; L503-I508 WeakPolarHBondContact CB-O 3.5Å; L503-I508 HydrophobicContact CD2-CB 4.46Å; L503-I508 HydrophobicContact CD2-CG2 4.18Å; L503-I508 PolarHBondContact O-N 3.44Å; L503-H510 HydrophobicContact CD1-CB 4.14Å; L503-L529 HydrophobicContact CD1-CD1 4.28Å; L503-F532 HydrophobicContact CD1-CE1 3.82Å; L503-F532 HydrophobicContact CD1-CZ 4.26Å; L503-F532 HydrophobicContact CD2-CE1 3.93Å; L503-F532 HydrophobicContact CD2-CZ 4.39Å
504	H	94.3	Very high	95	Very high	26 Å²	26	24.8 Å²	24.8	12%	0.12	14%	0.138	C	C	.	.	H	α-helix	trans	-66	-36.6	-178.1	-63.2	176.9	0	0	0	111.6	L500 Q506 N507 I508 S572 D575	L500-H504 WeakPolarHBondContact O-CB 3.5Å; L500-H504 PolarHBondContact O-CD2 2.98Å; L500-H504 VanDerWaalsContact O-CD2 3.28Å; L500-H504 PolarHBondContact O-N 2.96Å; H504-Q506 PolarHBondContact O-N 2.98Å; H504-N507 PolarHBondContact O-N 3.43Å; H504-I508 PolarHBondContact CD2-O 3.38Å; H504-S572 PolarHBondContact CE1-O 3.13Å; H504-D575 IonicContact CD2-OD2 2.74Å; H504-D575 IonicContact CE1-OD2 2.64Å; H504-D575 IonicContact NE2-OD2 2.69Å; H504-D575 PolarHBondContact NE2-OD2 2.84Å
505	A	93.3	Very high	95	Very high	84 Å²	84	24.2 Å²	24.2	69%	0.694	13%	0.133	S	C	*	.	H	α-helix	trans	-64.4	-24.4	171.7	0	0	0	0	0	113.5	E501 H502 L503	E501-A505 WeakPolarHBondContact O-CB 3.37Å; E501-A505 PolarHBondContact O-N 2.8Å; H502-A505 PolarHBondContact O-N 3.49Å; L503-A505 VanDerWaalsContact C-N 3.34Å; L503-A505 PolarHBondContact O-N 3.32Å
506	Q	91	Very high	94.8	Very high	76 Å²	76	25.6 Å²	25.6	36%	0.355	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	7.1	172.5	-64.9	-174.1	-42.6	0	0	113.3	H502 L503 H504 I508	H502-Q506 PolarHBondContact O-N 3.38Å; L503-Q506 CarbonylContact O-C 3.53Å; L503-Q506 WeakPolarHBondContact O-CA 3.38Å; L503-Q506 WeakPolarHBondContact O-CB 3.4Å; L503-Q506 PolarHBondContact O-N 3.37Å; H504-Q506 PolarHBondContact O-N 2.98Å; Q506-I508 HydrophobicContact CB-CD1 3.86Å; Q506-I508 HydrophobicContact CB-CG1 4.17Å; Q506-I508 PolarHBondContact O-N 2.97Å
507	N	89.1	Confident	94.7	Very high	77 Å²	77	25.9 Å²	25.9	41%	0.412	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	32.8	-171.8	-57.6	-75.8	0	0	0	113.7	L503 H504 L538	L503-N507 PolarHBondContact O-N 2.85Å; H504-N507 PolarHBondContact O-N 3.43Å; N507-L538 HydrophobicContact CB-CB 4.28Å; N507-L538 WeakPolarHBondContact CB-O 3.23Å; N507-L538 PolarHBondContact O-N 3.16Å
508	I	89.9	Confident	94.7	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.015	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.4	174.6	-63.3	165.1	0	0	0	108.8	T440 I444 L503 H504 Q506	T440-I508 HydrophobicContact CG2-CD1 4.13Å; T440-I508 HydrophobicContact CG2-CG1 4.39Å; T440-I508 HydrophobicContact CG2-CG2 3.55Å; I444-I508 HydrophobicContact CD1-CD1 4.16Å; I444-I508 HydrophobicContact CG1-CD1 3.82Å; L503-I508 CarbonylContact C-O 3.44Å; L503-I508 HydrophobicContact CB-CB 4.14Å; L503-I508 HydrophobicContact CB-CG2 4.32Å; L503-I508 WeakPolarHBondContact CB-O 3.5Å; L503-I508 HydrophobicContact CD2-CB 4.46Å; L503-I508 HydrophobicContact CD2-CG2 4.18Å; L503-I508 PolarHBondContact O-N 3.44Å; H504-I508 PolarHBondContact CD2-O 3.38Å; Q506-I508 HydrophobicContact CB-CD1 3.86Å; Q506-I508 HydrophobicContact CB-CG1 4.17Å; Q506-I508 PolarHBondContact O-N 2.97Å
509	L	91.5	Very high	94.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.4	165.2	-175.5	77.8	0	0	0	109.4	S535 A536 L538 L547 D571 V574 D575	L509-S535 CarbonylContact O-C 3.58Å; L509-S535 WeakPolarHBondContact O-CA 3.47Å; L509-S535 VanDerWaalsContact O-CB 3.23Å; L509-S535 WeakPolarHBondContact O-CB 3.21Å; L509-A536 PolarHBondContact N-O 3.47Å; L509-A536 PolarHBondContact O-N 3.49Å; L509-L538 HydrophobicContact CB-CD2 4.4Å; L509-L538 HydrophobicContact CB-CG 4.43Å; L509-L547 HydrophobicContact CD2-CD1 3.53Å; L509-L547 HydrophobicContact CD2-CD2 3.72Å; L509-L547 HydrophobicContact CD2-CG 4.26Å; L509-D571 WeakPolarHBondContact CD1-O 3.26Å; L509-V574 HydrophobicContact CD1-CB 4.17Å; L509-D575 HydrophobicContact CD1-CB 4.37Å; L509-D575 VanDerWaalsContact CD1-CG 3.45Å; L509-D575 WeakPolarHBondContact CD1-OD1 3.2Å; L509-D575 WeakPolarHBondContact CD1-OD2 3.49Å
510	H	93.4	Very high	94.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.			trans	-80.8	-41.4	174.4	-171.5	-27.9	0	0	0	112.5	L500 L503 D512 V513 C530 D531 H534 S535 D575	L500-H510 HydrophobicContact CD2-CB 4.13Å; L503-H510 HydrophobicContact CD1-CB 4.14Å; H510-D512 VanDerWaalsContact C-N 3.3Å; H510-D512 PolarHBondContact O-N 2.92Å; H510-V513 HydrophobicContact CB-CG2 3.91Å; H510-C530 PolarHBondContact CE1-O 3.44Å; H510-C530 VanDerWaalsContact CE1-O 3.26Å; H510-C530 PolarHBondContact NE2-O 2.72Å; H510-D531 PolarHBondContact CE1-O 3.41Å; H510-H534 CarbonylContact O-C 3.51Å; H510-S535 WeakPolarHBondContact O-CA 3.16Å; H510-S535 PolarHBondContact O-N 3.36Å; H510-D575 PolarHBondContact N-OD1 3.16Å; H510-D575 PolarHBondContact N-OD2 2.86Å
511	G	91.5	Very high	94.6	Very high	8 Å²	8	24.6 Å²	24.6	8%	0.082	14%	0.138	C	C	.	.	S	Bend	trans	80.2	-7.7	168.8	0	0	0	0	0	116.8	D575	G511-D575 PolarHBondContact N-OD1 2.98Å
512	D	93.6	Very high	94.5	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	16%	0.157	C	C	.	.			trans	-152.7	50.6	178.3	-170.9	42.2	0	0	0	111.5	S407 H510 K514 N517 H534 G555 T556	S407-D512 PolarHBondContact OG-OD2 2.97Å; H510-D512 VanDerWaalsContact C-N 3.3Å; H510-D512 PolarHBondContact O-N 2.92Å; D512-K514 PolarHBondContact O-N 3.43Å; D512-K514 IonicContact OD1-NZ 3.48Å; D512-K514 PolarHBondContact OD1-NZ 2.99Å; D512-K514 WeakPolarHBondContact OD2-CE 3.38Å; D512-K514 IonicContact OD2-NZ 2.66Å; D512-K514 PolarHBondContact OD2-NZ 2.93Å; D512-N517 PolarHBondContact O-ND2 2.84Å; D512-N517 PolarHBondContact OD2-ND2 3.31Å; D512-H534 HydrophobicContact CB-CB 3.92Å; D512-H534 VanDerWaalsContact CB-CD2 3.42Å; D512-H534 WeakPolarHBondContact CB-CD2 3.47Å; D512-H534 IonicContact OD2-CD2 3.31Å; D512-H534 IonicContact OD2-NE2 3.21Å; D512-H534 PolarHBondContact OD2-NE2 2.84Å; D512-G555 WeakPolarHBondContact OD1-CA 3.34Å; D512-T556 WeakPolarHBondContact OD1-CB 3.5Å; D512-T556 PolarHBondContact OD1-N 2.97Å; D512-T556 PolarHBondContact OD1-OG1 3.22Å
513	V	97.5	Very high	94.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.			trans	-71	111.8	179.6	-176.3	0	0	0	0	110	L500 H510 H559 D575 S578	L500-V513 HydrophobicContact CD1-CG1 4.37Å; L500-V513 HydrophobicContact CD1-CG2 4.24Å; L500-V513 HydrophobicContact CD2-CG2 3.77Å; H510-V513 HydrophobicContact CB-CG2 3.91Å; V513-H559 PolarHBondContact O-CD2 3.39Å; V513-D575 HydrophobicContact CG2-CB 3.88Å; V513-S578 WeakPolarHBondContact O-CB 3.31Å
514	K	96.9	Very high	94.4	Very high	26 Å²	26	28.8 Å²	28.8	11%	0.113	16%	0.164	C	C	.	.			trans	-153.7	164.2	179.7	72.3	-158.8	-174.7	-159.9	0	111.3	D512 D516 N517 T556 M582	D512-K514 PolarHBondContact O-N 3.43Å; D512-K514 IonicContact OD1-NZ 3.48Å; D512-K514 PolarHBondContact OD1-NZ 2.99Å; D512-K514 WeakPolarHBondContact OD2-CE 3.38Å; D512-K514 IonicContact OD2-NZ 2.66Å; D512-K514 PolarHBondContact OD2-NZ 2.93Å; K514-D516 VanDerWaalsContact C-N 3.28Å; K514-D516 HydrophobicContact CG-CB 4.41Å; K514-D516 PolarHBondContact O-N 3.05Å; K514-N517 WeakPolarHBondContact CE-OD1 3.5Å; K514-N517 HydrophobicContact CG-CB 4.1Å; K514-N517 PolarHBondContact O-N 3.25Å; K514-T556 HydrophobicContact CD-CG2 4.46Å; K514-T556 WeakPolarHBondContact CD-OG1 3.33Å; K514-T556 PolarHBondContact NZ-OG1 3.49Å; K514-M582 VanDerWaalsContact C-SD 3.56Å
515	A	97.4	Very high	94.4	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.008	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-59.1	-34	-177.5	0	0	0	0	0	113.8	L474 G475 I478 N517 V518 M582	L474-A515 CarbonylContact C-O 3.58Å; L474-A515 HydrophobicContact CB-CB 4.44Å; L474-A515 WeakPolarHBondContact CB-O 2.83Å; L474-A515 HydrophobicContact CD2-CB 4.43Å; L474-A515 HydrophobicContact CG-CB 4.14Å; L474-A515 PolarHBondContact N-O 3.06Å; G475-A515 VanDerWaalsContact N-C 3.3Å; G475-A515 PolarHBondContact N-O 2.99Å; I478-A515 HydrophobicContact CD1-CB 3.59Å; A515-N517 PolarHBondContact O-N 3.48Å; A515-V518 PolarHBondContact O-N 2.95Å; A515-M582 HydrophobicContact CB-CG 4.12Å
516	D	95.2	Very high	94.6	Very high	52 Å²	52	31.2 Å²	31.2	28%	0.278	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-69.7	-19.9	176.2	-68.1	-60.6	0	0	0	113.1	S473 G475 K479 K514	S473-D516 WeakPolarHBondContact CB-O 3.46Å; G475-D516 WeakPolarHBondContact CA-OD1 3.43Å; K479-D516 VanDerWaalsContact NZ-CG 3.31Å; K479-D516 IonicContact NZ-OD1 2.78Å; K479-D516 PolarHBondContact NZ-OD1 2.97Å; K479-D516 IonicContact NZ-OD2 2.66Å; K479-D516 PolarHBondContact NZ-OD2 3.25Å; K479-D516 VanDerWaalsContact NZ-OD2 3.08Å; K514-D516 VanDerWaalsContact C-N 3.28Å; K514-D516 HydrophobicContact CG-CB 4.41Å; K514-D516 PolarHBondContact O-N 3.05Å
517	N	96.4	Very high	94.9	Very high	8 Å²	8	27.6 Å²	27.6	4%	0.043	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-98.3	14.8	178	-67.1	-2.5	0	0	0	113.3	D512 K514 A515 C530	D512-N517 PolarHBondContact O-ND2 2.84Å; D512-N517 PolarHBondContact OD2-ND2 3.31Å; K514-N517 WeakPolarHBondContact CE-OD1 3.5Å; K514-N517 HydrophobicContact CG-CB 4.1Å; K514-N517 PolarHBondContact O-N 3.25Å; A515-N517 PolarHBondContact O-N 3.48Å; N517-C530 PolarHBondContact O-N 3.22Å; N517-C530 PolarHBondContact O-SG 2.88Å; N517-C530 VanDerWaalsContact O-SG 3.4Å
518	V	98	Very high	95.3	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.1	172.8	174.9	0	0	0	0	108.5	S473 L474 A515 A527 L528 L529 M582	S473-V518 CarbonylContact C-O 3.59Å; S473-V518 VanDerWaalsContact CA-O 3.31Å; S473-V518 WeakPolarHBondContact CA-O 3.45Å; L474-V518 HydrophobicContact CB-CB 3.98Å; L474-V518 HydrophobicContact CB-CG1 4.09Å; L474-V518 HydrophobicContact CD2-CB 4.02Å; L474-V518 HydrophobicContact CD2-CG1 3.92Å; L474-V518 HydrophobicContact CD2-CG2 4.46Å; L474-V518 PolarHBondContact N-O 3.23Å; A515-V518 PolarHBondContact O-N 2.95Å; V518-A527 HydrophobicContact CG1-CB 3.75Å; V518-L528 CarbonylContact C-O 3.57Å; V518-L528 WeakPolarHBondContact CA-O 3.45Å; V518-L529 HydrophobicContact CG2-CD2 4.06Å; V518-M582 HydrophobicContact CG2-CE 4.37Å; V518-M582 HydrophobicContact CG2-SD 3.79Å
519	L	97.4	Very high	95.6	Very high	32 Å²	32	24 Å²	24	17%	0.168	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	144.4	-179.4	-54.6	-169.5	0	0	0	112.5	V450 M469 G472 A527 L528 C530	V450-L519 HydrophobicContact CG2-CB 4.36Å; V450-L519 HydrophobicContact CG2-CD1 4.06Å; V450-L519 HydrophobicContact CG2-CG 4.34Å; M469-L519 HydrophobicContact CB-CB 3.73Å; M469-L519 HydrophobicContact CB-CD1 4.08Å; M469-L519 HydrophobicContact CG-CB 3.94Å; M469-L519 HydrophobicContact CG-CD1 4.19Å; G472-L519 WeakPolarHBondContact O-CA 3.34Å; L519-A527 WeakPolarHBondContact O-CA 3.43Å; L519-L528 PolarHBondContact N-O 3.35Å; L519-L528 PolarHBondContact O-N 3.26Å; L519-C530 HydrophobicContact CD1-CB 4.37Å; L519-C530 HydrophobicContact CG-CB 4.32Å
520	L	97.6	Very high	95.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.1	-173.5	-56.7	-178.7	0	0	0	112.5	M469 G471 G472 L474 L477 Y492 R526 A527 W662	M469-L520 CarbonylContact C-O 3.56Å; M469-L520 WeakPolarHBondContact CB-O 3.24Å; G471-L520 VanDerWaalsContact CA-O 3.24Å; G471-L520 WeakPolarHBondContact CA-O 3.43Å; G471-L520 PolarHBondContact N-O 3.28Å; G472-L520 PolarHBondContact O-N 3.41Å; L474-L520 HydrophobicContact CB-CD2 4.48Å; L474-L520 HydrophobicContact CD1-CD1 4.46Å; L477-L520 HydrophobicContact CB-CD1 4.11Å; L477-L520 HydrophobicContact CD2-CD1 3.58Å; L477-L520 HydrophobicContact CG-CD1 4.43Å; Y492-L520 HydrophobicContact CD1-CD2 4.01Å; Y492-L520 HydrophobicContact CE1-CD2 3.72Å; L520-R526 WeakPolarHBondContact CA-O 3.33Å; L520-A527 HydrophobicContact CD2-CB 3.87Å; L520-W662 HydrophobicContact CD1-CZ3 4.43Å
521	S	96	Very high	95.5	Very high	14 Å²	14	25.5 Å²	25.5	10%	0.098	14%	0.136	C	C	.	.			trans	-70.3	164.9	168.3	48.3	0	0	0	0	112.1	G471 D523 G524 S525 R526	G471-S521 WeakPolarHBondContact CA-O 3.44Å; S521-D523 WeakPolarHBondContact CB-OD1 2.92Å; S521-D523 PolarHBondContact O-N 3.47Å; S521-D523 VanDerWaalsContact O-N 3.12Å; S521-D523 PolarHBondContact OG-OD1 2.99Å; S521-G524 PolarHBondContact O-N 2.97Å; S521-S525 PolarHBondContact OG-N 2.85Å; S521-R526 PolarHBondContact N-O 3.29Å; S521-R526 VanDerWaalsContact N-O 3.08Å; S521-R526 PolarHBondContact OG-N 3.4Å
522	D	93.9	Very high	95.3	Very high	119 Å²	119	25.3 Å²	25.3	64%	0.636	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.7	-176.1	69.4	93.6	0	0	0	114	E470 W662	E470-D522 HydrophobicContact CB-CB 4.14Å; D522-W662 WeakPolarHBondContact O-CH2 3.35Å; D522-W662 WeakPolarHBondContact O-CZ2 3.1Å
523	D	94.4	Very high	94.9	Very high	75 Å²	75	25.3 Å²	25.3	40%	0.401	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-2.8	177.5	69.4	-17.7	0	0	0	113.7	S521 S525 W662	S521-D523 WeakPolarHBondContact CB-OD1 2.92Å; S521-D523 PolarHBondContact O-N 3.47Å; S521-D523 VanDerWaalsContact O-N 3.12Å; S521-D523 PolarHBondContact OG-OD1 2.99Å; D523-S525 PolarHBondContact O-N 3.46Å; D523-S525 PolarHBondContact OD1-N 3.49Å; D523-S525 PolarHBondContact OD1-OG 2.87Å; D523-S525 WeakPolarHBondContact OD2-CB 3.49Å; D523-S525 PolarHBondContact OD2-OG 3.22Å; D523-W662 PolarHBondContact O-NE1 3.48Å
524	G	94.5	Very high	94.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	61.3	20.2	-173.9	0	0	0	0	0	115.5	R488 Y492 S521 W662	R488-G524 PolarHBondContact NH1-O 2.77Å; Y492-G524 PolarHBondContact OH-O 3.4Å; S521-G524 PolarHBondContact O-N 2.97Å; G524-W662 VanDerWaalsContact CA-CE3 3.49Å
525	S	94.8	Very high	93.9	Very high	58 Å²	58	26 Å²	26	41%	0.406	14%	0.139	S	C	.	.			trans	-83.5	-30.4	177.5	69.5	0	0	0	0	113.3	Q495 S521 D523	Q495-S525 PolarHBondContact NE2-O 3.08Å; S521-S525 PolarHBondContact OG-N 2.85Å; D523-S525 PolarHBondContact O-N 3.46Å; D523-S525 PolarHBondContact OD1-N 3.49Å; D523-S525 PolarHBondContact OD1-OG 2.87Å; D523-S525 WeakPolarHBondContact OD2-CB 3.49Å; D523-S525 PolarHBondContact OD2-OG 3.22Å
526	R	96.3	Very high	93.4	Very high	102 Å²	102	26.6 Å²	26.6	39%	0.385	14%	0.143	S	C	.	.			trans	-115.1	134.5	-177.4	-64.4	-179.1	61.3	165.5	0.7	112	P447 L520 S521 L528	P447-R526 PolarHBondContact O-NH2 3.43Å; L520-R526 WeakPolarHBondContact CA-O 3.33Å; S521-R526 PolarHBondContact N-O 3.29Å; S521-R526 VanDerWaalsContact N-O 3.08Å; S521-R526 PolarHBondContact OG-N 3.4Å; R526-L528 HydrophobicContact CB-CD1 3.92Å
527	A	97.6	Very high	92.8	Very high	1 Å²	1	28 Å²	28	1%	0.008	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.1	168.3	0	0	0	0	0	110.4	Y492 Q495 V518 L519 L520	Y492-A527 HydrophobicContact CD1-CB 3.95Å; Q495-A527 HydrophobicContact CB-CB 4.07Å; Q495-A527 VanDerWaalsContact OE1-N 3.16Å; V518-A527 HydrophobicContact CG1-CB 3.75Å; L519-A527 WeakPolarHBondContact O-CA 3.43Å; L520-A527 HydrophobicContact CD2-CB 3.87Å
528	L	97.6	Very high	92	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.7	-179.3	-75.7	66.7	0	0	0	110.6	K448 V450 M469 V518 L519 R526	K448-L528 CarbonylContact O-C 3.5Å; K448-L528 VanDerWaalsContact O-CA 3.29Å; K448-L528 WeakPolarHBondContact O-CA 3.3Å; V450-L528 HydrophobicContact CG2-CB 3.76Å; V450-L528 HydrophobicContact CG2-CD2 4.32Å; M469-L528 HydrophobicContact CE-CD1 3.8Å; M469-L528 HydrophobicContact CE-CD2 4.18Å; M469-L528 HydrophobicContact CE-CG 4.41Å; M469-L528 HydrophobicContact SD-CD2 4.2Å; V518-L528 CarbonylContact C-O 3.57Å; V518-L528 WeakPolarHBondContact CA-O 3.45Å; L519-L528 PolarHBondContact N-O 3.35Å; L519-L528 PolarHBondContact O-N 3.26Å; R526-L528 HydrophobicContact CB-CD1 3.92Å
529	L	96.8	Very high	90.6	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	144.9	176.3	-64.8	164.7	0	0	0	112.4	K448 V449 V450 A496 L500 L503 V518	K448-L529 PolarHBondContact O-N 3.22Å; V449-L529 HydrophobicContact CG2-CB 4.47Å; V450-L529 WeakPolarHBondContact CG2-O 3.44Å; V450-L529 PolarHBondContact N-O 3.22Å; A496-L529 HydrophobicContact CB-CD2 4.45Å; L500-L529 HydrophobicContact CD2-CD1 3.97Å; L500-L529 HydrophobicContact CG-CD1 4.2Å; L503-L529 HydrophobicContact CD1-CD1 4.28Å; V518-L529 HydrophobicContact CG2-CD2 4.06Å
530	C	93.5	Very high	88.6	Confident	15 Å²	15	38.4 Å²	38.4	10%	0.101	21%	0.205	C	C	.	.			trans	-147.2	176.1	176.5	71.9	0	0	0	0	113.6	V450 H510 N517 L519	V450-C530 HydrophobicContact CB-CB 4.2Å; V450-C530 HydrophobicContact CG2-CB 3.89Å; H510-C530 PolarHBondContact CE1-O 3.44Å; H510-C530 VanDerWaalsContact CE1-O 3.26Å; H510-C530 PolarHBondContact NE2-O 2.72Å; N517-C530 PolarHBondContact O-N 3.22Å; N517-C530 PolarHBondContact O-SG 2.88Å; N517-C530 VanDerWaalsContact O-SG 3.4Å; L519-C530 HydrophobicContact CD1-CB 4.37Å; L519-C530 HydrophobicContact CG-CB 4.32Å
531	D	88.9	Confident	86.5	Confident	15 Å²	15	46.1 Å²	46.1	8%	0.08	25%	0.246	C	C	.	.			trans	58.3	84.5	-176.2	-160.5	-12.9	0	0	0	114	S407 K426 H510 G533	S407-D531 PolarHBondContact N-OD2 3.05Å; S407-D531 PolarHBondContact OG-OD2 3.43Å; K426-D531 VanDerWaalsContact NZ-CG 3.29Å; K426-D531 IonicContact NZ-OD1 3.17Å; K426-D531 PolarHBondContact NZ-OD1 2.88Å; K426-D531 IonicContact NZ-OD2 2.89Å; K426-D531 PolarHBondContact NZ-OD2 2.65Å; H510-D531 PolarHBondContact CE1-O 3.41Å; D531-G533 VanDerWaalsContact C-N 3.3Å; D531-G533 PolarHBondContact O-N 3.07Å; D531-G533 PolarHBondContact OD1-N 3.35Å
532	F	88.1	Confident	84.2	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.018	26%	0.263	C	S	.	.			trans	-89.3	15.7	-179.9	-72	-100.6	0	0	0	112.9	E437 T440 C441 I444 V449 L503 H534 S535	E437-F532 HydrophobicContact CG-CB 4.1Å; T440-F532 HydrophobicContact CG2-CD1 3.93Å; C441-F532 WeakPolarHBondContact SG-CD2 3.41Å; I444-F532 HydrophobicContact CD1-CD1 4.09Å; I444-F532 HydrophobicContact CD1-CE1 3.55Å; I444-F532 HydrophobicContact CD1-CZ 3.99Å; V449-F532 HydrophobicContact CG1-CE2 3.64Å; V449-F532 HydrophobicContact CG1-CZ 3.58Å; V449-F532 HydrophobicContact CG2-CZ 4.11Å; L503-F532 HydrophobicContact CD1-CE1 3.82Å; L503-F532 HydrophobicContact CD1-CZ 4.26Å; L503-F532 HydrophobicContact CD2-CE1 3.93Å; L503-F532 HydrophobicContact CD2-CZ 4.39Å; F532-H534 PolarHBondContact O-N 3.44Å; F532-H534 VanDerWaalsContact O-N 3.16Å; F532-S535 VanDerWaalsContact O-CB 3.22Å; F532-S535 WeakPolarHBondContact O-CB 3.29Å; F532-S535 PolarHBondContact O-N 2.87Å; F532-S535 PolarHBondContact O-OG 3.02Å
533	G	84.2	Confident	82.1	Confident	3 Å²	3	49 Å²	49	3%	0.031	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-14	-178.5	0	0	0	0	0	115.6	R434 D531	R434-G533 VanDerWaalsContact CD-O 3.29Å; R434-G533 WeakPolarHBondContact CD-O 3.44Å; R434-G533 PolarHBondContact NH1-O 3.04Å; R434-G533 VanDerWaalsContact NH1-O 3.07Å; D531-G533 VanDerWaalsContact C-N 3.3Å; D531-G533 PolarHBondContact O-N 3.07Å; D531-G533 PolarHBondContact OD1-N 3.35Å
534	H	85.8	Confident	80.1	Confident	30 Å²	30	46.9 Å²	46.9	14%	0.139	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	3.2	170.8	-56.7	-90.2	0	0	0	113.4	S407 F408 H510 D512 F532 Y552 P554 G555	S407-H534 WeakPolarHBondContact CB-NE2 3.35Å; S407-H534 PolarHBondContact OG-NE2 2.98Å; F408-H534 AromaticContact CE2-CD2 3.99Å; F408-H534 AromaticContact CE2-NE2 3.93Å; F408-H534 AromaticContact CZ-CE1 3.87Å; H510-H534 CarbonylContact O-C 3.51Å; D512-H534 HydrophobicContact CB-CB 3.92Å; D512-H534 VanDerWaalsContact CB-CD2 3.42Å; D512-H534 WeakPolarHBondContact CB-CD2 3.47Å; D512-H534 IonicContact OD2-CD2 3.31Å; D512-H534 IonicContact OD2-NE2 3.21Å; D512-H534 PolarHBondContact OD2-NE2 2.84Å; F532-H534 PolarHBondContact O-N 3.44Å; F532-H534 VanDerWaalsContact O-N 3.16Å; H534-Y552 AromaticContact CE1-CZ 3.98Å; H534-Y552 PolarHBondContact CE1-OH 3.41Å; H534-Y552 PolarHBondContact ND1-OH 3.28Å; H534-Y552 VanDerWaalsContact ND1-OH 3.1Å; H534-P554 HydrophobicContact CB-CB 4.48Å; H534-G555 PolarHBondContact ND1-N 2.85Å; H534-G555 VanDerWaalsContact ND1-N 3.16Å
535	S	88.2	Confident	78.2	Confident	12 Å²	12	52 Å²	52	8%	0.084	28%	0.283	C	S	.	.			trans	-71	155.6	-175.1	69.5	0	0	0	0	112.9	T440 L509 H510 F532	T440-S535 PolarHBondContact OG1-OG 3.4Å; L509-S535 CarbonylContact O-C 3.58Å; L509-S535 WeakPolarHBondContact O-CA 3.47Å; L509-S535 VanDerWaalsContact O-CB 3.23Å; L509-S535 WeakPolarHBondContact O-CB 3.21Å; H510-S535 WeakPolarHBondContact O-CA 3.16Å; H510-S535 PolarHBondContact O-N 3.36Å; F532-S535 VanDerWaalsContact O-CB 3.22Å; F532-S535 WeakPolarHBondContact O-CB 3.29Å; F532-S535 PolarHBondContact O-N 2.87Å; F532-S535 PolarHBondContact O-OG 3.02Å
536	A	85.4	Confident	76.3	Confident	12 Å²	12	51.9 Å²	51.9	10%	0.099	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	135.4	178.9	0	0	0	0	0	111.9	L509 L547	L509-A536 PolarHBondContact N-O 3.47Å; L509-A536 PolarHBondContact O-N 3.49Å; A536-L547 HydrophobicContact CB-CD2 4.49Å
537	H	84.4	Confident	74.7	Confident	81 Å²	81	47.9 Å²	47.9	38%	0.375	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.1	164.5	-69.5	-84.2	0	0	0	110.3
538	L	78.9	Confident	72.8	Confident	28 Å²	28	50.3 Å²	50.3	15%	0.147	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-87.7	116.9	171.1	-54.8	174.4	0	0	0	107.8	N507 L509	N507-L538 HydrophobicContact CB-CB 4.28Å; N507-L538 WeakPolarHBondContact CB-O 3.23Å; N507-L538 PolarHBondContact O-N 3.16Å; L509-L538 HydrophobicContact CB-CD2 4.4Å; L509-L538 HydrophobicContact CB-CG 4.43Å
539	H	68.1	Low	70.5	Confident	129 Å²	129	54.9 Å²	54.9	60%	0.597	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-78.2	130.7	177.1	-90.9	-86.7	0	0	0	110.6	D541 S542	H539-D541 VanDerWaalsContact C-N 3.3Å; H539-D541 PolarHBondContact O-N 2.67Å; H539-S542 WeakPolarHBondContact CB-OG 3.18Å; H539-S542 WeakPolarHBondContact O-CB 3.22Å; H539-S542 PolarHBondContact O-N 3.46Å
540	P	55.9	Low	68.4	Low	104 Å²	104	57.8 Å²	57.8	68%	0.675	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-39.2	-178.4	-29	36.2	0	0	0	114.6	S542	P540-S542 VanDerWaalsContact C-N 3.3Å
541	D	53.5	Low	65.8	Low	161 Å²	161	65.2 Å²	65.2	86%	0.861	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.2	178.5	-51.2	-60.7	0	0	0	113.2	H539 L543	H539-D541 VanDerWaalsContact C-N 3.3Å; H539-D541 PolarHBondContact O-N 2.67Å; D541-L543 PolarHBondContact O-N 3.4Å
542	S	48.5	Very low	63.8	Low	65 Å²	65	67.9 Å²	67.9	46%	0.455	39%	0.387	S	S	.	.	S	Bend	trans	-87.7	104	175	-67	0	0	0	0	109.6	H539 P540 G544	H539-S542 WeakPolarHBondContact CB-OG 3.18Å; H539-S542 WeakPolarHBondContact O-CB 3.22Å; H539-S542 PolarHBondContact O-N 3.46Å; P540-S542 VanDerWaalsContact C-N 3.3Å; S542-G544 PolarHBondContact O-N 2.95Å
543	L	49	Very low	62.5	Low	129 Å²	129	70.1 Å²	70.1	68%	0.675	40%	0.4	S	S	*	.	S	Bend	trans	-68.8	75.7	178.1	-158.7	156.6	0	0	0	110.4	D541 R569	D541-L543 PolarHBondContact O-N 3.4Å; L543-R569 WeakPolarHBondContact O-CD 3.29Å; L543-R569 WeakPolarHBondContact O-CG 3.48Å; L543-R569 PolarHBondContact O-NE 3.16Å
544	G	51.9	Low	61.6	Low	31 Å²	31	70.6 Å²	70.6	32%	0.32	40%	0.403	S	S	.	.			trans	70.1	128	-172.3	0	0	0	0	0	114	S542	S542-G544 PolarHBondContact O-N 2.95Å
545	K	54.9	Low	61.2	Low	107 Å²	107	69.8 Å²	69.8	47%	0.465	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-86	141.2	168.8	-167.7	177.3	177.6	-178.2	0	108.6	C570	K545-C570 PolarHBondContact N-O 2.81Å; K545-C570 WeakPolarHBondContact O-CB 3.38Å; K545-C570 PolarHBondContact O-N 3.38Å
546	C	55.8	Low	61.2	Low	55 Å²	55	70.9 Å²	70.9	37%	0.372	41%	0.409	S	S	.	.			trans	-77.2	125.5	163	-169.8	0	0	0	0	107.9
547	L	60.9	Low	61.6	Low	18 Å²	18	72.3 Å²	72.3	9%	0.094	41%	0.414	C	S	.	.	S	Bend	trans	-78.9	-23.1	179.3	-68.1	174.4	0	0	0	112.3	L509 A536 T549 P554 V564 C570 V574	L509-L547 HydrophobicContact CD2-CD1 3.53Å; L509-L547 HydrophobicContact CD2-CD2 3.72Å; L509-L547 HydrophobicContact CD2-CG 4.26Å; A536-L547 HydrophobicContact CB-CD2 4.49Å; L547-T549 PolarHBondContact O-N 3.07Å; L547-P554 HydrophobicContact CB-CG 3.76Å; L547-P554 VanDerWaalsContact O-CD 3.3Å; L547-P554 WeakPolarHBondContact O-CD 3.32Å; L547-V564 HydrophobicContact CD1-CG2 4.27Å; L547-C570 HydrophobicContact CD1-CB 3.57Å; L547-C570 HydrophobicContact CG-CB 3.69Å; L547-V574 HydrophobicContact CD1-CG1 4.43Å; L547-V574 HydrophobicContact CD1-CG2 4.31Å
548	I	58.4	Low	62.1	Low	53 Å²	53	68.7 Å²	68.7	27%	0.272	40%	0.398	S	S	.	.			trans	-68.7	123.9	170.3	-52.5	-176.8	0	0	0	108.6	G550 Y552 V553	I548-G550 VanDerWaalsContact CG2-O 3.31Å; I548-G550 WeakPolarHBondContact CG2-O 3.13Å; I548-Y552 WeakPolarHBondContact CA-O 3.33Å; I548-V553 HydrophobicContact CD1-CG2 4.38Å; I548-V553 HydrophobicContact CG1-CG1 4.48Å; I548-V553 HydrophobicContact CG1-CG2 4.31Å
549	T	49.7	Very low	63	Low	100 Å²	100	67.5 Å²	67.5	61%	0.613	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-126.5	102.6	176	-56.9	0	0	0	0	108.8	L547 N551 Y552	L547-T549 PolarHBondContact O-N 3.07Å; T549-N551 PolarHBondContact O-N 2.87Å; T549-Y552 PolarHBondContact N-O 3.28Å; T549-Y552 VanDerWaalsContact N-O 3.16Å; T549-Y552 PolarHBondContact O-N 2.78Å
550	G	52.2	Low	64.3	Low	62 Å²	62	62.1 Å²	62.1	64%	0.639	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	-134.1	-168.2	0	0	0	0	0	111	I548 Y552	I548-G550 VanDerWaalsContact CG2-O 3.31Å; I548-G550 WeakPolarHBondContact CG2-O 3.13Å; G550-Y552 PolarHBondContact O-N 2.58Å
551	N	37.9	Very low	66.2	Low	170 Å²	170	57.2 Å²	57.2	91%	0.909	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	3.3	-178	-59.9	5.3	0	0	0	113.9	T549	T549-N551 PolarHBondContact O-N 2.87Å
552	Y	48.5	Very low	68.1	Low	71 Å²	71	49.6 Å²	49.6	28%	0.278	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-100.9	116	-174.1	-176.1	-99.1	0	0	0	112	R434 H534 I548 T549 G550 P554	R434-Y552 PolarHBondContact NH1-OH 3.43Å; H534-Y552 AromaticContact CE1-CZ 3.98Å; H534-Y552 PolarHBondContact CE1-OH 3.41Å; H534-Y552 PolarHBondContact ND1-OH 3.28Å; H534-Y552 VanDerWaalsContact ND1-OH 3.1Å; I548-Y552 WeakPolarHBondContact CA-O 3.33Å; T549-Y552 PolarHBondContact N-O 3.28Å; T549-Y552 VanDerWaalsContact N-O 3.16Å; T549-Y552 PolarHBondContact O-N 2.78Å; G550-Y552 PolarHBondContact O-N 2.58Å; Y552-P554 HydrophobicContact CD1-CB 4.49Å; Y552-P554 HydrophobicContact CE1-CB 3.8Å
553	V	60.1	Low	70.3	Confident	51 Å²	51	46.6 Å²	46.6	31%	0.309	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-99.9	116.4	167.7	-168.9	0	0	0	0	108.1	I548 M560 V564	I548-V553 HydrophobicContact CD1-CG2 4.38Å; I548-V553 HydrophobicContact CG1-CG1 4.48Å; I548-V553 HydrophobicContact CG1-CG2 4.31Å; V553-M560 HydrophobicContact CB-CE 4.1Å; V553-M560 HydrophobicContact CG1-CE 3.58Å; V553-M560 HydrophobicContact CG1-SD 3.64Å; V553-V564 HydrophobicContact CG1-CG1 4.04Å
554	P	65.1	Low	72.3	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.084	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-73	152.6	-177.7	25.5	-31.1	0	0	0	113.1	H534 L547 Y552 M560	H534-P554 HydrophobicContact CB-CB 4.48Å; L547-P554 HydrophobicContact CB-CG 3.76Å; L547-P554 VanDerWaalsContact O-CD 3.3Å; L547-P554 WeakPolarHBondContact O-CD 3.32Å; Y552-P554 HydrophobicContact CD1-CB 4.49Å; Y552-P554 HydrophobicContact CE1-CB 3.8Å; P554-M560 WeakPolarHBondContact O-CE 3.47Å
555	G	77.8	Confident	74.1	Confident	14 Å²	14	40.5 Å²	40.5	14%	0.144	24%	0.235	C	C	.	.	S	Bend	trans	83.1	-179.1	174.6	0	0	0	0	0	115.6	D512 H534 M560	D512-G555 WeakPolarHBondContact OD1-CA 3.34Å; H534-G555 PolarHBondContact ND1-N 2.85Å; H534-G555 VanDerWaalsContact ND1-N 3.16Å; G555-M560 VanDerWaalsContact O-CE 3.26Å; G555-M560 WeakPolarHBondContact O-CE 3.42Å
556	T	88.2	Confident	75.7	Confident	35 Å²	35	40.3 Å²	40.3	22%	0.215	24%	0.237	C	C	.	.			trans	-89.2	118.6	-173.7	-56.7	0	0	0	0	111.6	D512 K514 T558 H559 M560	D512-T556 WeakPolarHBondContact OD1-CB 3.5Å; D512-T556 PolarHBondContact OD1-N 2.97Å; D512-T556 PolarHBondContact OD1-OG1 3.22Å; K514-T556 HydrophobicContact CD-CG2 4.46Å; K514-T556 WeakPolarHBondContact CD-OG1 3.33Å; K514-T556 PolarHBondContact NZ-OG1 3.49Å; T556-T558 PolarHBondContact O-N 2.86Å; T556-T558 VanDerWaalsContact O-N 3.12Å; T556-H559 WeakPolarHBondContact O-CA 3.39Å; T556-H559 PolarHBondContact O-N 2.81Å; T556-M560 PolarHBondContact O-N 3Å
557	E	92.8	Very high	77	Confident	41 Å²	41	39.4 Å²	39.4	19%	0.192	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-44.9	-52.8	-168.3	-165.5	-170.2	-151.8	0	0	114.7	H559 M560 H599 L601 C602 I605	E557-H559 PolarHBondContact O-N 2.86Å; E557-M560 HydrophobicContact CB-CE 4.42Å; E557-M560 HydrophobicContact CG-SD 4.38Å; E557-M560 WeakPolarHBondContact O-CB 3.39Å; E557-M560 PolarHBondContact O-N 3.03Å; E557-H599 IonicContact OE2-CE1 3.66Å; E557-H599 IonicContact OE2-CG 3.76Å; E557-H599 IonicContact OE2-ND1 2.62Å; E557-H599 PolarHBondContact OE2-ND1 3.04Å; E557-L601 HydrophobicContact CG-CB 4.14Å; E557-L601 PolarHBondContact OE1-N 3.45Å; E557-L601 PolarHBondContact OE2-N 3.25Å; E557-C602 PolarHBondContact OE1-N 2.86Å; E557-C602 PolarHBondContact OE1-SG 3.31Å; E557-C602 VanDerWaalsContact OE1-SG 3.36Å; E557-I605 VanDerWaalsContact O-CD1 3.23Å; E557-I605 WeakPolarHBondContact O-CD1 3.49Å
558	T	96.1	Very high	78.2	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.031	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-53.8	-23.1	177.5	52.2	0	0	0	0	115.8	T556 H591 T594 L601	T556-T558 PolarHBondContact O-N 2.86Å; T556-T558 VanDerWaalsContact O-N 3.12Å; T558-H591 HydrophobicContact CG2-CB 3.88Å; T558-H591 PolarHBondContact OG1-ND1 3.27Å; T558-T594 HydrophobicContact CG2-CG2 3.48Å; T558-T594 VanDerWaalsContact CG2-CG2 3.48Å; T558-L601 HydrophobicContact CG2-CD1 3.58Å
559	H	97.3	Very high	79.3	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.019	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-105.5	-4	-179.3	-66.8	53.9	0	0	0	112.4	V513 T556 E557 W577 S578 C581 H591	V513-H559 PolarHBondContact O-CD2 3.39Å; T556-H559 WeakPolarHBondContact O-CA 3.39Å; T556-H559 PolarHBondContact O-N 2.81Å; E557-H559 PolarHBondContact O-N 2.86Å; H559-W577 VanDerWaalsContact O-CD1 3.29Å; H559-S578 PolarHBondContact O-OG 2.75Å; H559-S578 VanDerWaalsContact O-OG 3.1Å; H559-C581 HydrophobicContact CB-CB 4.05Å; H559-H591 AromaticContact CE1-CE1 3.82Å; H559-H591 AromaticContact CE1-CG 3.97Å; H559-H591 AromaticContact CE1-ND1 3.59Å; H559-H591 AromaticContact ND1-ND1 3.88Å
560	M	95.2	Very high	81	Confident	16 Å²	16	43 Å²	43	8%	0.079	24%	0.237	C	C	.	.			trans	-64.5	140.8	178.3	-67.1	178.3	-176.8	0	0	111.5	V553 P554 G555 T556 E557 V565 W577 I605	V553-M560 HydrophobicContact CB-CE 4.1Å; V553-M560 HydrophobicContact CG1-CE 3.58Å; V553-M560 HydrophobicContact CG1-SD 3.64Å; P554-M560 WeakPolarHBondContact O-CE 3.47Å; G555-M560 VanDerWaalsContact O-CE 3.26Å; G555-M560 WeakPolarHBondContact O-CE 3.42Å; T556-M560 PolarHBondContact O-N 3Å; E557-M560 HydrophobicContact CB-CE 4.42Å; E557-M560 HydrophobicContact CG-SD 4.38Å; E557-M560 WeakPolarHBondContact O-CB 3.39Å; E557-M560 PolarHBondContact O-N 3.03Å; M560-V565 HydrophobicContact CB-CG1 3.81Å; M560-V565 HydrophobicContact SD-CG1 3.92Å; M560-W577 PolarHBondContact O-NE1 3.08Å; M560-I605 WeakPolarHBondContact O-CG2 3.4Å
561	A	95.7	Very high	82.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.			trans	-83.7	155.3	177.2	0	0	0	0	0	112.2	E563 V564 V565 V574 W577	A561-E563 VanDerWaalsContact C-N 3.26Å; A561-E563 VanDerWaalsContact CB-CD 3.41Å; A561-E563 HydrophobicContact CB-CG 4.46Å; A561-E563 WeakPolarHBondContact CB-OE1 3.08Å; A561-E563 WeakPolarHBondContact CB-OE2 3.21Å; A561-E563 PolarHBondContact O-N 2.8Å; A561-V564 HydrophobicContact CB-CG2 4.19Å; A561-V564 WeakPolarHBondContact O-CB 3.27Å; A561-V564 PolarHBondContact O-N 3.44Å; A561-V565 PolarHBondContact O-N 3.21Å; A561-V574 HydrophobicContact CB-CG1 4.43Å; A561-W577 VanDerWaalsContact CA-CD1 3.49Å; A561-W577 HydrophobicContact CB-CB 3.86Å; A561-W577 HydrophobicContact CB-CD2 4.1Å; A561-W577 HydrophobicContact CB-CG 3.61Å
562	P	95	Very high	85.4	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-55.7	-38.6	-177	-26.1	35.7	0	0	0	113.4	V564 V565 M566 W577 I605 K633	P562-V564 VanDerWaalsContact C-N 3.31Å; P562-V564 PolarHBondContact O-N 2.73Å; P562-V565 WeakPolarHBondContact O-CG2 3.36Å; P562-M566 VanDerWaalsContact O-CB 3.29Å; P562-M566 WeakPolarHBondContact O-CB 3.43Å; P562-M566 WeakPolarHBondContact O-CG 3.34Å; P562-M566 PolarHBondContact O-N 3.33Å; P562-W577 HydrophobicContact CG-CE3 4.37Å; P562-W577 HydrophobicContact CG-CH2 3.56Å; P562-W577 HydrophobicContact CG-CZ2 3.95Å; P562-W577 HydrophobicContact CG-CZ3 3.79Å; P562-I605 HydrophobicContact CG-CG2 4.36Å; P562-K633 HydrophobicContact CG-CB 4.2Å; P562-K633 HydrophobicContact CG-CD 4.37Å; P562-K633 HydrophobicContact CG-CG 3.97Å
563	E	93.1	Very high	87.6	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-33.4	176.3	65.6	-81.4	-168.7	0	0	113.3	A561 G567 K568 V574 P635 R638	A561-E563 VanDerWaalsContact C-N 3.26Å; A561-E563 VanDerWaalsContact CB-CD 3.41Å; A561-E563 HydrophobicContact CB-CG 4.46Å; A561-E563 WeakPolarHBondContact CB-OE1 3.08Å; A561-E563 WeakPolarHBondContact CB-OE2 3.21Å; A561-E563 PolarHBondContact O-N 2.8Å; E563-G567 PolarHBondContact O-N 3.44Å; E563-K568 HydrophobicContact CB-CB 3.9Å; E563-K568 HydrophobicContact CB-CD 4.13Å; E563-K568 WeakPolarHBondContact O-CB 3.33Å; E563-K568 PolarHBondContact O-N 2.78Å; E563-V574 HydrophobicContact CG-CG2 4.09Å; E563-V574 WeakPolarHBondContact OE1-CG2 3.41Å; E563-P635 HydrophobicContact CB-CG 4.04Å; E563-P635 VanDerWaalsContact CD-CG 3.43Å; E563-P635 HydrophobicContact CG-CG 3.77Å; E563-R638 IonicContact OE1-CZ 2.75Å; E563-R638 IonicContact OE1-NH1 3.71Å; E563-R638 PolarHBondContact OE1-NH1 3.42Å; E563-R638 IonicContact OE1-NH2 3.42Å; E563-R638 PolarHBondContact OE1-NH2 3.11Å; E563-R638 IonicContact OE2-CZ 3.08Å; E563-R638 IonicContact OE2-NH1 2.65Å; E563-R638 IonicContact OE2-NH2 2.67Å; E563-R638 PolarHBondContact OE2-NH2 3.06Å
564	V	91.1	Very high	89.3	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-51.9	178	-175.1	0	0	0	0	110	L547 V553 A561 P562 M566 G567 V574	L547-V564 HydrophobicContact CD1-CG2 4.27Å; V553-V564 HydrophobicContact CG1-CG1 4.04Å; A561-V564 HydrophobicContact CB-CG2 4.19Å; A561-V564 WeakPolarHBondContact O-CB 3.27Å; A561-V564 PolarHBondContact O-N 3.44Å; P562-V564 VanDerWaalsContact C-N 3.31Å; P562-V564 PolarHBondContact O-N 2.73Å; V564-M566 PolarHBondContact O-N 3.07Å; V564-G567 PolarHBondContact O-N 3.25Å; V564-V574 HydrophobicContact CG2-CB 4.34Å; V564-V574 HydrophobicContact CG2-CG1 3.64Å; V564-V574 HydrophobicContact CG2-CG2 3.68Å
565	V	90.6	Very high	90.9	Very high	28 Å²	28	31.6 Å²	31.6	17%	0.17	16%	0.164	C	C	.	.	H	α-helix	trans	-69.6	-18.6	-178.8	-59.1	0	0	0	0	113.3	M560 A561 P562 C602 I605 A606	M560-V565 HydrophobicContact CB-CG1 3.81Å; M560-V565 HydrophobicContact SD-CG1 3.92Å; A561-V565 PolarHBondContact O-N 3.21Å; P562-V565 WeakPolarHBondContact O-CG2 3.36Å; V565-C602 HydrophobicContact CB-CB 4.19Å; V565-C602 HydrophobicContact CG1-CB 4.14Å; V565-I605 HydrophobicContact CG1-CD1 4.46Å; V565-I605 HydrophobicContact CG1-CG2 4.36Å; V565-I605 HydrophobicContact CG2-CB 4.09Å; V565-I605 HydrophobicContact CG2-CG2 3.77Å; V565-A606 HydrophobicContact CG2-CB 4.09Å
566	M	87.6	Confident	91.9	Very high	104 Å²	104	31 Å²	31	51%	0.512	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-0.2	172.3	-68.7	179.9	81	0	0	113.7	P562 V564 K568 A606	P562-M566 VanDerWaalsContact O-CB 3.29Å; P562-M566 WeakPolarHBondContact O-CB 3.43Å; P562-M566 WeakPolarHBondContact O-CG 3.34Å; P562-M566 PolarHBondContact O-N 3.33Å; V564-M566 PolarHBondContact O-N 3.07Å; M566-K568 HydrophobicContact CB-CD 4.45Å; M566-K568 HydrophobicContact CB-CG 4.01Å; M566-K568 PolarHBondContact O-N 2.9Å; M566-K568 HydrophobicContact SD-CD 4.42Å; M566-A606 HydrophobicContact CG-CB 4.12Å
567	G	84.2	Confident	92.4	Very high	35 Å²	35	29.3 Å²	29.3	36%	0.361	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	21.8	-174.7	0	0	0	0	0	114	E563 V564	E563-G567 PolarHBondContact O-N 3.44Å; V564-G567 PolarHBondContact O-N 3.25Å
568	K	85.6	Confident	92.6	Very high	70 Å²	70	27.6 Å²	27.6	30%	0.304	14%	0.14	S	C	.	.			trans	-71.2	165.3	175.8	-72.4	-179.4	177.8	178	0	109.7	E563 M566 C570 E634	E563-K568 HydrophobicContact CB-CB 3.9Å; E563-K568 HydrophobicContact CB-CD 4.13Å; E563-K568 WeakPolarHBondContact O-CB 3.33Å; E563-K568 PolarHBondContact O-N 2.78Å; M566-K568 HydrophobicContact CB-CD 4.45Å; M566-K568 HydrophobicContact CB-CG 4.01Å; M566-K568 PolarHBondContact O-N 2.9Å; M566-K568 HydrophobicContact SD-CD 4.42Å; K568-C570 PolarHBondContact O-N 2.82Å; K568-C570 PolarHBondContact O-SG 3.03Å; K568-E634 IonicContact NZ-OE1 2.73Å; K568-E634 PolarHBondContact NZ-OE1 2.56Å; K568-E634 IonicContact NZ-OE2 3.59Å; K568-E634 PolarHBondContact NZ-OE2 3.24Å; K568-E634 VanDerWaalsContact NZ-OE2 3.17Å
569	R	81.4	Confident	92.8	Very high	173 Å²	173	27.4 Å²	27.4	65%	0.653	14%	0.139	S	C	*	.			trans	-54.1	124.4	165.4	-80	166.2	160.6	153	-3	110.3	L543	L543-R569 WeakPolarHBondContact O-CD 3.29Å; L543-R569 WeakPolarHBondContact O-CG 3.48Å; L543-R569 PolarHBondContact O-NE 3.16Å
570	C	85.6	Confident	92.8	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.027	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-107.7	150.2	-179.6	-63.1	0	0	0	0	111.2	K545 L547 K568 V574	K545-C570 PolarHBondContact N-O 2.81Å; K545-C570 WeakPolarHBondContact O-CB 3.38Å; K545-C570 PolarHBondContact O-N 3.38Å; L547-C570 HydrophobicContact CD1-CB 3.57Å; L547-C570 HydrophobicContact CG-CB 3.69Å; K568-C570 PolarHBondContact O-N 2.82Å; K568-C570 PolarHBondContact O-SG 3.03Å; C570-V574 HydrophobicContact CB-CG2 3.98Å
571	D	89.1	Confident	93	Very high	57 Å²	57	26.4 Å²	26.4	31%	0.305	13%	0.134	S	C	.	.			trans	-137.9	-168.4	174.6	68.3	6.7	0	0	0	110.1	L509 K573 V574	L509-D571 WeakPolarHBondContact CD1-O 3.26Å; D571-K573 PolarHBondContact O-N 3.2Å; D571-K573 VanDerWaalsContact O-N 3.12Å; D571-K573 WeakPolarHBondContact OD1-CB 3.25Å; D571-K573 WeakPolarHBondContact OD1-CG 3.44Å; D571-K573 PolarHBondContact OD1-N 3.35Å; D571-V574 WeakPolarHBondContact O-CG2 3.22Å; D571-V574 PolarHBondContact O-N 2.85Å
572	S	92.9	Very high	93.1	Very high	32 Å²	32	26.4 Å²	26.4	22%	0.224	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-14	179.1	51.4	0	0	0	0	115.2	H504 V574 D575	H504-S572 PolarHBondContact CE1-O 3.13Å; S572-V574 PolarHBondContact O-N 2.87Å; S572-D575 PolarHBondContact O-N 3.09Å
573	K	95.8	Very high	93.3	Very high	34 Å²	34	26.3 Å²	26.3	15%	0.148	13%	0.134	C	C	.	.	H	α-helix	trans	-69	-17.5	178.6	-56	-68	-172.2	74.6	0	112.7	D571 D575 V576 W577 P635 R638 A639	D571-K573 PolarHBondContact O-N 3.2Å; D571-K573 VanDerWaalsContact O-N 3.12Å; D571-K573 WeakPolarHBondContact OD1-CB 3.25Å; D571-K573 WeakPolarHBondContact OD1-CG 3.44Å; D571-K573 PolarHBondContact OD1-N 3.35Å; K573-D575 VanDerWaalsContact C-N 3.34Å; K573-V576 PolarHBondContact O-N 2.85Å; K573-W577 PolarHBondContact O-N 2.82Å; K573-W577 VanDerWaalsContact O-N 3.1Å; K573-P635 HydrophobicContact CB-CB 4.03Å; K573-P635 HydrophobicContact CG-CB 4.2Å; K573-P635 WeakPolarHBondContact CG-O 3.41Å; K573-P635 PolarHBondContact NZ-O 2.92Å; K573-R638 VanDerWaalsContact C-NH1 3.32Å; K573-R638 WeakPolarHBondContact CE-O 3.38Å; K573-R638 PolarHBondContact NZ-O 2.9Å; K573-R638 WeakPolarHBondContact O-CD 3.03Å; K573-R638 PolarHBondContact O-NH1 2.93Å; K573-A639 VanDerWaalsContact CD-O 3.3Å; K573-A639 WeakPolarHBondContact CD-O 3.48Å
574	V	95.8	Very high	93.6	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.03	13%	0.133	C	C	.	.	H	α-helix	trans	-59.7	-44	173	174.1	0	0	0	0	111.2	L509 L547 A561 E563 V564 C570 D571 S572 V576 W577 S578	L509-V574 HydrophobicContact CD1-CB 4.17Å; L547-V574 HydrophobicContact CD1-CG1 4.43Å; L547-V574 HydrophobicContact CD1-CG2 4.31Å; A561-V574 HydrophobicContact CB-CG1 4.43Å; E563-V574 HydrophobicContact CG-CG2 4.09Å; E563-V574 WeakPolarHBondContact OE1-CG2 3.41Å; V564-V574 HydrophobicContact CG2-CB 4.34Å; V564-V574 HydrophobicContact CG2-CG1 3.64Å; V564-V574 HydrophobicContact CG2-CG2 3.68Å; C570-V574 HydrophobicContact CB-CG2 3.98Å; D571-V574 WeakPolarHBondContact O-CG2 3.22Å; D571-V574 PolarHBondContact O-N 2.85Å; S572-V574 PolarHBondContact O-N 2.87Å; V574-V576 VanDerWaalsContact C-N 3.31Å; V574-V576 PolarHBondContact O-N 2.82Å; V574-W577 PolarHBondContact O-N 2.85Å; V574-S578 WeakPolarHBondContact O-CB 3.37Å; V574-S578 PolarHBondContact O-N 2.91Å; V574-S578 PolarHBondContact O-OG 2.88Å
575	D	97.6	Very high	93.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.4	-34.6	177.2	-71.1	-21.2	0	0	0	111.5	L500 H504 L509 H510 G511 V513 S572 K573 S578 S579	L500-D575 HydrophobicContact CD1-CB 4.03Å; L500-D575 HydrophobicContact CD2-CB 3.94Å; H504-D575 IonicContact CD2-OD2 2.74Å; H504-D575 IonicContact CE1-OD2 2.64Å; H504-D575 IonicContact NE2-OD2 2.69Å; H504-D575 PolarHBondContact NE2-OD2 2.84Å; L509-D575 HydrophobicContact CD1-CB 4.37Å; L509-D575 VanDerWaalsContact CD1-CG 3.45Å; L509-D575 WeakPolarHBondContact CD1-OD1 3.2Å; L509-D575 WeakPolarHBondContact CD1-OD2 3.49Å; H510-D575 PolarHBondContact N-OD1 3.16Å; H510-D575 PolarHBondContact N-OD2 2.86Å; G511-D575 PolarHBondContact N-OD1 2.98Å; V513-D575 HydrophobicContact CG2-CB 3.88Å; S572-D575 PolarHBondContact O-N 3.09Å; K573-D575 VanDerWaalsContact C-N 3.34Å; D575-S578 PolarHBondContact O-N 3.08Å; D575-S579 WeakPolarHBondContact O-CB 3.36Å; D575-S579 PolarHBondContact O-N 3.48Å
576	V	98.5	Very high	94.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-65.5	-45.5	178.4	-175.2	0	0	0	0	110.8	K573 V574 S579 C580 A641 L644	K573-V576 PolarHBondContact O-N 2.85Å; V574-V576 VanDerWaalsContact C-N 3.31Å; V574-V576 PolarHBondContact O-N 2.82Å; V576-S579 PolarHBondContact O-N 2.87Å; V576-S579 PolarHBondContact O-OG 3.34Å; V576-C580 PolarHBondContact O-N 2.85Å; V576-A641 HydrophobicContact CG2-CB 4.33Å; V576-L644 HydrophobicContact CG1-CD2 3.64Å
577	W	98.6	Very high	94.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.9	-49.1	173.2	172	-77.8	0	0	0	111.4	H559 M560 A561 P562 K573 V574 S579 C580 C581 W593 I605 P610 G630 L631 K633	H559-W577 VanDerWaalsContact O-CD1 3.29Å; M560-W577 PolarHBondContact O-NE1 3.08Å; A561-W577 VanDerWaalsContact CA-CD1 3.49Å; A561-W577 HydrophobicContact CB-CB 3.86Å; A561-W577 HydrophobicContact CB-CD2 4.1Å; A561-W577 HydrophobicContact CB-CG 3.61Å; P562-W577 HydrophobicContact CG-CE3 4.37Å; P562-W577 HydrophobicContact CG-CH2 3.56Å; P562-W577 HydrophobicContact CG-CZ2 3.95Å; P562-W577 HydrophobicContact CG-CZ3 3.79Å; K573-W577 PolarHBondContact O-N 2.82Å; K573-W577 VanDerWaalsContact O-N 3.1Å; V574-W577 PolarHBondContact O-N 2.85Å; W577-S579 PolarHBondContact O-N 2.81Å; W577-C580 PolarHBondContact O-N 3.31Å; W577-C581 PolarHBondContact O-N 3.23Å; W577-W593 HydrophobicContact CZ2-CZ2 4.1Å; W577-I605 HydrophobicContact CZ2-CG2 4.48Å; W577-P610 HydrophobicContact CH2-CB 3.98Å; W577-P610 HydrophobicContact CZ3-CB 4.16Å; W577-G630 WeakPolarHBondContact CA-O 3.3Å; W577-L631 HydrophobicContact CD2-CD2 3.65Å; W577-L631 HydrophobicContact CE3-CB 4.29Å; W577-L631 HydrophobicContact CE3-CD2 3.79Å; W577-L631 HydrophobicContact CG-CD2 4.08Å; W577-L631 HydrophobicContact CH2-CD2 4.45Å; W577-L631 HydrophobicContact CZ2-CD2 4.33Å; W577-L631 HydrophobicContact CZ3-CB 4.2Å; W577-L631 HydrophobicContact CZ3-CD2 4.2Å; W577-L631 VanDerWaalsContact CZ3-O 3.25Å; W577-L631 WeakPolarHBondContact CZ3-O 3.39Å; W577-K633 HydrophobicContact CH2-CG 4.19Å; W577-K633 HydrophobicContact CZ3-CG 4.08Å
578	S	98.6	Very high	95.4	Very high	5 Å²	5	19.4 Å²	19.4	4%	0.035	9%	0.089	C	C	.	.	H	α-helix	trans	-56.9	-37.8	177	-54.9	0	0	0	0	112	V513 H559 V574 D575 C580 C581 M582	V513-S578 WeakPolarHBondContact O-CB 3.31Å; H559-S578 PolarHBondContact O-OG 2.75Å; H559-S578 VanDerWaalsContact O-OG 3.1Å; V574-S578 WeakPolarHBondContact O-CB 3.37Å; V574-S578 PolarHBondContact O-N 2.91Å; V574-S578 PolarHBondContact O-OG 2.88Å; D575-S578 PolarHBondContact O-N 3.08Å; S578-C580 PolarHBondContact O-N 2.92Å; S578-C581 WeakPolarHBondContact O-CB 3.5Å; S578-C581 PolarHBondContact O-N 2.92Å; S578-M582 PolarHBondContact O-N 2.78Å
579	S	98.8	Very high	95.9	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.9	-33.8	175.4	82.2	0	0	0	0	113.5	D575 V576 W577 M582 M583	D575-S579 WeakPolarHBondContact O-CB 3.36Å; D575-S579 PolarHBondContact O-N 3.48Å; V576-S579 PolarHBondContact O-N 2.87Å; V576-S579 PolarHBondContact O-OG 3.34Å; W577-S579 PolarHBondContact O-N 2.81Å; S579-M582 WeakPolarHBondContact O-CB 3.44Å; S579-M582 PolarHBondContact O-N 2.89Å; S579-M583 PolarHBondContact O-N 3.2Å
580	C	98.8	Very high	96.6	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-78.2	-29.9	173.1	-78.3	0	0	0	0	113	V576 W577 S578 M582 M583 L584 L631	V576-C580 PolarHBondContact O-N 2.85Å; W577-C580 PolarHBondContact O-N 3.31Å; S578-C580 PolarHBondContact O-N 2.92Å; C580-M582 VanDerWaalsContact C-N 3.3Å; C580-M583 WeakPolarHBondContact O-CB 3.36Å; C580-M583 PolarHBondContact O-N 3.13Å; C580-L584 PolarHBondContact O-N 3.19Å; C580-L631 HydrophobicContact CB-CD1 4.17Å; C580-L631 HydrophobicContact CB-CD2 3.7Å; C580-L631 HydrophobicContact CB-CG 3.6Å
581	C	98.8	Very high	97.1	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61	-40.8	165.4	-71.1	0	0	0	0	111.2	H559 W577 S578 L584 H585 P592	H559-C581 HydrophobicContact CB-CB 4.05Å; W577-C581 PolarHBondContact O-N 3.23Å; S578-C581 WeakPolarHBondContact O-CB 3.5Å; S578-C581 PolarHBondContact O-N 2.92Å; C581-L584 PolarHBondContact O-N 2.87Å; C581-H585 PolarHBondContact O-N 2.91Å; C581-P592 HydrophobicContact CB-CG 3.84Å
582	M	98.7	Very high	97.4	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-64.9	-37.1	172.2	-178.5	-178.4	72.3	0	0	112.5	L474 A496 K514 A515 V518 S578 S579 C580 H585 M586	L474-M582 HydrophobicContact CD2-SD 4.15Å; A496-M582 HydrophobicContact CB-CE 3.9Å; K514-M582 VanDerWaalsContact C-SD 3.56Å; A515-M582 HydrophobicContact CB-CG 4.12Å; V518-M582 HydrophobicContact CG2-CE 4.37Å; V518-M582 HydrophobicContact CG2-SD 3.79Å; S578-M582 PolarHBondContact O-N 2.78Å; S579-M582 WeakPolarHBondContact O-CB 3.44Å; S579-M582 PolarHBondContact O-N 2.89Å; C580-M582 VanDerWaalsContact C-N 3.3Å; M582-H585 WeakPolarHBondContact O-CB 3.45Å; M582-H585 PolarHBondContact O-N 2.67Å; M582-M586 PolarHBondContact O-N 2.87Å
583	M	98.7	Very high	97.6	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.9	-45.3	173.7	-173.5	60.8	168.1	0	0	111.9	A489 L490 L493 S579 C580 H585 M586 L587 T623 I627	A489-M583 HydrophobicContact CB-CE 3.88Å; A489-M583 HydrophobicContact CB-SD 3.73Å; L490-M583 HydrophobicContact CD2-CE 3.77Å; L490-M583 HydrophobicContact CG-CE 3.88Å; L493-M583 HydrophobicContact CB-SD 4.12Å; L493-M583 HydrophobicContact CD2-CB 4.17Å; L493-M583 HydrophobicContact CD2-CE 4.28Å; L493-M583 HydrophobicContact CD2-CG 3.95Å; L493-M583 HydrophobicContact CD2-SD 3.84Å; S579-M583 PolarHBondContact O-N 3.2Å; C580-M583 WeakPolarHBondContact O-CB 3.36Å; C580-M583 PolarHBondContact O-N 3.13Å; M583-H585 VanDerWaalsContact C-N 3.27Å; M583-H585 PolarHBondContact O-N 3.42Å; M583-M586 PolarHBondContact O-N 2.69Å; M583-M586 HydrophobicContact SD-CE 3.72Å; M583-L587 HydrophobicContact CE-CD1 4.14Å; M583-L587 HydrophobicContact CE-CG 4.46Å; M583-L587 HydrophobicContact CG-CD1 4.14Å; M583-L587 WeakPolarHBondContact O-CB 3.49Å; M583-L587 WeakPolarHBondContact O-CG 3.39Å; M583-L587 PolarHBondContact O-N 2.67Å; M583-L587 HydrophobicContact SD-CD1 4.43Å; M583-L587 HydrophobicContact SD-CG 4.49Å; M583-T623 HydrophobicContact CE-CG2 3.66Å; M583-I627 HydrophobicContact CB-CG1 4.47Å; M583-I627 HydrophobicContact CG-CD1 3.85Å; M583-I627 HydrophobicContact CG-CG1 3.83Å
584	L	98.6	Very high	97.6	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61	-35.9	172.9	-72.3	175.2	0	0	0	112.1	C580 C581 N588 P592 P611 E614 I615 I627 L631	C580-L584 PolarHBondContact O-N 3.19Å; C581-L584 PolarHBondContact O-N 2.87Å; L584-N588 WeakPolarHBondContact O-CB 3.3Å; L584-N588 PolarHBondContact O-N 2.85Å; L584-N588 PolarHBondContact O-ND2 2.77Å; L584-P592 HydrophobicContact CB-CB 4.45Å; L584-P592 HydrophobicContact CD1-CB 4.12Å; L584-P611 HydrophobicContact CD1-CB 4.25Å; L584-P611 HydrophobicContact CD1-CG 3.95Å; L584-E614 HydrophobicContact CD1-CB 4.43Å; L584-E614 HydrophobicContact CD2-CB 4.32Å; L584-I615 HydrophobicContact CD2-CG1 4.01Å; L584-I627 HydrophobicContact CD2-CG2 4.12Å; L584-I627 HydrophobicContact CG-CG2 4.2Å; L584-L631 HydrophobicContact CD1-CD1 3.78Å
585	H	98.3	Very high	97.5	Very high	7 Å²	7	11.1 Å²	11.1	3%	0.032	6%	0.064	C	C	.	.	H	α-helix	trans	-66.5	-46.6	174.9	-177.8	-167.9	0	0	0	112.4	C581 M582 M583 L587 G589 C590 H591	C581-H585 PolarHBondContact O-N 2.91Å; M582-H585 WeakPolarHBondContact O-CB 3.45Å; M582-H585 PolarHBondContact O-N 2.67Å; M583-H585 VanDerWaalsContact C-N 3.27Å; M583-H585 PolarHBondContact O-N 3.42Å; H585-L587 VanDerWaalsContact C-N 3.31Å; H585-L587 PolarHBondContact O-N 3.27Å; H585-G589 WeakPolarHBondContact O-CA 3.29Å; H585-G589 PolarHBondContact O-N 3.23Å; H585-C590 VanDerWaalsContact CA-O 3.3Å; H585-C590 WeakPolarHBondContact CA-O 3.34Å; H585-H591 AromaticContact CD2-CD2 3.9Å; H585-H591 AromaticContact CE1-CD2 3.25Å; H585-H591 PolarHBondContact CE1-CD2 2.92Å; H585-H591 AromaticContact CE1-NE2 3.22Å; H585-H591 PolarHBondContact CE1-NE2 3.09Å; H585-H591 AromaticContact CG-CD2 3.81Å; H585-H591 AromaticContact ND1-CD2 3.39Å; H585-H591 PolarHBondContact ND1-CD2 2.19Å; H585-H591 AromaticContact ND1-NE2 3.5Å; H585-H591 PolarHBondContact ND1-NE2 3.46Å; H585-H591 AromaticContact NE2-CD2 3.58Å; H585-H591 AromaticContact NE2-NE2 3.94Å
586	M	98.4	Very high	97.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-56.7	-44.9	174.4	-74.8	-170.5	-73	0	0	112.2	L474 I478 L484 A489 Y492 L493 M582 M583	L474-M586 HydrophobicContact CD1-CG 4.44Å; L474-M586 HydrophobicContact CD1-SD 4.02Å; L474-M586 HydrophobicContact CD2-CG 4.36Å; L474-M586 HydrophobicContact CD2-SD 3.73Å; L474-M586 HydrophobicContact CG-CG 4.49Å; L474-M586 HydrophobicContact CG-SD 4.26Å; I478-M586 HydrophobicContact CD1-CB 4.47Å; I478-M586 HydrophobicContact CD1-CG 3.86Å; I478-M586 HydrophobicContact CG1-CG 4.39Å; L484-M586 HydrophobicContact CB-CB 4.43Å; L484-M586 HydrophobicContact CD1-CB 4.1Å; L484-M586 HydrophobicContact CD1-CG 3.84Å; L484-M586 HydrophobicContact CD1-SD 3.96Å; L484-M586 HydrophobicContact CG-CB 4.43Å; L484-M586 PolarHBondContact N-O 3.34Å; A489-M586 HydrophobicContact CB-CB 3.96Å; A489-M586 HydrophobicContact CB-CE 4.26Å; A489-M586 HydrophobicContact CB-SD 4.24Å; A489-M586 VanDerWaalsContact O-CE 3.29Å; A489-M586 WeakPolarHBondContact O-CE 3.43Å; Y492-M586 HydrophobicContact CD2-SD 4.23Å; L493-M586 HydrophobicContact CB-CE 4.17Å; M582-M586 PolarHBondContact O-N 2.87Å; M583-M586 PolarHBondContact O-N 2.69Å; M583-M586 HydrophobicContact SD-CE 3.72Å
587	L	97.6	Very high	97	Very high	15 Å²	15	16.5 Å²	16.5	8%	0.079	9%	0.086	C	C	.	.	H	α-helix	trans	-75.6	-37.6	-174.8	-70.2	173.4	0	0	0	114.1	E486 A489 M583 H585 P616 I627	E486-L587 HydrophobicContact CB-CD2 4.47Å; A489-L587 HydrophobicContact CB-CD2 3.87Å; A489-L587 HydrophobicContact CB-CG 4.28Å; M583-L587 HydrophobicContact CE-CD1 4.14Å; M583-L587 HydrophobicContact CE-CG 4.46Å; M583-L587 HydrophobicContact CG-CD1 4.14Å; M583-L587 WeakPolarHBondContact O-CB 3.49Å; M583-L587 WeakPolarHBondContact O-CG 3.39Å; M583-L587 PolarHBondContact O-N 2.67Å; M583-L587 HydrophobicContact SD-CD1 4.43Å; M583-L587 HydrophobicContact SD-CG 4.49Å; H585-L587 VanDerWaalsContact C-N 3.31Å; H585-L587 PolarHBondContact O-N 3.27Å; L587-P616 HydrophobicContact CB-CG 3.88Å; L587-P616 HydrophobicContact CD1-CG 4.28Å; L587-I627 HydrophobicContact CD1-CD1 3.75Å
588	N	96.9	Very high	96.6	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-97.9	-18.5	-175.3	-64.1	-71.5	0	0	0	114	L584 C590 E614 P669 R670	L584-N588 WeakPolarHBondContact O-CB 3.3Å; L584-N588 PolarHBondContact O-N 2.85Å; L584-N588 PolarHBondContact O-ND2 2.77Å; N588-C590 VanDerWaalsContact C-N 3.32Å; N588-E614 PolarHBondContact ND2-O 3.24Å; N588-E614 PolarHBondContact OD1-O 2.79Å; N588-P669 WeakPolarHBondContact O-CA 3.34Å; N588-R670 HydrophobicContact CB-CB 4.26Å; N588-R670 PolarHBondContact O-N 3.2Å; N588-R670 WeakPolarHBondContact OD1-CD 3.49Å; N588-R670 PolarHBondContact OD1-NH1 2.9Å; N588-R670 VanDerWaalsContact OD1-NH1 3.16Å
589	G	96.3	Very high	96.1	Very high	18 Å²	18	28.8 Å²	28.8	19%	0.186	15%	0.147	C	C	.	.	S	Bend	trans	81.5	6.4	-175.8	0	0	0	0	0	115	G482 H585	G482-G589 WeakPolarHBondContact O-CA 3.24Å; H585-G589 WeakPolarHBondContact O-CA 3.29Å; H585-G589 PolarHBondContact O-N 3.23Å
590	C	95.7	Very high	95.7	Very high	28 Å²	28	33.9 Å²	33.9	19%	0.189	18%	0.18	C	C	.	.	S	Bend	trans	-144.6	158.9	176.1	66.6	0	0	0	0	110.6	H585 N588 Q595	H585-C590 VanDerWaalsContact CA-O 3.3Å; H585-C590 WeakPolarHBondContact CA-O 3.34Å; N588-C590 VanDerWaalsContact C-N 3.32Å; C590-Q595 PolarHBondContact SG-NE2 3.24Å
591	H	96.6	Very high	95.4	Very high	44 Å²	44	33.9 Å²	33.9	20%	0.204	18%	0.18	C	C	.	.			trans	-61.5	151.5	174.5	-71.5	-148.5	0	0	0	110.9	T558 H559 H585 T594	T558-H591 HydrophobicContact CG2-CB 3.88Å; T558-H591 PolarHBondContact OG1-ND1 3.27Å; H559-H591 AromaticContact CE1-CE1 3.82Å; H559-H591 AromaticContact CE1-CG 3.97Å; H559-H591 AromaticContact CE1-ND1 3.59Å; H559-H591 AromaticContact ND1-ND1 3.88Å; H585-H591 AromaticContact CD2-CD2 3.9Å; H585-H591 AromaticContact CE1-CD2 3.25Å; H585-H591 PolarHBondContact CE1-CD2 2.92Å; H585-H591 AromaticContact CE1-NE2 3.22Å; H585-H591 PolarHBondContact CE1-NE2 3.09Å; H585-H591 AromaticContact CG-CD2 3.81Å; H585-H591 AromaticContact ND1-CD2 3.39Å; H585-H591 PolarHBondContact ND1-CD2 2.19Å; H585-H591 AromaticContact ND1-NE2 3.5Å; H585-H591 PolarHBondContact ND1-NE2 3.46Å; H585-H591 AromaticContact NE2-CD2 3.58Å; H585-H591 AromaticContact NE2-NE2 3.94Å; H591-T594 HydrophobicContact CB-CG2 4.03Å; H591-T594 PolarHBondContact O-OG1 3.24Å
592	P	96.8	Very high	95	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.193	C	C	.	.	S	Bend	trans	-64.3	161.9	173	28.6	-35.4	0	0	0	111.2	C581 L584 T594 P611 E614	C581-P592 HydrophobicContact CB-CG 3.84Å; L584-P592 HydrophobicContact CB-CB 4.45Å; L584-P592 HydrophobicContact CD1-CB 4.12Å; P592-T594 PolarHBondContact O-N 2.96Å; P592-P611 HydrophobicContact CB-CB 4.44Å; P592-P611 HydrophobicContact CB-CG 4.38Å; P592-E614 WeakPolarHBondContact CA-OE2 3.35Å
593	W	96.6	Very high	94.6	Very high	1 Å²	1	41 Å²	41	0%	0.004	22%	0.22	C	C	.	.	S	Bend	trans	68.4	-38.6	-177.4	-43.1	98.9	0	0	0	115.9	W577 Q595 Y596 Y597 L601 I605 E608 P609 P611 E614	W577-W593 HydrophobicContact CZ2-CZ2 4.1Å; W593-Q595 PolarHBondContact O-N 3.1Å; W593-Y596 PolarHBondContact O-N 3.16Å; W593-Y597 HydrophobicContact CB-CD2 4.49Å; W593-Y597 HydrophobicContact CE3-CD2 4.12Å; W593-Y597 AromaticContact CE3-CE2 3.93Å; W593-Y597 HydrophobicContact CE3-CE2 3.93Å; W593-Y597 HydrophobicContact CZ3-CE2 4.37Å; W593-Y597 PolarHBondContact O-N 2.92Å; W593-L601 HydrophobicContact CB-CD1 4.04Å; W593-L601 HydrophobicContact CB-CD2 4.06Å; W593-I605 HydrophobicContact CD2-CG1 4.32Å; W593-I605 HydrophobicContact CZ2-CB 4.38Å; W593-I605 HydrophobicContact CZ2-CG1 3.93Å; W593-E608 HydrophobicContact CZ3-CB 4.01Å; W593-P609 WeakPolarHBondContact CH2-O 3.36Å; W593-P611 HydrophobicContact CD2-CB 4.41Å; W593-P611 HydrophobicContact CH2-CB 4.42Å; W593-P611 HydrophobicContact CH2-CG 4.37Å; W593-P611 HydrophobicContact CZ2-CB 4.29Å; W593-P611 HydrophobicContact CZ2-CG 3.88Å; W593-E614 PolarHBondContact N-OE1 3.2Å; W593-E614 PolarHBondContact N-OE2 2.75Å
594	T	94.9	Very high	94.4	Very high	54 Å²	54	44.5 Å²	44.5	33%	0.331	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.9	-167.3	65.1	0	0	0	0	114.7	T558 H591 P592 L601	T558-T594 HydrophobicContact CG2-CG2 3.48Å; T558-T594 VanDerWaalsContact CG2-CG2 3.48Å; H591-T594 HydrophobicContact CB-CG2 4.03Å; H591-T594 PolarHBondContact O-OG1 3.24Å; P592-T594 PolarHBondContact O-N 2.96Å; T594-L601 HydrophobicContact CG2-CD1 4.31Å
595	Q	93.3	Very high	94.2	Very high	54 Å²	54	44.5 Å²	44.5	25%	0.252	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-29.7	171.8	-55.1	-157.4	-29.3	0	0	113	C590 W593 R670 L672	C590-Q595 PolarHBondContact SG-NE2 3.24Å; W593-Q595 PolarHBondContact O-N 3.1Å; Q595-R670 PolarHBondContact NE2-O 2.95Å; Q595-R670 PolarHBondContact OE1-O 3.35Å; Q595-L672 HydrophobicContact CB-CD1 3.84Å; Q595-L672 HydrophobicContact CB-CG 3.96Å; Q595-L672 WeakPolarHBondContact O-CD1 3.5Å
596	Y	93.4	Very high	94	Very high	77 Å²	77	45.4 Å²	45.4	30%	0.302	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-25.2	-170.5	-61	-89.1	0	0	0	112.9	W593 E614 L672	W593-Y596 PolarHBondContact O-N 3.16Å; Y596-E614 HydrophobicContact CD2-CG 4.22Å; Y596-E614 VanDerWaalsContact CD2-OE1 3.31Å; Y596-E614 WeakPolarHBondContact CD2-OE1 3.43Å; Y596-E614 VanDerWaalsContact CE2-CD 3.42Å; Y596-E614 HydrophobicContact CE2-CG 3.52Å; Y596-L672 HydrophobicContact CD1-CD1 4.48Å; Y596-L672 HydrophobicContact CE1-CD1 4.5Å; Y596-L672 HydrophobicContact CE1-CD2 3.81Å; Y596-L672 HydrophobicContact CE2-CD2 4.41Å
597	Y	93.5	Very high	93.7	Very high	38 Å²	38	51.9 Å²	51.9	15%	0.149	27%	0.272	C	S	.	.			trans	-139.9	144.5	-177	-50.5	-66.3	0	0	0	111.1	W593 K604 E608 R613	W593-Y597 HydrophobicContact CB-CD2 4.49Å; W593-Y597 HydrophobicContact CE3-CD2 4.12Å; W593-Y597 AromaticContact CE3-CE2 3.93Å; W593-Y597 HydrophobicContact CE3-CE2 3.93Å; W593-Y597 HydrophobicContact CZ3-CE2 4.37Å; W593-Y597 PolarHBondContact O-N 2.92Å; Y597-K604 HydrophobicContact CD1-CD 3.96Å; Y597-K604 VanDerWaalsContact CD1-CE 3.47Å; Y597-K604 HydrophobicContact CD1-CG 4.14Å; Y597-K604 HydrophobicContact CD2-CB 4.14Å; Y597-K604 HydrophobicContact CD2-CD 4.45Å; Y597-K604 HydrophobicContact CD2-CG 4.08Å; Y597-K604 HydrophobicContact CE1-CD 3.99Å; Y597-K604 HydrophobicContact CE2-CB 4.42Å; Y597-K604 HydrophobicContact CE2-CD 4.49Å; Y597-K604 HydrophobicContact CG-CB 4.44Å; Y597-K604 HydrophobicContact CG-CD 4.19Å; Y597-K604 HydrophobicContact CG-CG 3.89Å; Y597-E608 WeakPolarHBondContact CE1-OE1 3.15Å; Y597-E608 HydrophobicContact CE2-CG 4.13Å; Y597-E608 PolarHBondContact OH-OE1 3.03Å; Y597-E608 VanDerWaalsContact OH-OE1 3.09Å; Y597-E608 PolarHBondContact OH-OE2 3.42Å; Y597-E608 VanDerWaalsContact OH-OE2 3.05Å; Y597-R613 VanDerWaalsContact CZ-NH2 3.31Å; Y597-R613 PolarHBondContact OH-NH1 3.24Å; Y597-R613 PolarHBondContact OH-NH2 2.99Å
598	N	90.6	Very high	93.6	Very high	147 Å²	147	53.4 Å²	53.4	79%	0.786	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-78.3	159.3	166.9	-63.4	-30.6	0	0	0	110.3
599	H	87.4	Confident	93.6	Very high	116 Å²	116	57.1 Å²	57.1	54%	0.537	30%	0.303	S	S	.	.	S	Bend	trans	-67.7	152.3	169.9	-66.5	-88.4	0	0	0	111.7	E557	E557-H599 IonicContact OE2-CE1 3.66Å; E557-H599 IonicContact OE2-CG 3.76Å; E557-H599 IonicContact OE2-ND1 2.62Å; E557-H599 PolarHBondContact OE2-ND1 3.04Å
600	P	90.8	Very high	93.6	Very high	107 Å²	107	57.5 Å²	57.5	70%	0.695	30%	0.302	S	S	*	.	P	Polyproline II helix	cis	-76.1	142.6	-2.9	31.2	-34.9	0	0	0	113
601	L	91.9	Very high	93.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.			trans	-94	-17.4	-175.9	-60.9	172.4	0	0	0	113.9	E557 T558 W593 T594 L603 K604 I605	E557-L601 HydrophobicContact CG-CB 4.14Å; E557-L601 PolarHBondContact OE1-N 3.45Å; E557-L601 PolarHBondContact OE2-N 3.25Å; T558-L601 HydrophobicContact CG2-CD1 3.58Å; W593-L601 HydrophobicContact CB-CD1 4.04Å; W593-L601 HydrophobicContact CB-CD2 4.06Å; T594-L601 HydrophobicContact CG2-CD1 4.31Å; L601-L603 VanDerWaalsContact C-N 3.28Å; L601-L603 PolarHBondContact O-N 3.3Å; L601-L603 VanDerWaalsContact O-N 3.14Å; L601-K604 CarbonylContact O-C 3.52Å; L601-K604 WeakPolarHBondContact O-CA 3.36Å; L601-K604 WeakPolarHBondContact O-CB 2.55Å; L601-K604 PolarHBondContact O-N 2.85Å; L601-I605 HydrophobicContact CB-CD1 4.1Å; L601-I605 HydrophobicContact CB-CG1 4.45Å; L601-I605 WeakPolarHBondContact O-CG1 3.48Å; L601-I605 PolarHBondContact O-N 3.25Å
602	C	90.5	Very high	93.7	Very high	40 Å²	40	57 Å²	57	27%	0.27	30%	0.299	S	S	.	.	H	α-helix	trans	-46.8	-46.8	-177.5	-72.5	0	0	0	0	114	E557 V565 K604 I605 A606	E557-C602 PolarHBondContact OE1-N 2.86Å; E557-C602 PolarHBondContact OE1-SG 3.31Å; E557-C602 VanDerWaalsContact OE1-SG 3.36Å; V565-C602 HydrophobicContact CB-CB 4.19Å; V565-C602 HydrophobicContact CG1-CB 4.14Å; C602-K604 VanDerWaalsContact C-N 3.3Å; C602-K604 PolarHBondContact O-N 2.6Å; C602-I605 PolarHBondContact O-N 2.94Å; C602-A606 WeakPolarHBondContact O-CB 3.46Å; C602-A606 PolarHBondContact O-N 2.8Å
603	L	89.8	Confident	93.7	Very high	110 Å²	110	62.1 Å²	62.1	58%	0.576	32%	0.318	S	S	*	.	H	α-helix	trans	-67	-30.6	178.9	-172.8	63.1	0	0	0	112.8	L601 K607	L601-L603 VanDerWaalsContact C-N 3.28Å; L601-L603 PolarHBondContact O-N 3.3Å; L601-L603 VanDerWaalsContact O-N 3.14Å; L603-K607 HydrophobicContact CD1-CD 3.97Å; L603-K607 HydrophobicContact CD1-CG 4.2Å; L603-K607 HydrophobicContact CG-CD 4.15Å; L603-K607 WeakPolarHBondContact O-CB 3.34Å; L603-K607 PolarHBondContact O-N 3.43Å
604	K	94.4	Very high	93.7	Very high	72 Å²	72	62.3 Å²	62.3	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-73.6	-47.4	175.9	-66.4	-58.2	-164.1	172.6	0	111.2	Y597 L601 C602 A606 K607 E608	Y597-K604 HydrophobicContact CD1-CD 3.96Å; Y597-K604 VanDerWaalsContact CD1-CE 3.47Å; Y597-K604 HydrophobicContact CD1-CG 4.14Å; Y597-K604 HydrophobicContact CD2-CB 4.14Å; Y597-K604 HydrophobicContact CD2-CD 4.45Å; Y597-K604 HydrophobicContact CD2-CG 4.08Å; Y597-K604 HydrophobicContact CE1-CD 3.99Å; Y597-K604 HydrophobicContact CE2-CB 4.42Å; Y597-K604 HydrophobicContact CE2-CD 4.49Å; Y597-K604 HydrophobicContact CG-CB 4.44Å; Y597-K604 HydrophobicContact CG-CD 4.19Å; Y597-K604 HydrophobicContact CG-CG 3.89Å; L601-K604 CarbonylContact O-C 3.52Å; L601-K604 WeakPolarHBondContact O-CA 3.36Å; L601-K604 WeakPolarHBondContact O-CB 2.55Å; L601-K604 PolarHBondContact O-N 2.85Å; C602-K604 VanDerWaalsContact C-N 3.3Å; C602-K604 PolarHBondContact O-N 2.6Å; K604-A606 PolarHBondContact O-N 3.17Å; K604-K607 PolarHBondContact O-N 3.27Å; K604-E608 HydrophobicContact CB-CG 4.07Å; K604-E608 HydrophobicContact CD-CG 3.77Å; K604-E608 WeakPolarHBondContact CD-OE1 3.43Å; K604-E608 IonicContact NZ-OE1 2.67Å; K604-E608 PolarHBondContact NZ-OE1 2.72Å; K604-E608 WeakPolarHBondContact O-CB 3.42Å; K604-E608 VanDerWaalsContact O-CG 3.28Å; K604-E608 WeakPolarHBondContact O-CG 3.39Å; K604-E608 PolarHBondContact O-N 3.19Å
605	I	95.1	Very high	93.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.7	-40.4	173.9	-63.2	164.9	0	0	0	110.5	E557 M560 P562 V565 W577 W593 L601 C602 K633	E557-I605 VanDerWaalsContact O-CD1 3.23Å; E557-I605 WeakPolarHBondContact O-CD1 3.49Å; M560-I605 WeakPolarHBondContact O-CG2 3.4Å; P562-I605 HydrophobicContact CG-CG2 4.36Å; V565-I605 HydrophobicContact CG1-CD1 4.46Å; V565-I605 HydrophobicContact CG1-CG2 4.36Å; V565-I605 HydrophobicContact CG2-CB 4.09Å; V565-I605 HydrophobicContact CG2-CG2 3.77Å; W577-I605 HydrophobicContact CZ2-CG2 4.48Å; W593-I605 HydrophobicContact CD2-CG1 4.32Å; W593-I605 HydrophobicContact CZ2-CB 4.38Å; W593-I605 HydrophobicContact CZ2-CG1 3.93Å; L601-I605 HydrophobicContact CB-CD1 4.1Å; L601-I605 HydrophobicContact CB-CG1 4.45Å; L601-I605 WeakPolarHBondContact O-CG1 3.48Å; L601-I605 PolarHBondContact O-N 3.25Å; C602-I605 PolarHBondContact O-N 2.94Å; I605-K633 PolarHBondContact O-NZ 2.91Å
606	A	93.1	Very high	93.9	Very high	26 Å²	26	58.8 Å²	58.8	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-68.3	-53.1	175.4	0	0	0	0	0	113.7	V565 M566 C602 K604 K633	V565-A606 HydrophobicContact CG2-CB 4.09Å; M566-A606 HydrophobicContact CG-CB 4.12Å; C602-A606 WeakPolarHBondContact O-CB 3.46Å; C602-A606 PolarHBondContact O-N 2.8Å; K604-A606 PolarHBondContact O-N 3.17Å; A606-K633 PolarHBondContact O-NZ 3.39Å
607	K	92.7	Very high	94	Very high	137 Å²	137	60.9 Å²	60.9	60%	0.596	32%	0.324	S	S	*	.	H	α-helix	trans	-84.1	-39.4	-171.9	-73.1	-176.4	171.6	178.2	0	115.1	L603 K604 E771	L603-K607 HydrophobicContact CD1-CD 3.97Å; L603-K607 HydrophobicContact CD1-CG 4.2Å; L603-K607 HydrophobicContact CG-CD 4.15Å; L603-K607 WeakPolarHBondContact O-CB 3.34Å; L603-K607 PolarHBondContact O-N 3.43Å; K604-K607 PolarHBondContact O-N 3.27Å; K607-E771 IonicContact NZ-OE1 2.6Å; K607-E771 PolarHBondContact NZ-OE1 3.04Å
608	E	95.6	Very high	94	Very high	46 Å²	46	64 Å²	64	22%	0.215	35%	0.351	C	S	.	.	S	Bend	trans	-76.5	161.6	-171.1	-57.9	-79	-179	0	0	112	W593 Y597 K604 K633	W593-E608 HydrophobicContact CZ3-CB 4.01Å; Y597-E608 WeakPolarHBondContact CE1-OE1 3.15Å; Y597-E608 HydrophobicContact CE2-CG 4.13Å; Y597-E608 PolarHBondContact OH-OE1 3.03Å; Y597-E608 VanDerWaalsContact OH-OE1 3.09Å; Y597-E608 PolarHBondContact OH-OE2 3.42Å; Y597-E608 VanDerWaalsContact OH-OE2 3.05Å; K604-E608 HydrophobicContact CB-CG 4.07Å; K604-E608 HydrophobicContact CD-CG 3.77Å; K604-E608 WeakPolarHBondContact CD-OE1 3.43Å; K604-E608 IonicContact NZ-OE1 2.67Å; K604-E608 PolarHBondContact NZ-OE1 2.72Å; K604-E608 WeakPolarHBondContact O-CB 3.42Å; K604-E608 VanDerWaalsContact O-CG 3.28Å; K604-E608 WeakPolarHBondContact O-CG 3.39Å; K604-E608 PolarHBondContact O-N 3.19Å; E608-K633 PolarHBondContact O-NZ 3.33Å
609	P	96.3	Very high	94.2	Very high	84 Å²	84	57.9 Å²	57.9	55%	0.545	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-59.7	159.6	164.6	27.3	-36.2	0	0	0	111.5	W593	W593-P609 WeakPolarHBondContact CH2-O 3.36Å
610	P	97	Very high	94.7	Very high	25 Å²	25	53.8 Å²	53.8	16%	0.162	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-60.5	155.9	174.8	25.1	-30	0	0	0	111.2	W577 L612 L631 K633	W577-P610 HydrophobicContact CH2-CB 3.98Å; W577-P610 HydrophobicContact CZ3-CB 4.16Å; P610-L612 HydrophobicContact CB-CG 4.22Å; P610-L612 HydrophobicContact CG-CD1 3.95Å; P610-L612 HydrophobicContact CG-CG 3.97Å; P610-L612 PolarHBondContact O-N 3.33Å; P610-L631 HydrophobicContact CB-CB 4.2Å; P610-L631 WeakPolarHBondContact CB-O 3.36Å; P610-L631 WeakPolarHBondContact CG-O 3.41Å; P610-K633 HydrophobicContact CB-CG 4.11Å; P610-K633 HydrophobicContact CG-CG 4.1Å
611	P	96.9	Very high	95.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	30%	0.301	C	S	.	.	S	Bend	trans	-76.7	38.6	-167.4	30.7	-33.7	0	0	0	113.9	L584 P592 W593 R613 E614 L631	L584-P611 HydrophobicContact CD1-CB 4.25Å; L584-P611 HydrophobicContact CD1-CG 3.95Å; P592-P611 HydrophobicContact CB-CB 4.44Å; P592-P611 HydrophobicContact CB-CG 4.38Å; W593-P611 HydrophobicContact CD2-CB 4.41Å; W593-P611 HydrophobicContact CH2-CB 4.42Å; W593-P611 HydrophobicContact CH2-CG 4.37Å; W593-P611 HydrophobicContact CZ2-CB 4.29Å; W593-P611 HydrophobicContact CZ2-CG 3.88Å; P611-R613 PolarHBondContact O-N 2.95Å; P611-E614 HydrophobicContact CB-CG 4.04Å; P611-E614 VanDerWaalsContact O-CB 3.27Å; P611-E614 WeakPolarHBondContact O-CB 3.48Å; P611-E614 WeakPolarHBondContact O-CG 3.22Å; P611-E614 PolarHBondContact O-N 2.95Å; P611-L631 HydrophobicContact CG-CD1 4.04Å
612	L	97.2	Very high	95.4	Very high	60 Å²	60	56.3 Å²	56.3	31%	0.314	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-63.5	-22.4	-178.5	-53.2	179.4	0	0	0	113.2	P610 E614 I615 K628 L631	P610-L612 HydrophobicContact CB-CG 4.22Å; P610-L612 HydrophobicContact CG-CD1 3.95Å; P610-L612 HydrophobicContact CG-CG 3.97Å; P610-L612 PolarHBondContact O-N 3.33Å; L612-E614 PolarHBondContact O-N 3.28Å; L612-I615 HydrophobicContact CB-CD1 4.37Å; L612-I615 HydrophobicContact CD2-CD1 4.34Å; L612-I615 WeakPolarHBondContact O-CB 3.46Å; L612-I615 WeakPolarHBondContact O-CG1 3.38Å; L612-I615 PolarHBondContact O-N 3.24Å; L612-K628 HydrophobicContact CD1-CG 4.15Å; L612-K628 HydrophobicContact CD2-CB 4.32Å; L612-K628 HydrophobicContact CD2-CG 3.86Å; L612-L631 HydrophobicContact CD2-CB 4.02Å; L612-L631 HydrophobicContact CD2-CD1 4.2Å
613	R	95.9	Very high	95.7	Very high	109 Å²	109	54.4 Å²	54.4	41%	0.411	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-66.1	-17.3	171.7	69.2	-179.4	177.7	-147.5	-6.6	113.4	Y597 P611	Y597-R613 VanDerWaalsContact CZ-NH2 3.31Å; Y597-R613 PolarHBondContact OH-NH1 3.24Å; Y597-R613 PolarHBondContact OH-NH2 2.99Å; P611-R613 PolarHBondContact O-N 2.95Å
614	E	96.9	Very high	96.1	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.028	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-90.7	-6.2	-176.7	-46.5	-168.7	-158.7	0	0	111.4	L584 N588 P592 W593 Y596 P611 L612 R670	L584-E614 HydrophobicContact CD1-CB 4.43Å; L584-E614 HydrophobicContact CD2-CB 4.32Å; N588-E614 PolarHBondContact ND2-O 3.24Å; N588-E614 PolarHBondContact OD1-O 2.79Å; P592-E614 WeakPolarHBondContact CA-OE2 3.35Å; W593-E614 PolarHBondContact N-OE1 3.2Å; W593-E614 PolarHBondContact N-OE2 2.75Å; Y596-E614 HydrophobicContact CD2-CG 4.22Å; Y596-E614 VanDerWaalsContact CD2-OE1 3.31Å; Y596-E614 WeakPolarHBondContact CD2-OE1 3.43Å; Y596-E614 VanDerWaalsContact CE2-CD 3.42Å; Y596-E614 HydrophobicContact CE2-CG 3.52Å; P611-E614 HydrophobicContact CB-CG 4.04Å; P611-E614 VanDerWaalsContact O-CB 3.27Å; P611-E614 WeakPolarHBondContact O-CB 3.48Å; P611-E614 WeakPolarHBondContact O-CG 3.22Å; P611-E614 PolarHBondContact O-N 2.95Å; L612-E614 PolarHBondContact O-N 3.28Å; E614-R670 PolarHBondContact O-NH1 3.24Å
615	I	97.7	Very high	96.3	Very high	18 Å²	18	50 Å²	50	9%	0.092	28%	0.282	C	S	.	.	S	Bend	trans	-60.4	135.2	168.3	-59.6	171.6	0	0	0	108.9	L584 L612 A624 I627 K628 R670	L584-I615 HydrophobicContact CD2-CG1 4.01Å; L612-I615 HydrophobicContact CB-CD1 4.37Å; L612-I615 HydrophobicContact CD2-CD1 4.34Å; L612-I615 WeakPolarHBondContact O-CB 3.46Å; L612-I615 WeakPolarHBondContact O-CG1 3.38Å; L612-I615 PolarHBondContact O-N 3.24Å; I615-A624 HydrophobicContact CG2-CB 4.11Å; I615-I627 HydrophobicContact CD1-CB 4.01Å; I615-I627 HydrophobicContact CD1-CG2 3.8Å; I615-I627 HydrophobicContact CG1-CB 4.24Å; I615-I627 HydrophobicContact CG1-CD1 4.29Å; I615-I627 HydrophobicContact CG1-CG2 3.75Å; I615-I627 HydrophobicContact CG2-CD1 4.46Å; I615-K628 HydrophobicContact CD1-CG 4.37Å; I615-R670 PolarHBondContact O-NH1 2.87Å; I615-R670 VanDerWaalsContact O-NH1 3.08Å
616	P	96.1	Very high	96.5	Very high	15 Å²	15	50.1 Å²	50.1	10%	0.097	28%	0.283	C	S	.	.			trans	-65.5	130.4	171.8	-20.6	31.6	0	0	0	111.9	L587 S618 C619	L587-P616 HydrophobicContact CB-CG 3.88Å; L587-P616 HydrophobicContact CD1-CG 4.28Å; P616-S618 PolarHBondContact O-N 2.94Å; P616-C619 WeakPolarHBondContact O-CB 3.33Å; P616-C619 PolarHBondContact O-N 2.89Å
617	P	94.1	Very high	96.7	Very high	121 Å²	121	48.9 Å²	48.9	79%	0.786	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-11.3	173.4	-24.7	34.8	0	0	0	114.6
618	S	93.4	Very high	97	Very high	103 Å²	103	46.8 Å²	46.8	72%	0.72	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-9.7	175.4	55.6	0	0	0	0	114.1	P616	P616-S618 PolarHBondContact O-N 2.94Å
619	C	96.1	Very high	97.2	Very high	20 Å²	20	47.1 Å²	47.1	14%	0.135	27%	0.266	C	S	.	.	S	Bend	trans	-69.8	150.4	-179.9	-76.9	0	0	0	0	112.4	E486 P616 T623	E486-C619 WeakPolarHBondContact OE1-CA 3.39Å; E486-C619 WeakPolarHBondContact OE1-CB 3.42Å; E486-C619 WeakPolarHBondContact OE2-CA 3.39Å; P616-C619 WeakPolarHBondContact O-CB 3.33Å; P616-C619 PolarHBondContact O-N 2.89Å; C619-T623 HydrophobicContact CB-CG2 4.38Å
620	N	97.6	Very high	97.3	Very high	30 Å²	30	43.1 Å²	43.1	16%	0.16	24%	0.24	C	C	.	.			trans	-57.1	141.1	170.4	-174.4	-64.1	0	0	0	110.6	E486 L622 T623 A624 E654 V655	E486-N620 WeakPolarHBondContact OE1-CB 3.11Å; E486-N620 PolarHBondContact OE1-N 2.95Å; E486-N620 PolarHBondContact OE2-N 2.84Å; N620-L622 PolarHBondContact O-N 3.06Å; N620-L622 VanDerWaalsContact O-N 3.14Å; N620-L622 WeakPolarHBondContact OD1-CB 3.48Å; N620-L622 PolarHBondContact OD1-N 3.35Å; N620-T623 WeakPolarHBondContact O-CB 3.19Å; N620-T623 PolarHBondContact O-N 3.38Å; N620-A624 PolarHBondContact O-N 2.9Å; N620-E654 WeakPolarHBondContact ND2-CG 3.47Å; N620-V655 HydrophobicContact CB-CG1 3.8Å
621	P	98.1	Very high	97.3	Very high	103 Å²	103	42 Å²	42	67%	0.669	23%	0.232	S	C	*	.	H	α-helix	trans	-50.7	-35.8	176.3	-30.1	36.6	0	0	0	114.9	A624 E625	P621-A624 PolarHBondContact O-N 3.39Å; P621-E625 PolarHBondContact O-N 2.98Å
622	L	98.1	Very high	97.4	Very high	56 Å²	56	45.5 Å²	45.5	29%	0.293	25%	0.248	S	C	.	.	H	α-helix	trans	-68.5	-41.4	177.5	-59.6	-179.3	0	0	0	112	N620 A624 E625 I626 V650 A651 E654	N620-L622 PolarHBondContact O-N 3.06Å; N620-L622 VanDerWaalsContact O-N 3.14Å; N620-L622 WeakPolarHBondContact OD1-CB 3.48Å; N620-L622 PolarHBondContact OD1-N 3.35Å; L622-A624 VanDerWaalsContact C-N 3.32Å; L622-A624 PolarHBondContact O-N 3.23Å; L622-E625 WeakPolarHBondContact O-CB 3.38Å; L622-E625 PolarHBondContact O-N 2.92Å; L622-E625 VanDerWaalsContact O-N 3.11Å; L622-I626 WeakPolarHBondContact O-CD1 3.46Å; L622-I626 WeakPolarHBondContact O-CG1 3.28Å; L622-I626 PolarHBondContact O-N 2.87Å; L622-V650 HydrophobicContact CD1-CG1 4.36Å; L622-A651 HydrophobicContact CB-CB 3.77Å; L622-E654 HydrophobicContact CD1-CB 3.86Å; L622-E654 HydrophobicContact CD1-CG 3.92Å
623	T	98.4	Very high	97.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-42.5	172.6	-51.6	0	0	0	0	111.2	E486 L490 M583 C619 N620 E625 I626 I627	E486-T623 HydrophobicContact CG-CG2 4.29Å; E486-T623 WeakPolarHBondContact OE1-CB 3.41Å; E486-T623 WeakPolarHBondContact OE1-CG2 3.49Å; E486-T623 PolarHBondContact OE1-OG1 3.32Å; L490-T623 HydrophobicContact CD2-CG2 4.09Å; L490-T623 HydrophobicContact CG-CG2 4.48Å; M583-T623 HydrophobicContact CE-CG2 3.66Å; C619-T623 HydrophobicContact CB-CG2 4.38Å; N620-T623 WeakPolarHBondContact O-CB 3.19Å; N620-T623 PolarHBondContact O-N 3.38Å; T623-E625 VanDerWaalsContact C-N 3.28Å; T623-E625 PolarHBondContact O-N 3.22Å; T623-I626 PolarHBondContact O-N 2.87Å; T623-I627 HydrophobicContact CG2-CD1 4.15Å; T623-I627 WeakPolarHBondContact O-CG1 3.48Å; T623-I627 PolarHBondContact O-N 3.05Å
624	A	98.4	Very high	97.3	Very high	15 Å²	15	43.7 Å²	43.7	12%	0.124	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-28	175	0	0	0	0	0	112.6	I615 N620 P621 L622 K628	I615-A624 HydrophobicContact CG2-CB 4.11Å; N620-A624 PolarHBondContact O-N 2.9Å; P621-A624 PolarHBondContact O-N 3.39Å; L622-A624 VanDerWaalsContact C-N 3.32Å; L622-A624 PolarHBondContact O-N 3.23Å; A624-K628 WeakPolarHBondContact O-CD 3.33Å; A624-K628 VanDerWaalsContact O-CE 3.25Å; A624-K628 WeakPolarHBondContact O-CE 3.5Å; A624-K628 WeakPolarHBondContact O-CG 3.26Å; A624-K628 PolarHBondContact O-N 2.99Å
625	E	98.2	Very high	97.2	Very high	76 Å²	76	44.1 Å²	44.1	36%	0.355	25%	0.246	S	C	.	.	H	α-helix	trans	-72.5	-46.1	172.5	-164.9	-168.6	131.4	0	0	112	P621 L622 T623 I627 K628 M629 K647	P621-E625 PolarHBondContact O-N 2.98Å; L622-E625 WeakPolarHBondContact O-CB 3.38Å; L622-E625 PolarHBondContact O-N 2.92Å; L622-E625 VanDerWaalsContact O-N 3.11Å; T623-E625 VanDerWaalsContact C-N 3.28Å; T623-E625 PolarHBondContact O-N 3.22Å; E625-I627 VanDerWaalsContact C-N 3.34Å; E625-I627 PolarHBondContact O-N 3.25Å; E625-K628 WeakPolarHBondContact O-CB 3.38Å; E625-K628 PolarHBondContact O-N 3.5Å; E625-K628 VanDerWaalsContact O-N 3.14Å; E625-M629 HydrophobicContact CG-SD 4.34Å; E625-M629 WeakPolarHBondContact O-CG 3.03Å; E625-M629 PolarHBondContact O-N 3.39Å; E625-K647 IonicContact OE1-NZ 2.72Å; E625-K647 PolarHBondContact OE1-NZ 3.44Å
626	I	98.3	Very high	97	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-53	-51.6	174.2	-72.2	157.6	0	0	0	110.5	L490 L493 L622 T623 K628 M629 G630 L644 K647 A651	L490-I626 HydrophobicContact CD2-CD1 4.16Å; L493-I626 HydrophobicContact CD2-CG2 3.99Å; L622-I626 WeakPolarHBondContact O-CD1 3.46Å; L622-I626 WeakPolarHBondContact O-CG1 3.28Å; L622-I626 PolarHBondContact O-N 2.87Å; T623-I626 PolarHBondContact O-N 2.87Å; I626-K628 VanDerWaalsContact C-N 3.28Å; I626-K628 PolarHBondContact O-N 2.8Å; I626-M629 PolarHBondContact O-N 3.02Å; I626-G630 PolarHBondContact O-N 3.47Å; I626-L644 HydrophobicContact CB-CD1 4.26Å; I626-L644 HydrophobicContact CG2-CD1 3.73Å; I626-L644 HydrophobicContact CG2-CG 4.06Å; I626-L644 WeakPolarHBondContact O-CD1 3.47Å; I626-K647 HydrophobicContact CD1-CB 4.32Å; I626-K647 HydrophobicContact CG1-CB 3.85Å; I626-A651 HydrophobicContact CD1-CB 3.43Å; I626-A651 VanDerWaalsContact CD1-CB 3.43Å
627	I	98.7	Very high	97.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-36.1	-178.6	-63.4	165.2	0	0	0	111.2	M583 L584 L587 I615 T623 E625 L631	M583-I627 HydrophobicContact CB-CG1 4.47Å; M583-I627 HydrophobicContact CG-CD1 3.85Å; M583-I627 HydrophobicContact CG-CG1 3.83Å; L584-I627 HydrophobicContact CD2-CG2 4.12Å; L584-I627 HydrophobicContact CG-CG2 4.2Å; L587-I627 HydrophobicContact CD1-CD1 3.75Å; I615-I627 HydrophobicContact CD1-CB 4.01Å; I615-I627 HydrophobicContact CD1-CG2 3.8Å; I615-I627 HydrophobicContact CG1-CB 4.24Å; I615-I627 HydrophobicContact CG1-CD1 4.29Å; I615-I627 HydrophobicContact CG1-CG2 3.75Å; I615-I627 HydrophobicContact CG2-CD1 4.46Å; T623-I627 HydrophobicContact CG2-CD1 4.15Å; T623-I627 WeakPolarHBondContact O-CG1 3.48Å; T623-I627 PolarHBondContact O-N 3.05Å; E625-I627 VanDerWaalsContact C-N 3.34Å; E625-I627 PolarHBondContact O-N 3.25Å; I627-L631 HydrophobicContact CG2-CD1 3.63Å; I627-L631 HydrophobicContact CG2-CG 4.44Å; I627-L631 VanDerWaalsContact O-CB 3.28Å; I627-L631 WeakPolarHBondContact O-CB 3.48Å; I627-L631 VanDerWaalsContact O-CG 3.25Å; I627-L631 WeakPolarHBondContact O-CG 3.42Å; I627-L631 PolarHBondContact O-N 3.38Å; I627-L631 VanDerWaalsContact O-N 3.14Å
628	K	98.6	Very high	97.3	Very high	93 Å²	93	49.8 Å²	49.8	40%	0.404	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-52.3	173.7	-69.2	160.3	-164.6	164.2	0	111.9	L612 I615 A624 E625 I626 G630 L631 E632	L612-K628 HydrophobicContact CD1-CG 4.15Å; L612-K628 HydrophobicContact CD2-CB 4.32Å; L612-K628 HydrophobicContact CD2-CG 3.86Å; I615-K628 HydrophobicContact CD1-CG 4.37Å; A624-K628 WeakPolarHBondContact O-CD 3.33Å; A624-K628 VanDerWaalsContact O-CE 3.25Å; A624-K628 WeakPolarHBondContact O-CE 3.5Å; A624-K628 WeakPolarHBondContact O-CG 3.26Å; A624-K628 PolarHBondContact O-N 2.99Å; E625-K628 WeakPolarHBondContact O-CB 3.38Å; E625-K628 PolarHBondContact O-N 3.5Å; E625-K628 VanDerWaalsContact O-N 3.14Å; I626-K628 VanDerWaalsContact C-N 3.28Å; I626-K628 PolarHBondContact O-N 2.8Å; K628-G630 VanDerWaalsContact C-N 3.26Å; K628-G630 PolarHBondContact O-N 2.95Å; K628-L631 CarbonylContact O-C 3.58Å; K628-L631 PolarHBondContact O-N 2.58Å; K628-E632 PolarHBondContact O-N 3.05Å; K628-E632 VanDerWaalsContact O-N 3.15Å
629	M	98.4	Very high	97.5	Very high	53 Å²	53	45 Å²	45	26%	0.261	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-31.8	-177.6	-72.3	-174.2	63.8	0	0	113.5	E625 I626 R638 A639 L644 K647	E625-M629 HydrophobicContact CG-SD 4.34Å; E625-M629 WeakPolarHBondContact O-CG 3.03Å; E625-M629 PolarHBondContact O-N 3.39Å; I626-M629 PolarHBondContact O-N 3.02Å; M629-R638 WeakPolarHBondContact O-CA 3.38Å; M629-R638 WeakPolarHBondContact O-CG 3.47Å; M629-A639 HydrophobicContact CB-CB 4.21Å; M629-A639 HydrophobicContact CE-CB 4.12Å; M629-A639 PolarHBondContact O-N 3.14Å; M629-L644 HydrophobicContact CB-CD1 4.24Å; M629-K647 HydrophobicContact CE-CD 3.99Å; M629-K647 HydrophobicContact SD-CD 3.53Å; M629-K647 VanDerWaalsContact SD-CD 3.53Å; M629-K647 WeakPolarHBondContact SD-CE 3.47Å
630	G	98.4	Very high	97.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-82.9	-14.8	172.8	0	0	0	0	0	114.7	W577 I626 K628 R638	W577-G630 WeakPolarHBondContact CA-O 3.3Å; I626-G630 PolarHBondContact O-N 3.47Å; K628-G630 VanDerWaalsContact C-N 3.26Å; K628-G630 PolarHBondContact O-N 2.95Å; G630-R638 VanDerWaalsContact O-CD 3.22Å; G630-R638 WeakPolarHBondContact O-CD 3.35Å; G630-R638 WeakPolarHBondContact O-CG 3.4Å
631	L	98.6	Very high	97.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.234	C	C	.	.	S	Bend	trans	-110.6	22.6	177.9	-63.7	175.7	0	0	0	113.4	W577 C580 L584 P610 P611 L612 I627 K628 K633	W577-L631 HydrophobicContact CD2-CD2 3.65Å; W577-L631 HydrophobicContact CE3-CB 4.29Å; W577-L631 HydrophobicContact CE3-CD2 3.79Å; W577-L631 HydrophobicContact CG-CD2 4.08Å; W577-L631 HydrophobicContact CH2-CD2 4.45Å; W577-L631 HydrophobicContact CZ2-CD2 4.33Å; W577-L631 HydrophobicContact CZ3-CB 4.2Å; W577-L631 HydrophobicContact CZ3-CD2 4.2Å; W577-L631 VanDerWaalsContact CZ3-O 3.25Å; W577-L631 WeakPolarHBondContact CZ3-O 3.39Å; C580-L631 HydrophobicContact CB-CD1 4.17Å; C580-L631 HydrophobicContact CB-CD2 3.7Å; C580-L631 HydrophobicContact CB-CG 3.6Å; L584-L631 HydrophobicContact CD1-CD1 3.78Å; P610-L631 HydrophobicContact CB-CB 4.2Å; P610-L631 WeakPolarHBondContact CB-O 3.36Å; P610-L631 WeakPolarHBondContact CG-O 3.41Å; P611-L631 HydrophobicContact CG-CD1 4.04Å; L612-L631 HydrophobicContact CD2-CB 4.02Å; L612-L631 HydrophobicContact CD2-CD1 4.2Å; I627-L631 HydrophobicContact CG2-CD1 3.63Å; I627-L631 HydrophobicContact CG2-CG 4.44Å; I627-L631 VanDerWaalsContact O-CB 3.28Å; I627-L631 WeakPolarHBondContact O-CB 3.48Å; I627-L631 VanDerWaalsContact O-CG 3.25Å; I627-L631 WeakPolarHBondContact O-CG 3.42Å; I627-L631 PolarHBondContact O-N 3.38Å; I627-L631 VanDerWaalsContact O-N 3.14Å; K628-L631 CarbonylContact O-C 3.58Å; K628-L631 PolarHBondContact O-N 2.58Å; L631-K633 PolarHBondContact O-N 3.39Å
632	E	98.3	Very high	97.6	Very high	75 Å²	75	42.1 Å²	42.1	35%	0.35	22%	0.22	S	C	.	.			trans	-64.3	130.6	166.5	-70.3	-60.4	167.3	0	0	110.2	K628 E634 Q637 R638	K628-E632 PolarHBondContact O-N 3.05Å; K628-E632 VanDerWaalsContact O-N 3.15Å; E632-E634 PolarHBondContact O-N 3.24Å; E632-Q637 HydrophobicContact CB-CB 4.31Å; E632-R638 HydrophobicContact CB-CB 4.11Å; E632-R638 HydrophobicContact CB-CG 4.48Å; E632-R638 PolarHBondContact O-NE 3.41Å; E632-R638 PolarHBondContact O-NH2 2.91Å; E632-R638 VanDerWaalsContact O-NH2 3.1Å
633	K	95.6	Very high	97.6	Very high	43 Å²	43	44.5 Å²	44.5	19%	0.187	23%	0.23	C	C	.	.	S	Bend	trans	-70.5	-33.7	-171.7	-75.4	-164.6	55.5	148.8	0	113.4	P562 W577 I605 A606 E608 P610 L631 R638	P562-K633 HydrophobicContact CG-CB 4.2Å; P562-K633 HydrophobicContact CG-CD 4.37Å; P562-K633 HydrophobicContact CG-CG 3.97Å; W577-K633 HydrophobicContact CH2-CG 4.19Å; W577-K633 HydrophobicContact CZ3-CG 4.08Å; I605-K633 PolarHBondContact O-NZ 2.91Å; A606-K633 PolarHBondContact O-NZ 3.39Å; E608-K633 PolarHBondContact O-NZ 3.33Å; P610-K633 HydrophobicContact CB-CG 4.11Å; P610-K633 HydrophobicContact CG-CG 4.1Å; L631-K633 PolarHBondContact O-N 3.39Å; K633-R638 PolarHBondContact O-NH2 3.32Å
634	E	95.1	Very high	97.6	Very high	88 Å²	88	44.5 Å²	44.5	41%	0.411	23%	0.23	S	C	.	.	S	Bend	trans	-90.3	120.9	175.4	-68.5	-58.9	145.5	0	0	110.5	K568 E632 V636 Q637 R638	K568-E634 IonicContact NZ-OE1 2.73Å; K568-E634 PolarHBondContact NZ-OE1 2.56Å; K568-E634 IonicContact NZ-OE2 3.59Å; K568-E634 PolarHBondContact NZ-OE2 3.24Å; K568-E634 VanDerWaalsContact NZ-OE2 3.17Å; E632-E634 PolarHBondContact O-N 3.24Å; E634-V636 HydrophobicContact CB-CG2 4.38Å; E634-V636 PolarHBondContact O-N 2.65Å; E634-Q637 PolarHBondContact O-N 3.48Å; E634-R638 PolarHBondContact O-N 3.14Å
635	P	94.7	Very high	97.6	Very high	15 Å²	15	46.1 Å²	46.1	10%	0.097	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.3	-174.4	-31.7	38.2	0	0	0	115.2	E563 K573 Q637 R638	E563-P635 HydrophobicContact CB-CG 4.04Å; E563-P635 VanDerWaalsContact CD-CG 3.43Å; E563-P635 HydrophobicContact CG-CG 3.77Å; K573-P635 HydrophobicContact CB-CB 4.03Å; K573-P635 HydrophobicContact CG-CB 4.2Å; K573-P635 WeakPolarHBondContact CG-O 3.41Å; K573-P635 PolarHBondContact NZ-O 2.92Å; P635-Q637 VanDerWaalsContact C-N 3.28Å; P635-Q637 PolarHBondContact O-N 3.4Å; P635-R638 PolarHBondContact O-N 2.9Å
636	V	94.8	Very high	97.6	Very high	128 Å²	128	46.3 Å²	46.3	78%	0.776	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-21	178.5	-63.4	0	0	0	0	113.6	E634	E634-V636 HydrophobicContact CB-CG2 4.38Å; E634-V636 PolarHBondContact O-N 2.65Å
637	Q	96.8	Very high	97.6	Very high	140 Å²	140	49.8 Å²	49.8	65%	0.654	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-24.7	175.2	-69.4	174.5	-10.5	0	0	112.5	E632 E634 P635	E632-Q637 HydrophobicContact CB-CB 4.31Å; E634-Q637 PolarHBondContact O-N 3.48Å; P635-Q637 VanDerWaalsContact C-N 3.28Å; P635-Q637 PolarHBondContact O-N 3.4Å
638	R	98.1	Very high	97.6	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.015	26%	0.256	C	S	.	.	S	Bend	trans	-63	140.4	176.1	-160	-177.9	-57.2	148.7	8.1	111.4	E563 K573 M629 G630 E632 K633 E634 P635	E563-R638 IonicContact OE1-CZ 2.75Å; E563-R638 IonicContact OE1-NH1 3.71Å; E563-R638 PolarHBondContact OE1-NH1 3.42Å; E563-R638 IonicContact OE1-NH2 3.42Å; E563-R638 PolarHBondContact OE1-NH2 3.11Å; E563-R638 IonicContact OE2-CZ 3.08Å; E563-R638 IonicContact OE2-NH1 2.65Å; E563-R638 IonicContact OE2-NH2 2.67Å; E563-R638 PolarHBondContact OE2-NH2 3.06Å; K573-R638 VanDerWaalsContact C-NH1 3.32Å; K573-R638 WeakPolarHBondContact CE-O 3.38Å; K573-R638 PolarHBondContact NZ-O 2.9Å; K573-R638 WeakPolarHBondContact O-CD 3.03Å; K573-R638 PolarHBondContact O-NH1 2.93Å; M629-R638 WeakPolarHBondContact O-CA 3.38Å; M629-R638 WeakPolarHBondContact O-CG 3.47Å; G630-R638 VanDerWaalsContact O-CD 3.22Å; G630-R638 WeakPolarHBondContact O-CD 3.35Å; G630-R638 WeakPolarHBondContact O-CG 3.4Å; E632-R638 HydrophobicContact CB-CB 4.11Å; E632-R638 HydrophobicContact CB-CG 4.48Å; E632-R638 PolarHBondContact O-NE 3.41Å; E632-R638 PolarHBondContact O-NH2 2.91Å; E632-R638 VanDerWaalsContact O-NH2 3.1Å; K633-R638 PolarHBondContact O-NH2 3.32Å; E634-R638 PolarHBondContact O-N 3.14Å; P635-R638 PolarHBondContact O-N 2.9Å
639	A	98.2	Very high	97.6	Very high	4 Å²	4	48.7 Å²	48.7	3%	0.033	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-60	154.9	176.4	0	0	0	0	0	112.7	K573 M629 E643 L644	K573-A639 VanDerWaalsContact CD-O 3.3Å; K573-A639 WeakPolarHBondContact CD-O 3.48Å; M629-A639 HydrophobicContact CB-CB 4.21Å; M629-A639 HydrophobicContact CE-CB 4.12Å; M629-A639 PolarHBondContact O-N 3.14Å; A639-E643 HydrophobicContact CB-CB 4.48Å; A639-L644 HydrophobicContact CB-CB 4.3Å; A639-L644 HydrophobicContact CB-CD1 4.22Å
640	S	98.4	Very high	97.6	Very high	37 Å²	37	49.8 Å²	49.8	26%	0.259	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-76.8	162.5	162.4	67.5	0	0	0	0	111.6	S642 E643 L644	S640-S642 PolarHBondContact O-N 3.26Å; S640-E643 VanDerWaalsContact CB-OE2 3.22Å; S640-E643 WeakPolarHBondContact CB-OE2 3.46Å; S640-E643 PolarHBondContact N-OE2 3.18Å; S640-E643 PolarHBondContact O-N 3.29Å; S640-E643 VanDerWaalsContact OG-CD 3.31Å; S640-E643 WeakPolarHBondContact OG-CG 3.46Å; S640-E643 PolarHBondContact OG-N 2.94Å; S640-E643 PolarHBondContact OG-OE2 3.48Å; S640-L644 WeakPolarHBondContact O-CB 3.39Å; S640-L644 PolarHBondContact O-N 3.02Å
641	A	98.1	Very high	97.5	Very high	2 Å²	2	49.8 Å²	49.8	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-57.3	-35.8	174.4	0	0	0	0	0	112.5	L497 L500 E501 V576 K645	L497-A641 HydrophobicContact CD2-CB 4.28Å; L500-A641 HydrophobicContact CB-CB 4.05Å; E501-A641 HydrophobicContact CB-CB 4.37Å; V576-A641 HydrophobicContact CG2-CB 4.33Å; A641-K645 WeakPolarHBondContact O-CB 3.46Å; A641-K645 PolarHBondContact O-N 3.04Å
642	S	98.1	Very high	97.5	Very high	52 Å²	52	51.2 Å²	51.2	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-70.1	-45.2	-178.7	-163.8	0	0	0	0	113.2	E501 S640 T646	E501-S642 WeakPolarHBondContact OE1-CA 3.4Å; E501-S642 WeakPolarHBondContact OE1-CB 3.19Å; E501-S642 PolarHBondContact OE1-OG 3.02Å; S640-S642 PolarHBondContact O-N 3.26Å; S642-T646 WeakPolarHBondContact O-CB 3.48Å; S642-T646 PolarHBondContact O-N 3.33Å; S642-T646 PolarHBondContact O-OG1 2.62Å
643	E	98.3	Very high	97.5	Very high	107 Å²	107	54 Å²	54	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-63.3	-43.6	175	-67.9	160.9	123.5	0	0	110.9	A639 S640 T646 K647	A639-E643 HydrophobicContact CB-CB 4.48Å; S640-E643 VanDerWaalsContact CB-OE2 3.22Å; S640-E643 WeakPolarHBondContact CB-OE2 3.46Å; S640-E643 PolarHBondContact N-OE2 3.18Å; S640-E643 PolarHBondContact O-N 3.29Å; S640-E643 VanDerWaalsContact OG-CD 3.31Å; S640-E643 WeakPolarHBondContact OG-CG 3.46Å; S640-E643 PolarHBondContact OG-N 2.94Å; S640-E643 PolarHBondContact OG-OE2 3.48Å; E643-T646 PolarHBondContact O-N 2.82Å; E643-K647 PolarHBondContact O-N 3.25Å
644	L	98.1	Very high	97.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.9	-38.9	-178.6	-158.2	67.9	0	0	0	111.9	L497 V576 I626 M629 A639 S640 T646 K647 T648	L497-L644 HydrophobicContact CD1-CB 4.07Å; L497-L644 HydrophobicContact CD1-CD2 4.06Å; L497-L644 HydrophobicContact CD1-CG 3.96Å; L497-L644 HydrophobicContact CD2-CB 4.39Å; L497-L644 HydrophobicContact CD2-CD2 4.09Å; V576-L644 HydrophobicContact CG1-CD2 3.64Å; I626-L644 HydrophobicContact CB-CD1 4.26Å; I626-L644 HydrophobicContact CG2-CD1 3.73Å; I626-L644 HydrophobicContact CG2-CG 4.06Å; I626-L644 WeakPolarHBondContact O-CD1 3.47Å; M629-L644 HydrophobicContact CB-CD1 4.24Å; A639-L644 HydrophobicContact CB-CB 4.3Å; A639-L644 HydrophobicContact CB-CD1 4.22Å; S640-L644 WeakPolarHBondContact O-CB 3.39Å; S640-L644 PolarHBondContact O-N 3.02Å; L644-T646 VanDerWaalsContact C-N 3.35Å; L644-K647 PolarHBondContact O-N 3Å; L644-T648 WeakPolarHBondContact O-CB 3.26Å; L644-T648 PolarHBondContact O-N 3.1Å; L644-T648 PolarHBondContact O-OG1 3.16Å
645	K	98.3	Very high	97.6	Very high	49 Å²	49	56 Å²	56	21%	0.213	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-49.6	171	-175.7	-164.9	73.8	-178.3	0	110.5	L497 E498 E501 A641 K647 T648 T649	L497-K645 HydrophobicContact CB-CB 3.91Å; L497-K645 HydrophobicContact CB-CG 4.36Å; E498-K645 HydrophobicContact CB-CD 4.03Å; E498-K645 HydrophobicContact CG-CD 4.41Å; E501-K645 WeakPolarHBondContact OE1-CE 3.43Å; E501-K645 IonicContact OE1-NZ 2.66Å; E501-K645 PolarHBondContact OE1-NZ 3.1Å; E501-K645 IonicContact OE2-NZ 3.76Å; E501-K645 PolarHBondContact OE2-NZ 2.81Å; A641-K645 WeakPolarHBondContact O-CB 3.46Å; A641-K645 PolarHBondContact O-N 3.04Å; K645-K647 PolarHBondContact O-N 3.39Å; K645-T648 WeakPolarHBondContact O-CB 3.39Å; K645-T648 PolarHBondContact O-N 2.82Å; K645-T648 VanDerWaalsContact O-N 3.09Å; K645-T649 PolarHBondContact O-N 2.74Å; K645-T649 PolarHBondContact O-OG1 2.68Å
646	T	98.3	Very high	97.7	Very high	80 Å²	80	58 Å²	58	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-44.7	-178.6	-55.6	0	0	0	0	111.6	S642 E643 L644 T649 V650	S642-T646 WeakPolarHBondContact O-CB 3.48Å; S642-T646 PolarHBondContact O-N 3.33Å; S642-T646 PolarHBondContact O-OG1 2.62Å; E643-T646 PolarHBondContact O-N 2.82Å; L644-T646 VanDerWaalsContact C-N 3.35Å; T646-T649 PolarHBondContact O-N 3.45Å; T646-V650 PolarHBondContact O-N 3.34Å
647	K	98.3	Very high	97.7	Very high	74 Å²	74	52.8 Å²	52.8	32%	0.322	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-38.6	172.9	-77.4	175.1	169.7	-81.5	0	112.6	E625 I626 M629 E643 L644 K645 T649 V650 A651	E625-K647 IonicContact OE1-NZ 2.72Å; E625-K647 PolarHBondContact OE1-NZ 3.44Å; I626-K647 HydrophobicContact CD1-CB 4.32Å; I626-K647 HydrophobicContact CG1-CB 3.85Å; M629-K647 HydrophobicContact CE-CD 3.99Å; M629-K647 HydrophobicContact SD-CD 3.53Å; M629-K647 VanDerWaalsContact SD-CD 3.53Å; M629-K647 WeakPolarHBondContact SD-CE 3.47Å; E643-K647 PolarHBondContact O-N 3.25Å; L644-K647 PolarHBondContact O-N 3Å; K645-K647 PolarHBondContact O-N 3.39Å; K647-T649 VanDerWaalsContact C-N 3.34Å; K647-T649 PolarHBondContact O-N 3.42Å; K647-V650 PolarHBondContact O-N 2.9Å; K647-A651 PolarHBondContact O-N 3.12Å
648	T	98.4	Very high	97.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-38	178.8	-57.3	0	0	0	0	112.2	L490 L493 L644 K645 L652	L490-T648 HydrophobicContact CB-CG2 4.38Å; L490-T648 HydrophobicContact CD2-CG2 3.98Å; L490-T648 VanDerWaalsContact O-CG2 3.24Å; L490-T648 WeakPolarHBondContact O-CG2 3.46Å; L493-T648 HydrophobicContact CB-CG2 4.37Å; L493-T648 HydrophobicContact CD2-CG2 4.26Å; L493-T648 HydrophobicContact CG-CG2 4.32Å; L644-T648 WeakPolarHBondContact O-CB 3.26Å; L644-T648 PolarHBondContact O-N 3.1Å; L644-T648 PolarHBondContact O-OG1 3.16Å; K645-T648 WeakPolarHBondContact O-CB 3.39Å; K645-T648 PolarHBondContact O-N 2.82Å; K645-T648 VanDerWaalsContact O-N 3.09Å; T648-L652 WeakPolarHBondContact O-CB 3.5Å; T648-L652 PolarHBondContact O-N 3.27Å
649	T	97.8	Very high	97.4	Very high	68 Å²	68	54.1 Å²	54.1	42%	0.417	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-48.3	172.1	-54.1	0	0	0	0	111.7	K645 T646 K647 A651 L652 E653	K645-T649 PolarHBondContact O-N 2.74Å; K645-T649 PolarHBondContact O-OG1 2.68Å; T646-T649 PolarHBondContact O-N 3.45Å; K647-T649 VanDerWaalsContact C-N 3.34Å; K647-T649 PolarHBondContact O-N 3.42Å; T649-A651 PolarHBondContact O-N 2.77Å; T649-L652 WeakPolarHBondContact O-CB 3.46Å; T649-L652 PolarHBondContact O-N 3.39Å; T649-L652 VanDerWaalsContact O-N 3.16Å; T649-E653 WeakPolarHBondContact O-CG 3.22Å; T649-E653 PolarHBondContact O-N 3.31Å
650	V	98.1	Very high	97.2	Very high	77 Å²	77	54.9 Å²	54.9	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-40.2	-179.9	178	0	0	0	0	111.8	L622 T646 K647 L652 E653 E654	L622-V650 HydrophobicContact CD1-CG1 4.36Å; T646-V650 PolarHBondContact O-N 3.34Å; K647-V650 PolarHBondContact O-N 2.9Å; V650-L652 VanDerWaalsContact C-N 3.32Å; V650-L652 PolarHBondContact O-N 3.5Å; V650-E653 PolarHBondContact O-N 2.99Å; V650-E654 PolarHBondContact O-N 3.43Å
651	A	98.1	Very high	96.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-35.6	174.3	0	0	0	0	0	112.4	L490 L622 I626 K647 T649 E654 V655	L490-A651 HydrophobicContact CD1-CB 4.21Å; L490-A651 HydrophobicContact CD2-CB 4Å; L622-A651 HydrophobicContact CB-CB 3.77Å; I626-A651 HydrophobicContact CD1-CB 3.43Å; I626-A651 VanDerWaalsContact CD1-CB 3.43Å; K647-A651 PolarHBondContact O-N 3.12Å; T649-A651 PolarHBondContact O-N 2.77Å; A651-E654 PolarHBondContact O-N 2.67Å; A651-V655 PolarHBondContact O-N 3.27Å; A651-V655 VanDerWaalsContact O-N 3.13Å
652	L	98.1	Very high	96.5	Very high	30 Å²	30	59.3 Å²	59.3	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-38.1	175.2	-178.9	57.7	0	0	0	111.9	D487 L490 T648 T649 V650 V655 G657 V658	D487-L652 HydrophobicContact CB-CD1 4.24Å; D487-L652 WeakPolarHBondContact O-CD1 3.31Å; L490-L652 HydrophobicContact CB-CB 4.25Å; L490-L652 HydrophobicContact CB-CD1 4.12Å; T648-L652 WeakPolarHBondContact O-CB 3.5Å; T648-L652 PolarHBondContact O-N 3.27Å; T649-L652 WeakPolarHBondContact O-CB 3.46Å; T649-L652 PolarHBondContact O-N 3.39Å; T649-L652 VanDerWaalsContact O-N 3.16Å; V650-L652 VanDerWaalsContact C-N 3.32Å; V650-L652 PolarHBondContact O-N 3.5Å; L652-V655 HydrophobicContact CD1-CG2 4.25Å; L652-V655 WeakPolarHBondContact O-CG2 3.41Å; L652-G657 WeakPolarHBondContact O-CA 3.3Å; L652-G657 PolarHBondContact O-N 3.11Å; L652-V658 HydrophobicContact CD1-CG2 3.96Å; L652-V658 HydrophobicContact CD2-CG2 4.09Å; L652-V658 HydrophobicContact CG-CG2 4.5Å
653	E	97.5	Very high	95.9	Very high	134 Å²	134	62 Å²	62	63%	0.626	35%	0.346	S	S	*	.	H	α-helix	trans	-65.2	-44.3	173	-70.9	171.9	-179.1	0	0	111.5	T649 V650 V655 G656	T649-E653 WeakPolarHBondContact O-CG 3.22Å; T649-E653 PolarHBondContact O-N 3.31Å; V650-E653 PolarHBondContact O-N 2.99Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 2.74Å; E653-G656 WeakPolarHBondContact O-CA 3.34Å; E653-G656 PolarHBondContact O-N 2.83Å
654	E	97	Very high	94.6	Very high	130 Å²	130	58.9 Å²	58.9	61%	0.607	34%	0.342	S	S	*	.	H	α-helix	trans	-64.1	-31.8	179.6	-174.3	68.2	-167.8	0	0	113.4	N620 L622 V650 A651 G656	N620-E654 WeakPolarHBondContact ND2-CG 3.47Å; L622-E654 HydrophobicContact CD1-CB 3.86Å; L622-E654 HydrophobicContact CD1-CG 3.92Å; V650-E654 PolarHBondContact O-N 3.43Å; A651-E654 PolarHBondContact O-N 2.67Å; E654-G656 PolarHBondContact O-N 2.62Å
655	V	96.5	Very high	93.8	Very high	42 Å²	42	67.5 Å²	67.5	26%	0.255	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	7.6	172.2	-57.8	0	0	0	0	113.9	E486 D487 L490 N620 A651 L652 E653	E486-V655 HydrophobicContact CG-CG1 4.43Å; D487-V655 HydrophobicContact CB-CG2 4.12Å; L490-V655 HydrophobicContact CD1-CG1 4.31Å; L490-V655 HydrophobicContact CD1-CG2 3.91Å; N620-V655 HydrophobicContact CB-CG1 3.8Å; A651-V655 PolarHBondContact O-N 3.27Å; A651-V655 VanDerWaalsContact O-N 3.13Å; L652-V655 HydrophobicContact CD1-CG2 4.25Å; L652-V655 WeakPolarHBondContact O-CG2 3.41Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 2.74Å
656	G	95.4	Very high	93.3	Very high	57 Å²	57	72.1 Å²	72.1	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	13.9	177.8	0	0	0	0	0	114.9	E653 E654	E653-G656 WeakPolarHBondContact O-CA 3.34Å; E653-G656 PolarHBondContact O-N 2.83Å; E654-G656 PolarHBondContact O-N 2.62Å
657	G	95.8	Very high	92.7	Very high	20 Å²	20	74.3 Å²	74.3	21%	0.206	40%	0.399	C	S	.	.	S	Bend	trans	76.2	-175.9	-176.4	0	0	0	0	0	113.8	D487 L652 T659	D487-G657 WeakPolarHBondContact CB-O 3.45Å; L652-G657 WeakPolarHBondContact O-CA 3.3Å; L652-G657 PolarHBondContact O-N 3.11Å; G657-T659 PolarHBondContact O-N 3.23Å; G657-T659 VanDerWaalsContact O-N 3.17Å
658	V	95.4	Very high	92	Very high	64 Å²	64	78 Å²	78	39%	0.388	42%	0.417	S	S	.	.	S	Bend	trans	-72.9	108.7	178.1	-175.1	0	0	0	0	109.6	D487 L652	D487-V658 WeakPolarHBondContact OD2-CA 3.3Å; L652-V658 HydrophobicContact CD1-CG2 3.96Å; L652-V658 HydrophobicContact CD2-CG2 4.09Å; L652-V658 HydrophobicContact CG-CG2 4.5Å
659	T	94	Very high	91.4	Very high	107 Å²	107	79.1 Å²	79.1	66%	0.656	42%	0.424	S	S	*	.			trans	-126.3	-27.7	-175.3	52.7	0	0	0	0	112.5	D487 G657	D487-T659 PolarHBondContact OD2-N 3.11Å; G657-T659 PolarHBondContact O-N 3.23Å; G657-T659 VanDerWaalsContact O-N 3.17Å
660	S	93.6	Very high	90.4	Very high	20 Å²	20	80 Å²	80	14%	0.14	42%	0.42	C	S	.	.	S	Bend	trans	-67.8	145.6	175.2	-61.9	0	0	0	0	111.5	P485 D487 R488	P485-S660 WeakPolarHBondContact CB-OG 3.2Å; P485-S660 VanDerWaalsContact CG-CB 3.44Å; P485-S660 VanDerWaalsContact CG-OG 3.3Å; P485-S660 WeakPolarHBondContact CG-OG 3.12Å; D487-S660 VanDerWaalsContact OD1-CB 3.27Å; D487-S660 WeakPolarHBondContact OD1-CB 3.5Å; D487-S660 PolarHBondContact OD1-OG 2.89Å; D487-S660 WeakPolarHBondContact OD2-CB 3.48Å; D487-S660 PolarHBondContact OD2-N 2.73Å; D487-S660 PolarHBondContact OD2-OG 2.72Å; R488-S660 VanDerWaalsContact CZ-O 3.28Å; R488-S660 PolarHBondContact NE-O 2.95Å; R488-S660 PolarHBondContact NH2-O 3.49Å
661	P	92.5	Very high	88.8	Confident	88 Å²	88	82.9 Å²	82.9	57%	0.571	43%	0.428	S	S	*	.			trans	-62.8	145.3	166.9	29.2	-35.2	0	0	0	110.4
662	W	88.6	Confident	86.8	Confident	44 Å²	44	86.5 Å²	86.5	17%	0.167	45%	0.447	C	S	.	.	S	Bend	trans	-74.7	-34.8	-176.4	80	-83.9	0	0	0	112.9	L477 L520 D522 D523 G524	L477-W662 HydrophobicContact CD1-CE3 4.38Å; L477-W662 HydrophobicContact CD2-CE3 4.3Å; L520-W662 HydrophobicContact CD1-CZ3 4.43Å; D522-W662 WeakPolarHBondContact O-CH2 3.35Å; D522-W662 WeakPolarHBondContact O-CZ2 3.1Å; D523-W662 PolarHBondContact O-NE1 3.48Å; G524-W662 VanDerWaalsContact CA-CE3 3.49Å
663	K	85	Confident	84.1	Confident	110 Å²	110	89.4 Å²	89.4	48%	0.478	48%	0.475	S	S	.	.	S	Bend	trans	-106.3	101.9	161.6	-78.7	170.4	175.8	159	0	106.8	L477	L477-K663 HydrophobicContact CD1-CG 4.01Å
664	G	71.8	Confident	81.2	Confident	41 Å²	41	90.2 Å²	90.2	42%	0.423	48%	0.483	S	S	.	.			trans	-106.8	-171	-176.5	0	0	0	0	0	113.4
665	E	80.6	Confident	78.2	Confident	181 Å²	181	90.5 Å²	90.5	85%	0.846	49%	0.489	S	S	*	.	S	Bend	trans	-64.3	146.7	164.4	-63	-176.1	150.2	0	0	110.5	R667	E665-R667 PolarHBondContact O-N 3.43Å
666	Y	88.4	Confident	75.1	Confident	146 Å²	146	98 Å²	98	57%	0.573	52%	0.518	S	S	*	.			trans	-62.4	127.3	177	178.7	-90.1	0	0	0	111	P669	Y666-P669 WeakPolarHBondContact OH-CD 3.47Å
667	R	85.4	Confident	72.3	Confident	126 Å²	126	103.2 Å²	103.2	48%	0.475	53%	0.527	S	S	.	.			trans	-106.8	125.3	175	-63.9	-177	175.3	-144.4	-1.2	108.7	S481 G482 C483 E665 P669	S481-R667 PolarHBondContact O-N 3.25Å; G482-R667 CarbonylContact C-O 3.52Å; G482-R667 VanDerWaalsContact CA-O 3.26Å; G482-R667 WeakPolarHBondContact CA-O 3.47Å; C483-R667 PolarHBondContact N-O 2.83Å; C483-R667 VanDerWaalsContact SG-CB 3.53Å; E665-R667 PolarHBondContact O-N 3.43Å; R667-P669 WeakPolarHBondContact O-CD 3.12Å
668	E	84.9	Confident	69.6	Low	152 Å²	152	109.8 Å²	109.8	71%	0.71	56%	0.558	S	S	*	*			trans	-61.2	124.4	-176	-167.4	167.5	-157.4	0	0	111.1
669	P	84.7	Confident	66.6	Low	25 Å²	25	112.4 Å²	112.4	16%	0.162	58%	0.578	C	S	.	*			trans	-53.5	145.4	174.1	-27.3	34.9	0	0	0	111.3	N588 Y666 R667 H671	N588-P669 WeakPolarHBondContact O-CA 3.34Å; Y666-P669 WeakPolarHBondContact OH-CD 3.47Å; R667-P669 WeakPolarHBondContact O-CD 3.12Å; P669-H671 PolarHBondContact O-CD2 3.04Å; P669-H671 VanDerWaalsContact O-CD2 3.25Å; P669-H671 PolarHBondContact O-N 2.81Å
670	R	76.6	Confident	63.9	Low	85 Å²	85	116.1 Å²	116.1	32%	0.321	59%	0.589	S	S	.	*			trans	-73	88	-172.5	-171.8	-172.6	-178.2	-172	-3.9	110.8	N588 Q595 E614 I615	N588-R670 HydrophobicContact CB-CB 4.26Å; N588-R670 PolarHBondContact O-N 3.2Å; N588-R670 WeakPolarHBondContact OD1-CD 3.49Å; N588-R670 PolarHBondContact OD1-NH1 2.9Å; N588-R670 VanDerWaalsContact OD1-NH1 3.16Å; Q595-R670 PolarHBondContact NE2-O 2.95Å; Q595-R670 PolarHBondContact OE1-O 3.35Å; E614-R670 PolarHBondContact O-NH1 3.24Å; I615-R670 PolarHBondContact O-NH1 2.87Å; I615-R670 VanDerWaalsContact O-NH1 3.08Å
671	H	65.8	Low	61	Low	139 Å²	139	123.8 Å²	123.8	64%	0.644	62%	0.622	S	S	*	*			trans	-68.2	144.1	173.4	-72.3	-76.1	0	0	0	111.7	P669 A673	P669-H671 PolarHBondContact O-CD2 3.04Å; P669-H671 VanDerWaalsContact O-CD2 3.25Å; P669-H671 PolarHBondContact O-N 2.81Å; H671-A673 PolarHBondContact O-N 2.76Å; H671-A673 VanDerWaalsContact O-N 3.17Å
672	L	54.9	Low	58.3	Low	76 Å²	76	126.4 Å²	126.4	40%	0.398	64%	0.637	S	S	.	*			trans	-62.5	118.5	170.4	-77.4	-179.4	0	0	0	110.4	Q595 Y596 L674	Q595-L672 HydrophobicContact CB-CD1 3.84Å; Q595-L672 HydrophobicContact CB-CG 3.96Å; Q595-L672 WeakPolarHBondContact O-CD1 3.5Å; Y596-L672 HydrophobicContact CD1-CD1 4.48Å; Y596-L672 HydrophobicContact CE1-CD1 4.5Å; Y596-L672 HydrophobicContact CE1-CD2 3.81Å; Y596-L672 HydrophobicContact CE2-CD2 4.41Å; L672-L674 PolarHBondContact O-N 2.75Å
673	A	42.5	Very low	55.6	Low	90 Å²	90	129.1 Å²	129.1	74%	0.744	66%	0.663	S	S	*	*			trans	-68.8	76.5	162	0	0	0	0	0	109.4	H671 N675	H671-A673 PolarHBondContact O-N 2.76Å; H671-A673 VanDerWaalsContact O-N 3.17Å; A673-N675 PolarHBondContact O-N 2.9Å; A673-N675 VanDerWaalsContact O-N 3.07Å; A673-N675 PolarHBondContact O-OD1 3.41Å
674	L	34.8	Very low	53.1	Low	151 Å²	151	131.7 Å²	131.7	79%	0.791	68%	0.681	S	S	*	*			trans	-60.8	109.5	170.1	-128.3	168.6	0	0	0	107.5	L672 K676	L672-L674 PolarHBondContact O-N 2.75Å; L674-K676 PolarHBondContact O-N 3.14Å
675	N	34.1	Very low	51.2	Low	137 Å²	137	135 Å²	135	73%	0.733	69%	0.694	S	S	*	*			trans	-52.7	101.3	-167.1	-80.5	-6.2	0	0	0	112.8	A673 E677	A673-N675 PolarHBondContact O-N 2.9Å; A673-N675 VanDerWaalsContact O-N 3.07Å; A673-N675 PolarHBondContact O-OD1 3.41Å; N675-E677 PolarHBondContact O-N 2.9Å
676	K	33	Very low	49	Very low	199 Å²	199	132.2 Å²	132.2	87%	0.865	69%	0.692	S	S	*	*			trans	-80.3	18.2	166.7	-77.7	-174.7	175.7	175.4	0	113	L674 N678	L674-K676 PolarHBondContact O-N 3.14Å; K676-N678 PolarHBondContact O-N 3.19Å
677	E	35.9	Very low	46	Very low	166 Å²	166	132 Å²	132	78%	0.776	71%	0.707	S	S	*	*			trans	-76.9	58	167.8	-63.7	-158.4	143.2	0	0	111.8	N675	N675-E677 PolarHBondContact O-N 2.9Å
678	N	39.5	Very low	43.4	Very low	159 Å²	159	132.2 Å²	132.2	85%	0.85	72%	0.721	S	S	*	*	S	Bend	trans	-174.9	70.1	151	-99	-45.4	0	0	0	111.5	K676	K676-N678 PolarHBondContact O-N 3.19Å
679	S	32.1	Very low	40.6	Very low	118 Å²	118	130.3 Å²	130.3	83%	0.825	73%	0.725	S	S	*	*	S	Bend	trans	-150.6	128.4	156.4	-80.6	0	0	0	0	109.2
680	Q	37	Very low	38.3	Very low	186 Å²	186	134.9 Å²	134.9	87%	0.869	76%	0.755	S	S	*	*			trans	-73.4	136.1	-165.6	-62.3	165.8	-12.1	0	0	112.7
681	Q	32.5	Very low	36	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	78%	0.78	S	S	*	*			trans	-134.9	92.1	149.7	-80	-162.3	-6.9	0	0	111.3	S683	Q681-S683 PolarHBondContact O-N 3.09Å
682	T	35.3	Very low	34.3	Very low	143 Å²	143	136.2 Å²	136.2	88%	0.877	79%	0.786	S	S	*	*			trans	-71.1	106.1	155	24.1	0	0	0	0	109.3
683	S	32.4	Very low	33	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	81%	0.81	S	S	*	*			trans	-141.5	155.1	165.9	63.9	0	0	0	0	110.8	Q681	Q681-S683 PolarHBondContact O-N 3.09Å
684	L	32.1	Very low	32.3	Very low	164 Å²	164	144.5 Å²	144.5	86%	0.859	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.6	155.2	-165.5	-73.4	158.8	0	0	0	112.2
685	P	32.1	Very low	32	Very low	109 Å²	109	141.2 Å²	141.2	71%	0.708	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-65.2	143.5	-179.6	27.5	-35.6	0	0	0	112
686	P	34.9	Very low	31.8	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.1	133.1	-177.7	29.9	-34.5	0	0	0	112.7
687	T	26.4	Very low	31.7	Very low	142 Å²	142	138.9 Å²	138.9	87%	0.871	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69.4	137.2	172.9	-50.5	0	0	0	0	111.5
688	V	29.5	Very low	31.4	Very low	130 Å²	130	134.8 Å²	134.8	79%	0.788	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.2	130.8	178	-178.2	0	0	0	0	111.5
689	S	26.1	Very low	30.9	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	83%	0.83	S	S	*	*			trans	167.2	155.2	146.4	-81	0	0	0	0	112
690	P	36.2	Very low	30.7	Very low	122 Å²	122	139.3 Å²	139.3	79%	0.792	83%	0.834	S	S	*	*			cis	-124.8	168.2	-27.5	38.5	-24.8	0	0	0	112.5
691	V	28.2	Very low	30.2	Very low	141 Å²	141	134.8 Å²	134.8	86%	0.855	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-93.9	140.7	167.2	177.2	0	0	0	0	109.2
692	S	30.2	Very low	30.1	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-87.3	142	176.6	53.4	0	0	0	0	112.5
693	E	28.3	Very low	29.6	Very low	191 Å²	191	135.3 Å²	135.3	89%	0.893	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-77.6	137.7	-174.1	-55.8	172.3	134.9	0	0	114.1
694	T	28.4	Very low	29.5	Very low	149 Å²	149	137.2 Å²	137.2	91%	0.914	83%	0.834	S	S	*	*			trans	-136.1	130.1	137.5	48.4	0	0	0	0	107
695	G	27.9	Very low	29.2	Very low	82 Å²	82	133.5 Å²	133.5	85%	0.845	82%	0.822	S	S	*	*			trans	-122.8	177.7	-162.6	0	0	0	0	0	115.6
696	S	30.1	Very low	29	Very low	122 Å²	122	134.4 Å²	134.4	85%	0.853	83%	0.83	S	S	*	*			trans	-156.4	144.7	160.4	-177.7	0	0	0	0	109.3
697	D	30.1	Very low	28.6	Very low	165 Å²	165	132.8 Å²	132.8	88%	0.882	83%	0.826	S	S	*	*			trans	-70.2	158.2	-178.8	-64.1	-88.1	0	0	0	114.3
698	G	30	Very low	28.6	Very low	79 Å²	79	131.5 Å²	131.5	81%	0.814	82%	0.823	S	S	*	*			trans	169.2	88.6	167.6	0	0	0	0	0	115.5
699	K	28.4	Very low	29.6	Very low	202 Å²	202	130.2 Å²	130.2	88%	0.878	82%	0.818	S	S	*	*			trans	-72.4	135.1	172.5	-60.7	168.5	-177.3	167.6	0	111.3
700	L	28.8	Very low	29.6	Very low	171 Å²	171	134.1 Å²	134.1	90%	0.895	82%	0.821	S	S	*	*				-165	165.5	110	-129.1	73.6	0	0	0	111.4
701	A	26.6	Very low	29.2	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	82%	0.822	S	S	*	*			trans	-130	142.1	-178.8	0	0	0	0	0	111.7
702	V	29.8	Very low	30	Very low	147 Å²	147	134.6 Å²	134.6	89%	0.891	82%	0.818	S	S	*	*			trans	-131.1	140	153.3	178.3	0	0	0	0	107.6
703	K	25.6	Very low	31.1	Very low	187 Å²	187	134.5 Å²	134.5	81%	0.813	82%	0.815	S	S	*	*			trans	-134.7	116.2	-173.5	171.1	-169.9	175.7	-175.6	0	108
704	V	30.2	Very low	32.2	Very low	142 Å²	142	130.7 Å²	130.7	86%	0.861	81%	0.806	S	S	*	*			trans	-130.1	132.2	163.4	-177.2	0	0	0	0	108
705	S	24.7	Very low	32	Very low	87 Å²	87	128.3 Å²	128.3	61%	0.608	80%	0.796	S	S	*	*			trans	-129.7	144	-177.5	54.7	0	0	0	0	109.3
706	C	27.8	Very low	32	Very low	128 Å²	128	131.7 Å²	131.7	87%	0.865	79%	0.794	S	S	*	*			trans	173.1	150.8	135.3	-93.7	0	0	0	0	107.2
707	A	28.1	Very low	31.9	Very low	89 Å²	89	132.6 Å²	132.6	74%	0.736	78%	0.784	S	S	*	*			cis	151.9	143.4	-10.1	0	0	0	0	0	104.4
708	S	26.7	Very low	31.7	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	78%	0.775	S	S	*	*			trans	-84.6	-151.7	-170.5	-37.2	0	0	0	0	111.1
709	P	48.6	Very low	31.5	Very low	103 Å²	103	135 Å²	135	67%	0.669	77%	0.769	S	S	*	*			cis	-141.9	-167.6	-8.8	18.3	11.1	0	0	0	115.7
710	F	26.8	Very low	31.4	Very low	192 Å²	192	133.9 Å²	133.9	84%	0.842	77%	0.767	S	S	*	*			trans	108.2	163.6	149.8	-73.5	-66.1	0	0	0	122.1
711	L	28.2	Very low	31.3	Very low	155 Å²	155	134 Å²	134	81%	0.812	76%	0.763	S	S	*	*			trans	-149.1	178.9	-157.3	-69.9	156.2	0	0	0	108
712	P	45	Very low	31.4	Very low	119 Å²	119	135.2 Å²	135.2	77%	0.773	76%	0.761	S	S	*	*			cis	-123.3	-107.9	-27.2	23.1	2.8	0	0	0	115.6
713	P	53.4	Low	31.3	Very low	109 Å²	109	137.4 Å²	137.4	71%	0.708	76%	0.761	S	S	*	*			trans	-122.9	-152	-138.8	42.7	-19.9	0	0	0	113.6
714	P	50.2	Low	31.2	Very low	110 Å²	110	131.7 Å²	131.7	71%	0.714	76%	0.756	S	S	*	*			cis	-144.3	-161.6	-2.2	41.4	-17.5	0	0	0	117.9
715	S	24.8	Very low	32.4	Very low	99 Å²	99	130.9 Å²	130.9	69%	0.692	75%	0.753	S	S	*	*			trans	82.4	114.2	142.8	54.7	0	0	0	0	126
716	L	27.4	Very low	33.8	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	76%	0.757	S	S	*	*				59.6	137.6	128.9	-96.1	71.7	0	0	0	126.7
717	E	28.4	Very low	33.8	Very low	140 Å²	140	135.3 Å²	135.3	65%	0.654	75%	0.752	S	S	*	*			trans	72.6	149.9	143.4	-74.4	-155.5	150	0	0	121.9
718	R	25.8	Very low	33.8	Very low	185 Å²	185	137.4 Å²	137.4	70%	0.698	75%	0.751	S	S	*	*			cis	-167.2	170.6	-12.9	-172.2	-166.6	-74.4	-176	1.9	110.6
719	T	25.3	Very low	33.7	Very low	111 Å²	111	138.7 Å²	138.7	68%	0.681	75%	0.748	S	S	*	*			trans	83.7	148.3	156.7	4.7	0	0	0	0	115.7
720	E	26.8	Very low	32.7	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	75%	0.75	S	S	*	*			cis	-136.9	148.2	23.2	-68.7	179.6	159.7	0	0	110.6
721	E	27.9	Very low	32.8	Very low	173 Å²	173	137 Å²	137	81%	0.808	74%	0.742	S	S	*	*				64.9	142.1	77.8	-68.2	-160.2	-163.5	0	0	115.8
722	V	28.8	Very low	32.8	Very low	116 Å²	116	136.4 Å²	136.4	70%	0.703	74%	0.735	S	S	*	*			cis	-165.8	179	-3.4	116.1	0	0	0	0	112.2
723	E	26.4	Very low	32.1	Very low	194 Å²	194	137.3 Å²	137.3	91%	0.907	73%	0.733	S	S	*	*			trans	102.2	150.8	163.7	-61.5	-136.6	142.3	0	0	123.9
724	G	24.1	Very low	30.8	Very low	67 Å²	67	137.5 Å²	137.5	69%	0.691	74%	0.736	S	S	*	*			trans	154.4	-177.1	-179.5	0	0	0	0	0	108.7
725	P	54.6	Low	29.7	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	74%	0.735	S	S	*	*			cis	-115.2	-124.6	-23.4	39.5	-19.5	0	0	0	108.5
726	P	54.9	Low	29.8	Very low	106 Å²	106	138 Å²	138	69%	0.688	74%	0.739	S	S	*	*			cis	-110.3	-141.3	-33.3	25.9	-1.7	0	0	0	111.8
727	W	27.8	Very low	29.8	Very low	203 Å²	203	142.1 Å²	142.1	77%	0.769	75%	0.745	S	S	*	*			cis	-166.2	147.8	15.1	50.4	-82.8	0	0	0	116
728	N	27.4	Very low	29.7	Very low	133 Å²	133	143.1 Å²	143.1	71%	0.711	75%	0.754	S	S	*	*			trans	37.1	152.1	134.4	-50.9	-24.4	0	0	0	122.7
729	L	25.7	Very low	31.3	Very low	142 Å²	142	139.4 Å²	139.4	74%	0.743	75%	0.754	S	S	*	*			cis	-173.4	129.5	48	-173.8	69.5	0	0	0	116.2
730	C	27.9	Very low	32.1	Very low	107 Å²	107	139.8 Å²	139.8	72%	0.723	76%	0.759	S	S	*	*			trans	63.1	166.9	151	-67.1	0	0	0	0	121.5
731	K	27.7	Very low	33.1	Very low	153 Å²	153	137.4 Å²	137.4	67%	0.665	76%	0.758	S	S	*	*			cis	-159.1	138.3	17.5	-148.5	159.7	-178.6	-79.8	0	115.7
732	E	28.5	Very low	33.1	Very low	143 Å²	143	137.3 Å²	137.3	67%	0.668	76%	0.762	S	S	*	*			trans	63.3	155.4	148.3	-73.3	168.4	177.1	0	0	121.7
733	L	29.5	Very low	32.9	Very low	138 Å²	138	137.4 Å²	137.4	72%	0.723	77%	0.768	S	S	*	*			cis	-158	144.8	3.5	-127.9	166.3	0	0	0	114
734	S	27.5	Very low	32.9	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	76%	0.758	S	S	*	*			trans	53.7	142.2	152.6	56.6	0	0	0	0	123.1
735	G	27.2	Very low	33	Very low	67 Å²	67	137.8 Å²	137.8	69%	0.691	77%	0.768	S	S	*	*			cis	156.9	172.5	-8.8	0	0	0	0	0	115.2
736	I	27.2	Very low	31.8	Very low	152 Å²	152	136.2 Å²	136.2	78%	0.779	77%	0.765	S	S	*	*			trans	78.2	129.6	166.4	-57.2	171.4	0	0	0	116.3
737	W	26.4	Very low	30.9	Very low	242 Å²	242	137.2 Å²	137.2	92%	0.917	77%	0.772	S	S	*	*			cis	-159	171.9	-13.3	-105.2	-5.9	0	0	0	111.1
738	D	25.8	Very low	31.1	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	78%	0.776	S	S	*	*			trans	-113.6	170.2	-162.9	-98.7	-47.6	0	0	0	116.8
739	P	60.3	Low	32	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	78%	0.777	S	S	*	*			trans	-96.9	175.6	-176.1	40.2	-37.8	0	0	0	115.2
740	P	42.4	Very low	31.9	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	78%	0.778	S	S	*	*			trans	-149.8	-173.6	138.3	40.9	-24.9	0	0	0	113.6
741	P	46.7	Very low	32	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	78%	0.783	S	S	*	*			cis	-128	-176.4	-8.2	18.8	7.3	0	0	0	115.8
742	L	28.1	Very low	31.7	Very low	170 Å²	170	136.4 Å²	136.4	89%	0.89	79%	0.787	S	S	*	*			trans	-97.9	160.3	-174.4	-62.5	149.7	0	0	0	114.9
743	S	25.5	Very low	31.4	Very low	118 Å²	118	135 Å²	135	83%	0.825	79%	0.792	S	S	*	*			trans	166.3	153.7	135.5	43.6	0	0	0	0	111.9
744	S	25.5	Very low	31.3	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	79%	0.793	S	S	*	*			cis	-168.4	172.5	-22.7	57.5	0	0	0	0	110.7
745	L	27.2	Very low	31.1	Very low	170 Å²	170	137.3 Å²	137.3	89%	0.89	80%	0.798	S	S	*	*			trans	83	127.1	163.2	-60.4	166.4	0	0	0	121.1
746	A	29.2	Very low	31.4	Very low	91 Å²	91	139.9 Å²	139.9	75%	0.752	80%	0.8	S	S	*	*			trans	-128.9	155.8	144.6	0	0	0	0	0	106
747	P	36.5	Very low	31.5	Very low	127 Å²	127	141.8 Å²	141.8	83%	0.825	81%	0.806	S	S	*	*				-146.9	-174	64.6	38.4	-16.9	0	0	0	116.3
748	L	30.2	Very low	31.5	Very low	165 Å²	165	141 Å²	141	86%	0.864	80%	0.802	S	S	*	*			trans	-83.3	-177.5	175.7	-55	168.3	0	0	0	111.5
749	P	48	Very low	31.7	Very low	111 Å²	111	138 Å²	138	72%	0.721	80%	0.8	S	S	*	*			cis	-139.9	-170.9	1.9	37.8	-15.7	0	0	0	116.9
750	L	23.6	Very low	30.5	Very low	146 Å²	146	138.6 Å²	138.6	76%	0.764	80%	0.802	S	S	*	*			trans	113.6	112.2	152.9	-70.1	156.5	0	0	0	120.6
751	K	28.1	Very low	30.3	Very low	191 Å²	191	139.4 Å²	139.4	83%	0.83	81%	0.805	S	S	*	*			trans	24.1	131.5	135	-63.4	179.4	-179.2	180	0	118.2
752	S	22.8	Very low	30.3	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	79%	0.791	S	S	*	*			cis	-178	171.5	33.8	45.8	0	0	0	0	113.8
753	C	21.3	Very low	31.5	Very low	113 Å²	113	132.6 Å²	132.6	76%	0.764	77%	0.765	S	S	*	*			trans	71.5	100.2	156.3	-66.5	0	0	0	0	120.8
754	S	27.2	Very low	32.6	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	76%	0.761	S	S	*	*			trans	52.6	111.8	131	63.3	0	0	0	0	120.6
755	H	24.4	Very low	33.4	Very low	191 Å²	191	137 Å²	137	88%	0.884	76%	0.761	S	S	*	*				-144.9	159.2	117.3	-132.2	-92.4	0	0	0	113.2
756	V	32.6	Very low	34.4	Very low	121 Å²	121	133.9 Å²	133.9	73%	0.733	74%	0.742	S	S	*	*			trans	-71.3	133.6	179.7	173.8	0	0	0	0	111.1
757	E	28.7	Very low	35.8	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	73%	0.733	S	S	*	*			trans	-135.4	153.3	157.5	-134.4	165	-147.2	0	0	110.8
758	R	27.9	Very low	36.1	Very low	225 Å²	225	133.4 Å²	133.4	85%	0.849	72%	0.716	S	S	*	*			trans	-94.4	118.3	-164.4	-62.7	-178.3	-177.8	95.8	-2.1	111.3	T760	R758-T760 PolarHBondContact O-N 3.01Å
759	A	30.2	Very low	37.1	Very low	97 Å²	97	130.7 Å²	130.7	80%	0.802	70%	0.699	S	S	*	*			trans	-67.7	112.1	155.4	0	0	0	0	0	108.4	T761	A759-T761 PolarHBondContact O-N 3.06Å
760	T	33.7	Very low	37.2	Very low	121 Å²	121	130.1 Å²	130.1	74%	0.742	69%	0.689	S	S	*	*			trans	-72.4	108.3	169.4	43.9	0	0	0	0	108.7	R758 I762	R758-T760 PolarHBondContact O-N 3.01Å; T760-I762 PolarHBondContact O-N 3.08Å
761	T	38.3	Very low	38.6	Very low	136 Å²	136	128.7 Å²	128.7	83%	0.834	68%	0.679	S	S	*	*			trans	-66.1	99.9	169.6	49.3	0	0	0	0	108.9	A759 S763	A759-T761 PolarHBondContact O-N 3.06Å; T761-S763 PolarHBondContact O-N 3.05Å
762	I	46.9	Very low	39.8	Very low	105 Å²	105	123 Å²	123	54%	0.538	66%	0.657	S	S	.	*			trans	-59.3	130	165.1	-60.3	175	0	0	0	106.8	T760 E766	T760-I762 PolarHBondContact O-N 3.08Å; I762-E766 HydrophobicContact CG2-CB 3.64Å
763	S	53.1	Low	40.9	Very low	48 Å²	48	122.4 Å²	122.4	34%	0.336	64%	0.642	S	S	.	*			trans	-73.4	155.4	-178.9	65.4	0	0	0	0	111.6	T761 Q765 E766 L767	T761-S763 PolarHBondContact O-N 3.05Å; S763-Q765 PolarHBondContact O-N 3.21Å; S763-E766 VanDerWaalsContact CB-OE2 3.28Å; S763-E766 WeakPolarHBondContact CB-OE2 3.33Å; S763-E766 PolarHBondContact N-OE2 3.16Å; S763-E766 PolarHBondContact O-N 2.85Å; S763-E766 VanDerWaalsContact OG-CD 3.31Å; S763-E766 VanDerWaalsContact OG-CG 3.29Å; S763-E766 WeakPolarHBondContact OG-CG 3.41Å; S763-E766 PolarHBondContact OG-N 3.15Å; S763-E766 PolarHBondContact OG-OE2 2.97Å; S763-L767 PolarHBondContact O-N 2.92Å
764	E	49.1	Very low	42.3	Very low	158 Å²	158	122.9 Å²	122.9	74%	0.738	64%	0.636	S	S	*	*	H	α-helix	trans	-60.8	-30	177.6	-164	165.8	-166.1	0	0	111.8	L767 Q768	E764-L767 PolarHBondContact O-N 2.98Å; E764-Q768 VanDerWaalsContact O-CG 3.3Å; E764-Q768 WeakPolarHBondContact O-CG 3.39Å; E764-Q768 PolarHBondContact O-N 2.85Å
765	Q	42.1	Very low	43.1	Very low	153 Å²	153	123.5 Å²	123.5	72%	0.715	63%	0.626	S	S	*	*	H	α-helix	trans	-70.6	-39.4	171.8	-72.4	-174.3	-63.9	0	0	113.4	S763 L767 Q768 Q769	S763-Q765 PolarHBondContact O-N 3.21Å; Q765-L767 VanDerWaalsContact C-N 3.29Å; Q765-L767 PolarHBondContact O-N 3.02Å; Q765-Q768 PolarHBondContact O-N 3.37Å; Q765-Q769 WeakPolarHBondContact O-CB 3.27Å; Q765-Q769 PolarHBondContact O-N 3.12Å
766	E	48.2	Very low	44	Very low	104 Å²	104	119.2 Å²	119.2	49%	0.486	61%	0.609	S	S	.	*	H	α-helix	trans	-65.7	-34.8	173.7	-74.3	161.2	124.7	0	0	111.3	I762 S763 Q769 L770	I762-E766 HydrophobicContact CG2-CB 3.64Å; S763-E766 VanDerWaalsContact CB-OE2 3.28Å; S763-E766 WeakPolarHBondContact CB-OE2 3.33Å; S763-E766 PolarHBondContact N-OE2 3.16Å; S763-E766 PolarHBondContact O-N 2.85Å; S763-E766 VanDerWaalsContact OG-CD 3.31Å; S763-E766 VanDerWaalsContact OG-CG 3.29Å; S763-E766 WeakPolarHBondContact OG-CG 3.41Å; S763-E766 PolarHBondContact OG-N 3.15Å; S763-E766 PolarHBondContact OG-OE2 2.97Å; E766-Q769 PolarHBondContact O-N 3.34Å; E766-L770 WeakPolarHBondContact O-CB 3.23Å; E766-L770 VanDerWaalsContact O-CG 3.26Å; E766-L770 WeakPolarHBondContact O-CG 3.46Å; E766-L770 PolarHBondContact O-N 3.14Å
767	L	58.3	Low	44.6	Very low	107 Å²	107	119.4 Å²	119.4	56%	0.56	61%	0.606	S	S	*	*	H	α-helix	trans	-64.6	-44.8	172.8	-115	165.7	0	0	0	112	S763 E764 Q765 L770 E771	S763-L767 PolarHBondContact O-N 2.92Å; E764-L767 PolarHBondContact O-N 2.98Å; Q765-L767 VanDerWaalsContact C-N 3.29Å; Q765-L767 PolarHBondContact O-N 3.02Å; L767-L770 PolarHBondContact O-N 3.34Å; L767-E771 PolarHBondContact O-N 2.96Å
768	Q	43.9	Very low	45.3	Very low	102 Å²	102	114.3 Å²	114.3	48%	0.477	59%	0.592	S	S	.	*	H	α-helix	trans	-63	-42.6	173.6	-72.8	167.8	-1.1	0	0	112.2	E764 Q765 L770 E771 I772	E764-Q768 VanDerWaalsContact O-CG 3.3Å; E764-Q768 WeakPolarHBondContact O-CG 3.39Å; E764-Q768 PolarHBondContact O-N 2.85Å; Q765-Q768 PolarHBondContact O-N 3.37Å; Q768-L770 VanDerWaalsContact C-N 3.32Å; Q768-L770 PolarHBondContact O-N 3.15Å; Q768-E771 PolarHBondContact O-N 2.93Å; Q768-I772 VanDerWaalsContact O-CG1 3.32Å; Q768-I772 WeakPolarHBondContact O-CG1 3.49Å; Q768-I772 PolarHBondContact O-N 2.83Å
769	Q	50.2	Low	46	Very low	108 Å²	108	106 Å²	106	51%	0.505	56%	0.563	S	S	.	*	H	α-helix	trans	-60.4	-42.5	177	-168.7	69.8	36.1	0	0	111.3	Q765 E766 I772 E773	Q765-Q769 WeakPolarHBondContact O-CB 3.27Å; Q765-Q769 PolarHBondContact O-N 3.12Å; E766-Q769 PolarHBondContact O-N 3.34Å; Q769-I772 PolarHBondContact O-N 3.49Å; Q769-E773 PolarHBondContact O-N 3.1Å
770	L	51	Low	46.5	Very low	98 Å²	98	106.3 Å²	106.3	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-70.2	-34.4	175.8	-71.3	167.7	0	0	0	112.9	E766 L767 Q768 I772 E773 L774	E766-L770 WeakPolarHBondContact O-CB 3.23Å; E766-L770 VanDerWaalsContact O-CG 3.26Å; E766-L770 WeakPolarHBondContact O-CG 3.46Å; E766-L770 PolarHBondContact O-N 3.14Å; L767-L770 PolarHBondContact O-N 3.34Å; Q768-L770 VanDerWaalsContact C-N 3.32Å; Q768-L770 PolarHBondContact O-N 3.15Å; L770-I772 VanDerWaalsContact C-N 3.33Å; L770-E773 PolarHBondContact O-N 3.42Å; L770-L774 WeakPolarHBondContact O-CB 3.44Å; L770-L774 PolarHBondContact O-N 3.26Å
771	E	53.8	Low	47.2	Very low	117 Å²	117	108.1 Å²	108.1	55%	0.547	56%	0.56	S	S	.	*	H	α-helix	trans	-66.7	-36.2	173.5	-159.5	174.2	-177	0	0	111	K607 L767 Q768 F775	K607-E771 IonicContact NZ-OE1 2.6Å; K607-E771 PolarHBondContact NZ-OE1 3.04Å; L767-E771 PolarHBondContact O-N 2.96Å; Q768-E771 PolarHBondContact O-N 2.93Å; E771-F775 WeakPolarHBondContact O-CB 3.15Å; E771-F775 PolarHBondContact O-N 3.22Å
772	I	52.2	Low	47.5	Very low	72 Å²	72	107.9 Å²	107.9	37%	0.369	56%	0.561	S	S	.	*	H	α-helix	trans	-67.3	-45.8	172.4	-67.7	164	0	0	0	111.4	Q768 Q769 L770 L774 F775 L776	Q768-I772 VanDerWaalsContact O-CG1 3.32Å; Q768-I772 WeakPolarHBondContact O-CG1 3.49Å; Q768-I772 PolarHBondContact O-N 2.83Å; Q769-I772 PolarHBondContact O-N 3.49Å; L770-I772 VanDerWaalsContact C-N 3.33Å; I772-L774 VanDerWaalsContact C-N 3.32Å; I772-L774 PolarHBondContact O-N 3.31Å; I772-F775 WeakPolarHBondContact O-CB 3.26Å; I772-F775 PolarHBondContact O-N 3.27Å; I772-L776 HydrophobicContact CG2-CD1 4.07Å; I772-L776 HydrophobicContact CG2-CG 4.49Å; I772-L776 WeakPolarHBondContact O-CG 3.37Å; I772-L776 PolarHBondContact O-N 3.22Å
773	E	46.9	Very low	47.6	Very low	95 Å²	95	109.1 Å²	109.1	44%	0.444	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-36	176.5	-75.5	-174.8	177.6	0	0	112.3	Q769 L770 F775 L776 N777	Q769-E773 PolarHBondContact O-N 3.1Å; L770-E773 PolarHBondContact O-N 3.42Å; E773-F775 VanDerWaalsContact C-N 3.34Å; E773-L776 PolarHBondContact O-N 3.26Å; E773-N777 PolarHBondContact O-N 3.32Å; E773-N777 PolarHBondContact O-ND2 2.88Å
774	L	50.6	Low	47.7	Very low	122 Å²	122	109.4 Å²	109.4	64%	0.639	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-39.3	173.7	-162.2	78.5	0	0	0	111.6	L770 I772 S778	L770-L774 WeakPolarHBondContact O-CB 3.44Å; L770-L774 PolarHBondContact O-N 3.26Å; I772-L774 VanDerWaalsContact C-N 3.32Å; I772-L774 PolarHBondContact O-N 3.31Å; L774-S778 PolarHBondContact O-N 3.48Å; L774-S778 PolarHBondContact O-OG 3.45Å
775	F	43.6	Very low	47.3	Very low	120 Å²	120	107.8 Å²	107.8	53%	0.526	56%	0.557	S	S	.	*	H	α-helix	trans	-65.4	-46.1	175.3	-170.6	-105.1	0	0	0	111.7	E771 I772 E773 N777 S778 L779 M791	E771-F775 WeakPolarHBondContact O-CB 3.15Å; E771-F775 PolarHBondContact O-N 3.22Å; I772-F775 WeakPolarHBondContact O-CB 3.26Å; I772-F775 PolarHBondContact O-N 3.27Å; E773-F775 VanDerWaalsContact C-N 3.34Å; F775-N777 PolarHBondContact O-N 3.24Å; F775-S778 WeakPolarHBondContact O-CB 3.4Å; F775-S778 PolarHBondContact O-N 2.93Å; F775-S778 VanDerWaalsContact O-N 3.07Å; F775-L779 HydrophobicContact CD1-CD1 4.08Å; F775-L779 HydrophobicContact CE1-CD1 3.87Å; F775-L779 PolarHBondContact O-N 3.04Å; F775-M791 HydrophobicContact CE1-CE 3.7Å; F775-M791 HydrophobicContact CZ-CE 3.84Å
776	L	42.7	Very low	47.5	Very low	102 Å²	102	107.1 Å²	107.1	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-61	-42	177.2	-70.8	170.3	0	0	0	112.7	I772 E773 S778 L779	I772-L776 HydrophobicContact CG2-CD1 4.07Å; I772-L776 HydrophobicContact CG2-CG 4.49Å; I772-L776 WeakPolarHBondContact O-CG 3.37Å; I772-L776 PolarHBondContact O-N 3.22Å; E773-L776 PolarHBondContact O-N 3.26Å; L776-S778 PolarHBondContact O-N 2.8Å; L776-L779 PolarHBondContact O-N 3.41Å
777	N	45.3	Very low	47.5	Very low	124 Å²	124	106.4 Å²	106.4	66%	0.663	55%	0.551	S	S	*	*	H	α-helix	trans	-65.3	-26.3	175.1	-79.5	-74.5	0	0	0	113.2	E773 F775 L779 S780	E773-N777 PolarHBondContact O-N 3.32Å; E773-N777 PolarHBondContact O-ND2 2.88Å; F775-N777 PolarHBondContact O-N 3.24Å; N777-L779 VanDerWaalsContact C-N 3.34Å; N777-S780 PolarHBondContact O-OG 2.83Å; N777-S780 VanDerWaalsContact O-OG 3.11Å
778	S	42.8	Very low	47.1	Very low	87 Å²	87	105.6 Å²	105.6	61%	0.608	54%	0.544	S	S	*	.	H	α-helix	trans	-78.5	-14.1	-179.7	-58.4	0	0	0	0	113.8	L774 F775 L776 S780	L774-S778 PolarHBondContact O-N 3.48Å; L774-S778 PolarHBondContact O-OG 3.45Å; F775-S778 WeakPolarHBondContact O-CB 3.4Å; F775-S778 PolarHBondContact O-N 2.93Å; F775-S778 VanDerWaalsContact O-N 3.07Å; L776-S778 PolarHBondContact O-N 2.8Å; S778-S780 VanDerWaalsContact C-N 3.27Å; S778-S780 PolarHBondContact O-N 3.19Å
779	L	43.9	Very low	47.3	Very low	49 Å²	49	106.7 Å²	106.7	26%	0.257	55%	0.549	S	S	.	.			trans	-89.2	31	-178	-67.9	169.8	0	0	0	113.5	F775 L776 N777 Q781 Y783 M791	F775-L779 HydrophobicContact CD1-CD1 4.08Å; F775-L779 HydrophobicContact CE1-CD1 3.87Å; F775-L779 PolarHBondContact O-N 3.04Å; L776-L779 PolarHBondContact O-N 3.41Å; N777-L779 VanDerWaalsContact C-N 3.34Å; L779-Q781 PolarHBondContact O-N 3.5Å; L779-Y783 HydrophobicContact CD2-CE2 4.22Å; L779-M791 HydrophobicContact CD1-CE 3.91Å; L779-M791 HydrophobicContact CD2-CE 4.26Å
780	S	40	Very low	47.3	Very low	104 Å²	104	107.6 Å²	107.6	73%	0.727	55%	0.554	S	S	*	*			trans	-82.2	37.6	-171.4	36.8	0	0	0	0	115.2	N777 S778	N777-S780 PolarHBondContact O-OG 2.83Å; N777-S780 VanDerWaalsContact O-OG 3.11Å; S778-S780 VanDerWaalsContact C-N 3.27Å; S778-S780 PolarHBondContact O-N 3.19Å
781	Q	49	Very low	46.9	Very low	160 Å²	160	106.5 Å²	106.5	75%	0.748	55%	0.547	S	S	*	.	S	Bend	trans	-139.3	152.3	163.5	-72.5	-161	9	0	0	110.5	L779 Y783	L779-Q781 PolarHBondContact O-N 3.5Å; Q781-Y783 PolarHBondContact O-N 3.24Å
782	P	43.2	Very low	46.2	Very low	131 Å²	131	106.2 Å²	106.2	85%	0.851	55%	0.548	S	S	*	.			trans	-82.5	106.3	-157.1	31.2	-35.5	0	0	0	114
783	Y	49.7	Very low	45.8	Very low	130 Å²	130	106.7 Å²	106.7	51%	0.51	56%	0.558	S	S	.	*			trans	-82.5	163.5	157.2	-64	-82.2	0	0	0	110.6	L779 Q781	L779-Y783 HydrophobicContact CD2-CE2 4.22Å; Q781-Y783 PolarHBondContact O-N 3.24Å
784	S	54.2	Low	45.5	Very low	55 Å²	55	107.2 Å²	107.2	39%	0.385	57%	0.572	S	S	.	*			trans	-74.3	158.6	172.7	69.3	0	0	0	0	111.9	E786 E787 Q788	S784-E786 PolarHBondContact O-N 3.45Å; S784-E787 VanDerWaalsContact CB-OE2 3.28Å; S784-E787 WeakPolarHBondContact CB-OE2 3.24Å; S784-E787 PolarHBondContact N-OE2 3.43Å; S784-E787 PolarHBondContact O-N 3.47Å; S784-E787 VanDerWaalsContact OG-CD 3.31Å; S784-E787 WeakPolarHBondContact OG-CG 3.21Å; S784-E787 PolarHBondContact OG-N 2.82Å; S784-E787 PolarHBondContact OG-OE2 2.73Å; S784-Q788 PolarHBondContact O-N 3.17Å
785	L	42.2	Very low	44.9	Very low	123 Å²	123	106.8 Å²	106.8	64%	0.644	57%	0.569	S	S	*	*	H	α-helix	trans	-57.6	-38.8	178.7	-169.7	72.5	0	0	0	111.8	E787 Q788 E789	L785-E787 PolarHBondContact O-N 2.89Å; L785-Q788 PolarHBondContact O-N 3.36Å; L785-E789 PolarHBondContact O-N 2.91Å
786	E	46.7	Very low	44.3	Very low	140 Å²	140	106.3 Å²	106.3	65%	0.654	58%	0.581	S	S	*	*	H	α-helix	trans	-68.6	-33	-177.1	-157.3	164	-163.8	0	0	112.1	S784 Q790	S784-E786 PolarHBondContact O-N 3.45Å; E786-Q790 VanDerWaalsContact O-CG 3.3Å; E786-Q790 WeakPolarHBondContact O-CG 2.98Å; E786-Q790 PolarHBondContact O-N 2.8Å
787	E	47.3	Very low	43.9	Very low	88 Å²	88	109 Å²	109	41%	0.411	59%	0.594	S	S	.	*	H	α-helix	trans	-71.9	-38	171.7	-69.3	163.3	120.7	0	0	111.9	S784 L785 Q790 M791	S784-E787 VanDerWaalsContact CB-OE2 3.28Å; S784-E787 WeakPolarHBondContact CB-OE2 3.24Å; S784-E787 PolarHBondContact N-OE2 3.43Å; S784-E787 PolarHBondContact O-N 3.47Å; S784-E787 VanDerWaalsContact OG-CD 3.31Å; S784-E787 WeakPolarHBondContact OG-CG 3.21Å; S784-E787 PolarHBondContact OG-N 2.82Å; S784-E787 PolarHBondContact OG-OE2 2.73Å; L785-E787 PolarHBondContact O-N 2.89Å; E787-Q790 PolarHBondContact O-N 2.84Å; E787-M791 WeakPolarHBondContact O-CG 3.42Å; E787-M791 PolarHBondContact O-N 2.8Å
788	Q	49.5	Very low	43.1	Very low	90 Å²	90	111.2 Å²	111.2	42%	0.421	61%	0.606	S	S	.	*	H	α-helix	trans	-67.2	-41.4	177.1	-68.6	-168.3	-45.9	0	0	112.3	S784 L785 M791 L792	S784-Q788 PolarHBondContact O-N 3.17Å; L785-Q788 PolarHBondContact O-N 3.36Å; Q788-M791 PolarHBondContact O-N 3.22Å; Q788-L792 WeakPolarHBondContact O-CG 3.46Å; Q788-L792 PolarHBondContact O-N 3.47Å
789	E	48.9	Very low	42.4	Very low	125 Å²	125	112.1 Å²	112.1	58%	0.584	61%	0.612	S	S	*	*	H	α-helix	trans	-65.5	-38.4	176.5	-71.5	-177.6	170.4	0	0	112	L785 L792 S793	L785-E789 PolarHBondContact O-N 2.91Å; E789-L792 PolarHBondContact O-N 3.2Å; E789-S793 PolarHBondContact O-N 2.99Å
790	Q	50	Low	41.9	Very low	127 Å²	127	115.3 Å²	115.3	59%	0.593	64%	0.636	S	S	*	*	H	α-helix	trans	-62.2	-45.3	172	-73.8	176.7	26.4	0	0	112.1	E786 E787 L792 S793	E786-Q790 VanDerWaalsContact O-CG 3.3Å; E786-Q790 WeakPolarHBondContact O-CG 2.98Å; E786-Q790 PolarHBondContact O-N 2.8Å; E787-Q790 PolarHBondContact O-N 2.84Å; Q790-L792 VanDerWaalsContact C-N 3.33Å; Q790-L792 PolarHBondContact O-N 2.74Å; Q790-S793 WeakPolarHBondContact O-CB 3.38Å; Q790-S793 PolarHBondContact O-N 3.08Å; Q790-S793 PolarHBondContact O-OG 3.36Å
791	M	42.2	Very low	41.2	Very low	75 Å²	75	120.4 Å²	120.4	37%	0.369	65%	0.645	S	S	.	*	H	α-helix	trans	-61.4	-38.5	176.9	-75.6	178	59	0	0	113	F775 L779 E787 Q788 S793 C794	F775-M791 HydrophobicContact CE1-CE 3.7Å; F775-M791 HydrophobicContact CZ-CE 3.84Å; L779-M791 HydrophobicContact CD1-CE 3.91Å; L779-M791 HydrophobicContact CD2-CE 4.26Å; E787-M791 WeakPolarHBondContact O-CG 3.42Å; E787-M791 PolarHBondContact O-N 2.8Å; Q788-M791 PolarHBondContact O-N 3.22Å; M791-S793 VanDerWaalsContact C-N 3.32Å; M791-S793 PolarHBondContact O-N 2.99Å; M791-C794 PolarHBondContact O-N 3.18Å
792	L	39.7	Very low	40.2	Very low	111 Å²	111	119.5 Å²	119.5	58%	0.581	65%	0.651	S	S	*	*	H	α-helix	trans	-68.8	-29.1	178.7	-72.4	168.7	0	0	0	112.8	Q788 E789 Q790 C794 L795	Q788-L792 WeakPolarHBondContact O-CG 3.46Å; Q788-L792 PolarHBondContact O-N 3.47Å; E789-L792 PolarHBondContact O-N 3.2Å; Q790-L792 VanDerWaalsContact C-N 3.33Å; Q790-L792 PolarHBondContact O-N 2.74Å; L792-C794 PolarHBondContact O-N 2.96Å; L792-L795 PolarHBondContact O-N 2.87Å
793	S	42.8	Very low	39.4	Very low	82 Å²	82	119 Å²	119	57%	0.573	65%	0.65	S	S	*	*	H	α-helix	trans	-62.2	-25.3	177.2	78.2	0	0	0	0	113.7	E789 Q790 M791 L795	E789-S793 PolarHBondContact O-N 2.99Å; Q790-S793 WeakPolarHBondContact O-CB 3.38Å; Q790-S793 PolarHBondContact O-N 3.08Å; Q790-S793 PolarHBondContact O-OG 3.36Å; M791-S793 VanDerWaalsContact C-N 3.32Å; M791-S793 PolarHBondContact O-N 2.99Å; S793-L795 VanDerWaalsContact C-N 3.27Å; S793-L795 PolarHBondContact O-N 2.7Å
794	C	41.2	Very low	38.4	Very low	107 Å²	107	120.3 Å²	120.3	72%	0.723	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-0.9	-175.6	-63.9	0	0	0	0	115.1	M791 L792	M791-C794 PolarHBondContact O-N 3.18Å; L792-C794 PolarHBondContact O-N 2.96Å
795	L	37	Very low	37.2	Very low	112 Å²	112	122 Å²	122	59%	0.586	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	-2	-174.3	-65.4	175.9	0	0	0	114.7	L792 S793 I797	L792-L795 PolarHBondContact O-N 2.87Å; S793-L795 VanDerWaalsContact C-N 3.27Å; S793-L795 PolarHBondContact O-N 2.7Å; L795-I797 PolarHBondContact O-N 2.98Å
796	S	32.5	Very low	36.4	Very low	111 Å²	111	121.1 Å²	121.1	78%	0.776	69%	0.688	S	S	*	*			trans	-80.4	100.9	178.4	-67	0	0	0	0	111.5
797	I	33.8	Very low	35.7	Very low	159 Å²	159	121.2 Å²	121.2	82%	0.815	69%	0.688	S	S	*	*			trans	-95.8	120.1	176.9	-55.6	176.3	0	0	0	110.2	L795	L795-I797 PolarHBondContact O-N 2.98Å
798	D	28.1	Very low	34.8	Very low	170 Å²	170	123.9 Å²	123.9	91%	0.909	70%	0.698	S	S	*	*			trans	-137.4	121.5	160.6	-111.2	-38.6	0	0	0	109.2
799	S	27.8	Very low	33.8	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	72%	0.716	S	S	*	*			trans	-159	120.3	178.2	-177.7	0	0	0	0	111.7
800	P	33.1	Very low	32.7	Very low	116 Å²	116	125.5 Å²	125.5	75%	0.753	72%	0.722	S	S	*	*			trans	-120.8	100	174.1	35.8	-22.5	0	0	0	112.5
801	F	26.3	Very low	31.6	Very low	210 Å²	210	127 Å²	127	92%	0.921	73%	0.733	S	S	*	*			trans	-149	116.8	149.1	-102.4	-68	0	0	0	111.8
802	V	28.3	Very low	31	Very low	142 Å²	142	132.9 Å²	132.9	86%	0.861	76%	0.756	S	S	*	*			trans	-130	134	165.7	175	0	0	0	0	106.6
803	S	26.9	Very low	30.4	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	77%	0.769	S	S	*	*			trans	-85.8	150.9	179.7	-150.7	0	0	0	0	111.6
804	D	27.1	Very low	29.6	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	78%	0.78	S	S	*	*			trans	-90	134.1	-166.8	-176.1	17.5	0	0	0	113.1
805	A	28.8	Very low	29	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	79%	0.79	S	S	*	*			trans	-155.1	120.3	169.7	0	0	0	0	0	113.5
806	S	27.1	Very low	28.4	Very low	105 Å²	105	138 Å²	138	73%	0.734	80%	0.796	S	S	*	*			trans	83	102.1	149.9	-170.9	0	0	0	0	121
807	E	31	Very low	28.2	Very low	142 Å²	142	140.3 Å²	140.3	66%	0.664	80%	0.798	S	S	*	*			trans	91.5	114.4	136.1	-73.4	-158.7	164.8	0	0	124
808	K	29.6	Very low	28.3	Very low	144 Å²	144	144 Å²	144	63%	0.626	80%	0.802	S	S	*	*				74.1	114.1	127	-69.6	177.4	-168.9	148.1	0	122
809	N	26.9	Very low	28.3	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	79%	0.794	S	S	*	*				93.6	132.8	129.4	-68.4	-27.2	0	0	0	121.9
810	S	25.9	Very low	28.5	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	79%	0.791	S	S	*	*			trans	72.2	77.2	151.7	-169.2	0	0	0	0	118.8
811	L	28	Very low	28.2	Very low	158 Å²	158	145.2 Å²	145.2	83%	0.827	80%	0.795	S	S	*	*				63	111.9	88.5	-65.8	166.8	0	0	0	117
812	K	29.4	Very low	28.4	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.865	77%	0.77	S	S	*	*				-176.9	117.3	111	-100.4	159.4	-174.3	163.8	0	115.6
813	A	26.8	Very low	28.7	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	76%	0.762	S	S	*	*			trans	62.7	153.7	142	0	0	0	0	0	119.3
814	S	26.6	Very low	28.7	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	76%	0.755	S	S	*	*			cis	-142.5	153.3	14.1	50.3	0	0	0	0	114
815	H	28	Very low	28.9	Very low	199 Å²	199	128.5 Å²	128.5	92%	0.921	73%	0.728	S	S	*	*			trans	-77.2	147	175.9	-66.8	-86.9	0	0	0	114
816	S	24.8	Very low	28.9	Very low	103 Å²	103	132 Å²	132	72%	0.72	73%	0.729	S	S	*	*			trans	-156.2	126.1	147.8	-176.7	0	0	0	0	111.4
817	L	27.8	Very low	28.9	Very low	158 Å²	158	130 Å²	130	83%	0.827	71%	0.714	S	S	*	*			trans	53.2	165.2	166.9	-86.5	77.8	0	0	0	120.2
818	R	35.1	Very low	28.6	Very low	236 Å²	236	132.9 Å²	132.9	89%	0.891	72%	0.719	S	S	*	*			trans	-91.5	137.5	161.7	-66	171.8	170.7	-176.7	-5.8	107
819	D	29.1	Very low	28.4	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	73%	0.731	S	S	*	*			trans	-117.5	135.6	153.9	-71.5	-52.7	0	0	0	108.5	M821	D819-M821 PolarHBondContact O-N 2.91Å
820	T	32.4	Very low	28.4	Very low	109 Å²	109	132 Å²	132	67%	0.669	73%	0.731	S	S	*	*			trans	-73.3	119.2	174.6	18.9	0	0	0	0	108.9	S822	T820-S822 PolarHBondContact O-N 3.31Å
821	M	27.2	Very low	28.5	Very low	169 Å²	169	136.6 Å²	136.6	83%	0.833	74%	0.741	S	S	*	*			trans	-74.6	66.4	175.8	-70.3	-79.4	102	0	0	111.1	D819 S823	D819-M821 PolarHBondContact O-N 2.91Å; M821-S823 PolarHBondContact O-N 3.04Å
822	S	30.4	Very low	28.7	Very low	57 Å²	57	134.7 Å²	134.7	40%	0.399	74%	0.736	S	S	.	*			trans	-69.8	106.7	159.2	179.3	0	0	0	0	107.2	T820 G824	T820-S822 PolarHBondContact O-N 3.31Å; S822-G824 PolarHBondContact O-N 2.95Å
823	S	33.4	Very low	29	Very low	100 Å²	100	132.9 Å²	132.9	70%	0.699	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.4	126.3	-177.8	50.1	0	0	0	0	111	M821	M821-S823 PolarHBondContact O-N 3.04Å
824	G	27.9	Very low	29	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-56.3	141.5	-179.5	0	0	0	0	0	112.4	S822	S822-G824 PolarHBondContact O-N 2.95Å
825	I	31.6	Very low	29.4	Very low	56 Å²	56	135.8 Å²	135.8	29%	0.287	74%	0.74	S	S	.	*	P	Polyproline II helix	trans	-100.7	138.7	-160.7	-138.8	174.4	0	0	0	113.5	G886 I887 S889 Q890	I825-G886 WeakPolarHBondContact CB-O 3.42Å; I825-G886 WeakPolarHBondContact CG2-O 3.3Å; I825-I887 HydrophobicContact CD1-CB 4.19Å; I825-I887 HydrophobicContact CD1-CG2 3.58Å; I825-S889 VanDerWaalsContact CG2-OG 3.31Å; I825-S889 WeakPolarHBondContact CG2-OG 3.24Å; I825-Q890 HydrophobicContact CD1-CG 4.28Å; I825-Q890 HydrophobicContact CG2-CG 3.63Å
826	H	28.1	Very low	29.3	Very low	164 Å²	164	131.9 Å²	131.9	76%	0.759	74%	0.735	S	S	*	*			trans	-98.3	106.5	174.1	-65.1	-67.4	0	0	0	110.3	Q890	H826-Q890 PolarHBondContact O-NE2 3.18Å
827	S	27.1	Very low	29.7	Very low	61 Å²	61	137.1 Å²	137.1	43%	0.427	75%	0.746	S	S	.	*			trans	-89.6	137.4	167	-162.3	0	0	0	0	109.7
828	W	24.5	Very low	29.7	Very low	203 Å²	203	133.8 Å²	133.8	77%	0.769	74%	0.735	S	S	*	*			trans	-130.3	96.5	171.6	-85.9	79.8	0	0	0	109.6
829	N	24.8	Very low	29.2	Very low	161 Å²	161	132 Å²	132	86%	0.861	73%	0.729	S	S	*	*			trans	177.4	99.1	139.5	-95.5	-20.2	0	0	0	112.3
830	S	27.3	Very low	29.1	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	73%	0.727	S	S	*	*			trans	-168.8	85.8	153.1	60.4	0	0	0	0	112.8
831	Q	28.9	Very low	28.8	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	74%	0.738	S	S	*	*				167	173.1	119.2	-90.9	-174.7	-20.2	0	0	113.4
832	T	32	Very low	28.8	Very low	117 Å²	117	133 Å²	133	72%	0.718	73%	0.733	S	S	*	*			trans	-96.1	155.4	-164.9	47.5	0	0	0	0	114.3
833	D	35.5	Very low	28.7	Very low	162 Å²	162	137.8 Å²	137.8	87%	0.866	75%	0.753	S	S	*	*			trans	52.5	98.3	154.1	-57.6	-20.7	0	0	0	118.7
834	G	26.9	Very low	28.3	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	76%	0.759	S	S	*	*			trans	-178.4	130.8	165.6	0	0	0	0	0	111.6	S836	G834-S836 PolarHBondContact O-N 3.24Å
835	Q	35.4	Very low	28.3	Very low	201 Å²	201	142.2 Å²	142.2	94%	0.939	75%	0.745	S	S	*	*			trans	-72.3	123.3	179.2	-68.8	174	-32	0	0	111.5
836	S	25.3	Very low	27.8	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	77%	0.765	S	S	*	*			trans	-172.8	143.7	142.7	24.5	0	0	0	0	111.3	G834	G834-S836 PolarHBondContact O-N 3.24Å
837	F	32	Very low	27.9	Very low	213 Å²	213	146.5 Å²	146.5	93%	0.934	77%	0.767	S	S	*	*			trans	-80.7	146.5	167.2	-76	-118.6	0	0	0	109.1
838	S	28.5	Very low	27.9	Very low	88 Å²	88	150.1 Å²	150.1	62%	0.615	78%	0.777	S	S	*	*				179.6	166.8	109	-147.7	0	0	0	0	116.2	N840	S838-N840 PolarHBondContact O-N 3.29Å
839	W	25.7	Very low	28.1	Very low	198 Å²	198	146.9 Å²	146.9	75%	0.75	78%	0.779	S	S	*	*	S	Bend	trans	75.9	-15	145.8	-73.6	127.7	0	0	0	124.9	L842	W839-L842 HydrophobicContact CZ3-CD1 4.18Å
840	N	25.8	Very low	28.2	Very low	134 Å²	134	147.3 Å²	147.3	72%	0.717	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	7	-173.2	-85.7	-12.9	0	0	0	118.6	S838	S838-N840 PolarHBondContact O-N 3.29Å
841	N	26.4	Very low	28.2	Very low	168 Å²	168	145 Å²	145	90%	0.898	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	0.6	-179	-92	17.9	0	0	0	116	L843	N841-L843 PolarHBondContact O-N 2.72Å
842	L	27	Very low	28.1	Very low	137 Å²	137	140.5 Å²	140.5	72%	0.717	75%	0.75	S	S	*	*	S	Bend	trans	-88.5	1.4	-170.6	-136	141	0	0	0	114.7	W839	W839-L842 HydrophobicContact CZ3-CD1 4.18Å
843	L	27.5	Very low	28	Very low	157 Å²	157	140.4 Å²	140.4	82%	0.822	76%	0.755	S	S	*	*	S	Bend	trans	-139.6	61.8	-179.2	-73.5	177	0	0	0	113.1	N841	N841-L843 PolarHBondContact O-N 2.72Å
844	N	25.1	Very low	28	Very low	157 Å²	157	142 Å²	142	84%	0.84	75%	0.75	S	S	*	*			trans	-170.6	78.6	151.7	-103.7	-36.3	0	0	0	115
845	R	27.8	Very low	28.4	Very low	103 Å²	103	146.1 Å²	146.1	39%	0.389	75%	0.746	S	S	.	*			trans	-156.9	82.2	145.9	-114.4	166.4	-169.6	-147.9	3.4	113.6	Q429 E431	Q429-R845 PolarHBondContact NE2-O 3.21Å; Q429-R845 PolarHBondContact OE1-O 2.87Å; E431-R845 WeakPolarHBondContact OE1-CD 3.39Å; E431-R845 IonicContact OE1-CZ 2.66Å; E431-R845 IonicContact OE1-NE 3.56Å; E431-R845 PolarHBondContact OE1-NE 2.73Å; E431-R845 IonicContact OE1-NH1 2.6Å; E431-R845 PolarHBondContact OE1-NH1 2.75Å; E431-R845 WeakPolarHBondContact OE2-CD 3.45Å
846	S	22.5	Very low	29	Very low	101 Å²	101	143.2 Å²	143.2	71%	0.706	74%	0.737	S	S	*	*			trans	-135.1	135.7	141.7	57.9	0	0	0	0	107.9
847	R	29.8	Very low	30.7	Very low	210 Å²	210	138.4 Å²	138.4	79%	0.792	71%	0.706	S	S	*	*			trans	-94.9	150.1	173	-74.9	-166.9	-174.9	-178.7	5.6	109.4	T849	R847-T849 PolarHBondContact O-N 3.45Å
848	H	26.5	Very low	32.7	Very low	137 Å²	137	128.5 Å²	128.5	63%	0.634	66%	0.663	S	S	*	*			trans	-71.7	113.8	-174.3	-62.1	-106.7	0	0	0	113.3	T851	H848-T851 PolarHBondContact ND1-OG1 2.91Å
849	T	28.6	Very low	34.9	Very low	134 Å²	134	129.7 Å²	129.7	82%	0.822	66%	0.657	S	S	*	*	S	Bend		-132.4	143.6	127.4	42.8	0	0	0	0	106.9	R847	R847-T849 PolarHBondContact O-N 3.45Å
850	D	27.8	Very low	37.8	Very low	170 Å²	170	120.3 Å²	120.3	91%	0.909	62%	0.622	S	S	*	*	S	Bend	trans	49.9	76.2	-172.2	-71.9	6.3	0	0	0	115.4
851	T	27.9	Very low	40.9	Very low	68 Å²	68	115.2 Å²	115.2	42%	0.417	59%	0.593	S	S	.	*			trans	-92.9	140.1	174.8	-38.4	0	0	0	0	110.4	H848 S853	H848-T851 PolarHBondContact ND1-OG1 2.91Å; T851-S853 PolarHBondContact O-N 3.4Å
852	P	25.4	Very low	44	Very low	100 Å²	100	107.2 Å²	107.2	65%	0.649	55%	0.551	S	S	*	*			trans	-53.3	137.8	167.4	-26.2	35.2	0	0	0	111.7	Y854	P852-Y854 HydrophobicContact CB-CD2 4.32Å; P852-Y854 PolarHBondContact O-N 3.01Å
853	S	31.3	Very low	46.9	Very low	116 Å²	116	103.4 Å²	103.4	81%	0.811	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	43.6	-164.7	66	0	0	0	0	115.4	T851	T851-S853 PolarHBondContact O-N 3.4Å
854	Y	33.9	Very low	49.8	Very low	194 Å²	194	97 Å²	97	76%	0.761	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-6.6	-173	-75.3	-84.5	0	0	0	114.6	P852	P852-Y854 HydrophobicContact CB-CD2 4.32Å; P852-Y854 PolarHBondContact O-N 3.01Å
855	F	35.9	Very low	52.5	Low	165 Å²	165	93.5 Å²	93.5	72%	0.724	48%	0.477	S	S	*	.			trans	-120.4	39.5	-175.6	-81.3	-76.9	0	0	0	114.8	G857	F855-G857 PolarHBondContact O-N 2.84Å
856	N	48.6	Very low	54.9	Low	139 Å²	139	92.3 Å²	92.3	74%	0.743	48%	0.484	S	S	*	.			trans	-76	104	159.8	-88	-5	0	0	0	109.1	H876	N856-H876 PolarHBondContact O-CD2 3.13Å; N856-H876 PolarHBondContact O-NE2 3.34Å
857	G	61.5	Low	57.4	Low	17 Å²	17	89.2 Å²	89.2	18%	0.175	47%	0.468	C	S	.	.			trans	-144.7	143.6	179.8	0	0	0	0	0	111.7	F855 R873 D874	F855-G857 PolarHBondContact O-N 2.84Å; G857-R873 WeakPolarHBondContact O-CG 3.48Å; G857-R873 PolarHBondContact O-NE 3.14Å; G857-D874 CarbonylContact C-O 3.5Å; G857-D874 VanDerWaalsContact C-O 3.3Å; G857-D874 WeakPolarHBondContact CA-O 3.34Å
858	V	72.4	Confident	59.8	Low	5 Å²	5	85.3 Å²	85.3	3%	0.03	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	136.9	-170.9	-179.4	0	0	0	0	110.7	R873 D874 H876 V912 P913	V858-R873 WeakPolarHBondContact O-CA 3.25Å; V858-D874 PolarHBondContact N-O 3.36Å; V858-D874 PolarHBondContact O-N 3.03Å; V858-D874 VanDerWaalsContact O-N 3.09Å; V858-H876 HydrophobicContact CG2-CB 4.42Å; V858-H876 WeakPolarHBondContact CG2-ND1 3.47Å; V858-V912 HydrophobicContact CG1-CG1 3.65Å; V858-P913 WeakPolarHBondContact CG1-O 3.5Å
859	K	75.4	Confident	62.3	Low	114 Å²	114	82.3 Å²	82.3	50%	0.496	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	121.6	178	-170.4	-163.6	174.9	-154	0	110.5	G916 I917	K859-G916 WeakPolarHBondContact O-CA 3.33Å; K859-I917 PolarHBondContact O-N 2.99Å
860	I	87.3	Confident	64.8	Low	1 Å²	1	77.5 Å²	77.5	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137	171.5	-61.9	126	0	0	0	108.1	I862 I872 D874 I883 V912 I917	I860-I862 HydrophobicContact CG2-CD1 4.14Å; I860-I862 HydrophobicContact CG2-CG1 3.84Å; I860-I872 HydrophobicContact CB-CB 4.2Å; I860-I872 HydrophobicContact CD1-CG2 4.45Å; I860-I872 PolarHBondContact N-O 2.74Å; I860-I872 PolarHBondContact O-N 2.81Å; I860-I872 VanDerWaalsContact O-O 3.07Å; I860-D874 HydrophobicContact CD1-CB 3.55Å; I860-I883 HydrophobicContact CD1-CD1 3.66Å; I860-I883 HydrophobicContact CG1-CD1 4.23Å; I860-V912 HydrophobicContact CD1-CG1 4.45Å; I860-V912 HydrophobicContact CD1-CG2 4.32Å; I860-V912 HydrophobicContact CG1-CB 4.5Å; I860-V912 HydrophobicContact CG1-CG1 3.83Å; I860-V912 HydrophobicContact CG1-CG2 4.1Å; I860-I917 HydrophobicContact CB-CG2 4.41Å; I860-I917 HydrophobicContact CG1-CG2 4.07Å; I860-I917 HydrophobicContact CG2-CG2 4.04Å
861	Q	89.5	Confident	67.3	Low	26 Å²	26	75 Å²	75	12%	0.121	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.9	174.8	-170	173.3	-41.3	0	0	108.9	N869 L870 H871 I917 E918 L919	Q861-N869 HydrophobicContact CG-CB 4.32Å; Q861-L870 CarbonylContact C-O 3.57Å; Q861-L870 WeakPolarHBondContact CA-O 3.23Å; Q861-H871 VanDerWaalsContact CD-NE2 3.34Å; Q861-H871 PolarHBondContact OE1-NE2 2.69Å; Q861-I917 PolarHBondContact N-O 3.48Å; Q861-E918 HydrophobicContact CB-CG 4.28Å; Q861-E918 WeakPolarHBondContact O-CA 3.19Å; Q861-L919 PolarHBondContact O-N 3.03Å
862	I	91.4	Very high	69.8	Low	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	113.2	-175.9	-48.7	-175.7	0	0	0	109.1	I860 L864 L870 I872 I883 I887 L898 L919	I860-I862 HydrophobicContact CG2-CD1 4.14Å; I860-I862 HydrophobicContact CG2-CG1 3.84Å; I862-L864 PolarHBondContact O-N 2.72Å; I862-L870 HydrophobicContact CB-CB 4.36Å; I862-L870 PolarHBondContact N-O 2.95Å; I862-L870 PolarHBondContact O-N 2.77Å; I862-I872 HydrophobicContact CD1-CD1 3.75Å; I862-I872 HydrophobicContact CG1-CD1 4.32Å; I862-I883 HydrophobicContact CD1-CG2 3.86Å; I862-I887 HydrophobicContact CD1-CD1 3.62Å; I862-L898 HydrophobicContact CD1-CD1 4.07Å; I862-L898 HydrophobicContact CG2-CD2 3.84Å; I862-L919 CarbonylContact C-O 3.56Å; I862-L919 WeakPolarHBondContact CA-O 3.3Å; I862-L919 HydrophobicContact CG1-CB 4.34Å; I862-L919 HydrophobicContact CG2-CB 4.46Å
863	Q	89.8	Confident	72.1	Confident	58 Å²	58	76.9 Å²	76.9	27%	0.271	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122.5	172.2	-167.7	171.4	35	0	0	110.1	G867 E868 N869 L919 Q920 C921	Q863-G867 PolarHBondContact NE2-O 3.06Å; Q863-E868 CarbonylContact C-O 3.47Å; Q863-E868 WeakPolarHBondContact CA-O 3.15Å; Q863-N869 WeakPolarHBondContact CB-OD1 3.39Å; Q863-L919 PolarHBondContact N-O 3.48Å; Q863-Q920 HydrophobicContact CB-CB 4.46Å; Q863-Q920 HydrophobicContact CB-CG 4.29Å; Q863-Q920 WeakPolarHBondContact O-CA 3.28Å; Q863-C921 WeakPolarHBondContact O-CB 3.15Å; Q863-C921 PolarHBondContact O-N 3.43Å
864	L	87.9	Confident	74.3	Confident	22 Å²	22	73.1 Å²	73.1	12%	0.115	36%	0.359	C	S	.	.			trans	-76.8	165.2	177.3	-69	-177.1	0	0	0	112.2	I862 S866 G867 E868 L870 I891	I862-L864 PolarHBondContact O-N 2.72Å; L864-S866 WeakPolarHBondContact CB-OG 3.25Å; L864-S866 PolarHBondContact O-N 2.89Å; L864-G867 WeakPolarHBondContact O-CA 3.28Å; L864-G867 PolarHBondContact O-N 3.17Å; L864-E868 PolarHBondContact N-O 2.82Å; L864-L870 HydrophobicContact CD1-CD1 4.22Å; L864-L870 HydrophobicContact CD1-CD2 4.46Å; L864-L870 HydrophobicContact CD1-CG 3.98Å; L864-L870 HydrophobicContact CD2-CD1 3.74Å; L864-L870 HydrophobicContact CD2-CG 4.2Å; L864-L870 HydrophobicContact CG-CD1 4.14Å; L864-L870 HydrophobicContact CG-CG 4.03Å; L864-I891 HydrophobicContact CD2-CD1 3.84Å; L864-I891 HydrophobicContact CD2-CG1 3.72Å
865	L	82.1	Confident	76.1	Confident	84 Å²	84	71 Å²	71	44%	0.44	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.9	173.4	-68.8	167.4	0	0	0	113.3	G867 V893 C921 L923	L865-G867 VanDerWaalsContact C-N 3.3Å; L865-V893 HydrophobicContact CD1-CB 4.38Å; L865-V893 HydrophobicContact CD1-CG1 3.88Å; L865-V893 HydrophobicContact CD1-CG2 3.66Å; L865-C921 VanDerWaalsContact CD2-O 3.28Å; L865-C921 WeakPolarHBondContact CD2-O 3.35Å; L865-C921 HydrophobicContact CG-CB 4.34Å; L865-L923 HydrophobicContact CD1-CD2 3.67Å; L865-L923 HydrophobicContact CD1-CG 3.89Å; L865-L923 HydrophobicContact CD2-CG 4.2Å
866	S	77.9	Confident	77.8	Confident	77 Å²	77	67.3 Å²	67.3	54%	0.538	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.1	169.2	52.2	0	0	0	0	113.7	L864 E868	L864-S866 WeakPolarHBondContact CB-OG 3.25Å; L864-S866 PolarHBondContact O-N 2.89Å; S866-E868 VanDerWaalsContact C-N 3.33Å; S866-E868 WeakPolarHBondContact CB-OE2 3.48Å; S866-E868 PolarHBondContact OG-OE2 3.43Å
867	G	75.6	Confident	79.1	Confident	37 Å²	37	69.1 Å²	69.1	38%	0.381	34%	0.335	S	S	.	.	S	Bend	trans	89.6	-10.7	-172	0	0	0	0	0	114.5	Q863 L864 L865	Q863-G867 PolarHBondContact NE2-O 3.06Å; L864-G867 WeakPolarHBondContact O-CA 3.28Å; L864-G867 PolarHBondContact O-N 3.17Å; L865-G867 VanDerWaalsContact C-N 3.3Å
868	E	78.8	Confident	80.1	Confident	127 Å²	127	69.6 Å²	69.6	59%	0.593	34%	0.335	S	S	*	.			trans	-69.8	156.4	177.2	-62.1	164.8	122.3	0	0	111.9	Q863 L864 S866	Q863-E868 CarbonylContact C-O 3.47Å; Q863-E868 WeakPolarHBondContact CA-O 3.15Å; L864-E868 PolarHBondContact N-O 2.82Å; S866-E868 VanDerWaalsContact C-N 3.33Å; S866-E868 WeakPolarHBondContact CB-OE2 3.48Å; S866-E868 PolarHBondContact OG-OE2 3.43Å
869	N	79.1	Confident	81	Confident	75 Å²	75	72.5 Å²	72.5	40%	0.401	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	108	-178.4	-71.8	-59	0	0	0	111.8	Q861 Q863 H871	Q861-N869 HydrophobicContact CG-CB 4.32Å; Q863-N869 WeakPolarHBondContact CB-OD1 3.39Å; N869-H871 PolarHBondContact O-ND1 2.64Å
870	L	80.4	Confident	81.7	Confident	33 Å²	33	67 Å²	67	17%	0.173	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.2	163.7	-71.2	176.3	0	0	0	109.5	Q861 I862 L864	Q861-L870 CarbonylContact C-O 3.57Å; Q861-L870 WeakPolarHBondContact CA-O 3.23Å; I862-L870 HydrophobicContact CB-CB 4.36Å; I862-L870 PolarHBondContact N-O 2.95Å; I862-L870 PolarHBondContact O-N 2.77Å; L864-L870 HydrophobicContact CD1-CD1 4.22Å; L864-L870 HydrophobicContact CD1-CD2 4.46Å; L864-L870 HydrophobicContact CD1-CG 3.98Å; L864-L870 HydrophobicContact CD2-CD1 3.74Å; L864-L870 HydrophobicContact CD2-CG 4.2Å; L864-L870 HydrophobicContact CG-CD1 4.14Å; L864-L870 HydrophobicContact CG-CG 4.03Å
871	H	81.2	Confident	81.7	Confident	116 Å²	116	67.1 Å²	67.1	54%	0.537	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.5	176.4	-70.4	78.6	0	0	0	108.3	Q861 N869	Q861-H871 VanDerWaalsContact CD-NE2 3.34Å; Q861-H871 PolarHBondContact OE1-NE2 2.69Å; N869-H871 PolarHBondContact O-ND1 2.64Å
872	I	79.6	Confident	81.6	Confident	34 Å²	34	68.1 Å²	68.1	17%	0.174	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146	-172.1	-59.4	171.2	0	0	0	108	I860 I862 I883 I887	I860-I872 HydrophobicContact CB-CB 4.2Å; I860-I872 HydrophobicContact CD1-CG2 4.45Å; I860-I872 PolarHBondContact N-O 2.74Å; I860-I872 PolarHBondContact O-N 2.81Å; I860-I872 VanDerWaalsContact O-O 3.07Å; I862-I872 HydrophobicContact CD1-CD1 3.75Å; I862-I872 HydrophobicContact CG1-CD1 4.32Å; I872-I883 HydrophobicContact CD1-CG2 4.1Å; I872-I887 HydrophobicContact CD1-CG2 3.52Å
873	R	73.9	Confident	81.4	Confident	175 Å²	175	68.3 Å²	68.3	66%	0.66	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	119.5	172.5	-159.7	-179.3	-156.2	163	5.9	108.8	G857 V858	G857-R873 WeakPolarHBondContact O-CG 3.48Å; G857-R873 PolarHBondContact O-NE 3.14Å; V858-R873 WeakPolarHBondContact O-CA 3.25Å
874	D	78.8	Confident	81.4	Confident	36 Å²	36	65.6 Å²	65.6	19%	0.193	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	171.9	-169.5	-148.4	-52.7	0	0	0	110.6	G857 V858 I860 T878	G857-D874 CarbonylContact C-O 3.5Å; G857-D874 VanDerWaalsContact C-O 3.3Å; G857-D874 WeakPolarHBondContact CA-O 3.34Å; V858-D874 PolarHBondContact N-O 3.36Å; V858-D874 PolarHBondContact O-N 3.03Å; V858-D874 VanDerWaalsContact O-N 3.09Å; I860-D874 HydrophobicContact CD1-CB 3.55Å; D874-T878 VanDerWaalsContact OD1-CB 3.27Å; D874-T878 WeakPolarHBondContact OD1-CB 3.25Å; D874-T878 WeakPolarHBondContact OD1-CG2 3.44Å; D874-T878 PolarHBondContact OD1-OG1 3.05Å
875	F	71.3	Confident	81.3	Confident	150 Å²	150	66.5 Å²	66.5	66%	0.658	33%	0.325	S	S	*	.			trans	-67.5	153.6	177.4	-65.7	-78.9	0	0	0	112.1	R877 T878	F875-R877 PolarHBondContact O-N 3.01Å; F875-T878 PolarHBondContact O-N 3.09Å; F875-T878 PolarHBondContact O-OG1 3.5Å
876	H	72	Confident	81.2	Confident	87 Å²	87	63.3 Å²	63.3	40%	0.403	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	130	170.2	-68.5	-86.3	0	0	0	110.2	N856 V858 D914	N856-H876 PolarHBondContact O-CD2 3.13Å; N856-H876 PolarHBondContact O-NE2 3.34Å; V858-H876 HydrophobicContact CG2-CB 4.42Å; V858-H876 WeakPolarHBondContact CG2-ND1 3.47Å; H876-D914 IonicContact CE1-OD1 2.66Å; H876-D914 IonicContact CG-OD1 2.75Å; H876-D914 IonicContact ND1-OD1 3.87Å; H876-D914 PolarHBondContact ND1-OD1 2.81Å
877	R	75.6	Confident	81.6	Confident	178 Å²	178	59.7 Å²	59.7	67%	0.672	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	15.3	-176.8	-48.9	-177.6	-168.5	176.9	2.5	117.1	F875 E911	F875-R877 PolarHBondContact O-N 3.01Å; R877-E911 HydrophobicContact CB-CB 4.43Å; R877-E911 HydrophobicContact CB-CG 4.28Å; R877-E911 WeakPolarHBondContact CB-OE2 3.29Å; R877-E911 WeakPolarHBondContact CD-OE2 3.47Å; R877-E911 WeakPolarHBondContact CG-OE2 3.48Å
878	T	82.1	Confident	82.1	Confident	27 Å²	27	59.3 Å²	59.3	17%	0.166	28%	0.278	C	S	.	.			trans	-60.6	146.3	165.5	-59.6	0	0	0	0	110.3	D874 F875 D882 I883 V912	D874-T878 VanDerWaalsContact OD1-CB 3.27Å; D874-T878 WeakPolarHBondContact OD1-CB 3.25Å; D874-T878 WeakPolarHBondContact OD1-CG2 3.44Å; D874-T878 PolarHBondContact OD1-OG1 3.05Å; F875-T878 PolarHBondContact O-N 3.09Å; F875-T878 PolarHBondContact O-OG1 3.5Å; T878-D882 HydrophobicContact CG2-CB 4.32Å; T878-I883 HydrophobicContact CG2-CD1 4.07Å; T878-I883 HydrophobicContact CG2-CG1 3.83Å; T878-V912 WeakPolarHBondContact O-CG2 3.14Å; T878-V912 PolarHBondContact O-N 3.45Å
879	K	90.8	Very high	82.1	Confident	65 Å²	65	57.4 Å²	57.4	28%	0.283	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-92.9	147.9	-177.3	-68	173.8	162.8	-173.7	0	113	G881 D882 I883 D909 M910 E911	K879-G881 PolarHBondContact O-N 2.85Å; K879-D882 WeakPolarHBondContact CB-OD2 3.16Å; K879-D882 PolarHBondContact O-N 2.69Å; K879-D882 VanDerWaalsContact O-N 3.11Å; K879-I883 WeakPolarHBondContact O-CG1 3.41Å; K879-I883 PolarHBondContact O-N 3.29Å; K879-I883 VanDerWaalsContact O-N 3.11Å; K879-D909 IonicContact NZ-OD1 2.73Å; K879-D909 PolarHBondContact NZ-OD1 3.26Å; K879-M910 WeakPolarHBondContact CA-O 3.14Å; K879-E911 HydrophobicContact CG-CG 4.4Å
880	V	90.9	Very high	82.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-34.2	176.9	175.7	0	0	0	0	112.6	A884 L898 V906 M910 V912 L919 W933	V880-A884 VanDerWaalsContact O-CB 3.23Å; V880-A884 WeakPolarHBondContact O-CB 3.43Å; V880-A884 PolarHBondContact O-N 2.94Å; V880-L898 HydrophobicContact CG1-CB 4.18Å; V880-L898 HydrophobicContact CG1-CD1 3.94Å; V880-V906 HydrophobicContact CB-CG1 4.12Å; V880-V906 HydrophobicContact CG1-CG1 3.85Å; V880-V906 HydrophobicContact CG2-CG1 3.95Å; V880-M910 HydrophobicContact CG2-CB 4.37Å; V880-M910 PolarHBondContact N-O 2.76Å; V880-V912 HydrophobicContact CG2-CG2 4.14Å; V880-L919 HydrophobicContact CG1-CD1 3.96Å; V880-L919 HydrophobicContact CG2-CD1 4.25Å; V880-W933 HydrophobicContact CG1-CH2 4.13Å; V880-W933 HydrophobicContact CG1-CZ2 4.12Å
881	G	88	Confident	82.1	Confident	2 Å²	2	54.2 Å²	54.2	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-37.4	175.7	0	0	0	0	0	114.4	K879 A884 T885 Y908	K879-G881 PolarHBondContact O-N 2.85Å; G881-A884 PolarHBondContact O-N 3.28Å; G881-T885 WeakPolarHBondContact O-CB 3.31Å; G881-T885 PolarHBondContact O-N 3.41Å; G881-T885 PolarHBondContact O-OG1 3.23Å; G881-Y908 PolarHBondContact N-O 3.44Å
882	D	86.1	Confident	82	Confident	47 Å²	47	54.9 Å²	54.9	25%	0.251	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-44.4	176.5	-65.9	-45.3	0	0	0	109.7	T878 K879 T885 G886	T878-D882 HydrophobicContact CG2-CB 4.32Å; K879-D882 WeakPolarHBondContact CB-OD2 3.16Å; K879-D882 PolarHBondContact O-N 2.69Å; K879-D882 VanDerWaalsContact O-N 3.11Å; D882-T885 PolarHBondContact O-N 3.03Å; D882-G886 PolarHBondContact O-N 3.32Å
883	I	88.6	Confident	82.2	Confident	5 Å²	5	55 Å²	55	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-48.5	173.5	-64.1	156.9	0	0	0	110.9	I860 I862 I872 T878 K879 T885 G886 I887 V912	I860-I883 HydrophobicContact CD1-CD1 3.66Å; I860-I883 HydrophobicContact CG1-CD1 4.23Å; I862-I883 HydrophobicContact CD1-CG2 3.86Å; I872-I883 HydrophobicContact CD1-CG2 4.1Å; T878-I883 HydrophobicContact CG2-CD1 4.07Å; T878-I883 HydrophobicContact CG2-CG1 3.83Å; K879-I883 WeakPolarHBondContact O-CG1 3.41Å; K879-I883 PolarHBondContact O-N 3.29Å; K879-I883 VanDerWaalsContact O-N 3.11Å; I883-T885 VanDerWaalsContact C-N 3.27Å; I883-T885 PolarHBondContact O-N 3.41Å; I883-G886 PolarHBondContact O-N 3.48Å; I883-I887 HydrophobicContact CG2-CG2 4.47Å; I883-I887 WeakPolarHBondContact O-CG1 3.18Å; I883-I887 WeakPolarHBondContact O-CG2 3.43Å; I883-I887 PolarHBondContact O-N 3.24Å; I883-V912 HydrophobicContact CD1-CG2 3.66Å
884	A	88.1	Confident	82.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-36.6	178	0	0	0	0	0	112.4	V880 G881 I887 F896 L898 W933 V935	V880-A884 VanDerWaalsContact O-CB 3.23Å; V880-A884 WeakPolarHBondContact O-CB 3.43Å; V880-A884 PolarHBondContact O-N 2.94Å; G881-A884 PolarHBondContact O-N 3.28Å; A884-I887 WeakPolarHBondContact O-CG1 3.41Å; A884-F896 HydrophobicContact CB-CE2 4.45Å; A884-F896 WeakPolarHBondContact O-CZ 3.45Å; A884-L898 HydrophobicContact CB-CD1 3.79Å; A884-L898 HydrophobicContact CB-CG 4.2Å; A884-W933 HydrophobicContact CB-CH2 3.82Å; A884-W933 HydrophobicContact CB-CZ3 3.69Å; A884-V935 HydrophobicContact CB-CG2 3.82Å
885	T	87.4	Confident	83.2	Confident	42 Å²	42	50 Å²	50	26%	0.258	27%	0.271	S	S	.	.	H	α-helix	trans	-70.7	-42.1	176.9	-55.2	0	0	0	0	110.6	G881 D882 I883 S888 G938	G881-T885 WeakPolarHBondContact O-CB 3.31Å; G881-T885 PolarHBondContact O-N 3.41Å; G881-T885 PolarHBondContact O-OG1 3.23Å; D882-T885 PolarHBondContact O-N 3.03Å; I883-T885 VanDerWaalsContact C-N 3.27Å; I883-T885 PolarHBondContact O-N 3.41Å; T885-S888 VanDerWaalsContact O-CB 3.23Å; T885-S888 WeakPolarHBondContact O-CB 3.34Å; T885-S888 PolarHBondContact O-N 3.49Å; T885-S888 PolarHBondContact O-OG 3.25Å; T885-G938 WeakPolarHBondContact CG2-O 3.36Å
886	G	80.2	Confident	84.2	Confident	16 Å²	16	43.1 Å²	43.1	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-57.9	-52.3	174.1	0	0	0	0	0	113.2	I825 D882 I883 S888	I825-G886 WeakPolarHBondContact CB-O 3.42Å; I825-G886 WeakPolarHBondContact CG2-O 3.3Å; D882-G886 PolarHBondContact O-N 3.32Å; I883-G886 PolarHBondContact O-N 3.48Å; G886-S888 PolarHBondContact O-N 3.49Å; G886-S888 VanDerWaalsContact O-N 3.08Å
887	I	84.4	Confident	85.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-70.1	-1.9	-177.9	68.2	-173.8	0	0	0	114.7	I825 I862 I872 I883 A884 S889 Q890 I891 F896 L898	I825-I887 HydrophobicContact CD1-CB 4.19Å; I825-I887 HydrophobicContact CD1-CG2 3.58Å; I862-I887 HydrophobicContact CD1-CD1 3.62Å; I872-I887 HydrophobicContact CD1-CG2 3.52Å; I883-I887 HydrophobicContact CG2-CG2 4.47Å; I883-I887 WeakPolarHBondContact O-CG1 3.18Å; I883-I887 WeakPolarHBondContact O-CG2 3.43Å; I883-I887 PolarHBondContact O-N 3.24Å; A884-I887 WeakPolarHBondContact O-CG1 3.41Å; I887-S889 VanDerWaalsContact C-N 3.29Å; I887-S889 PolarHBondContact O-N 2.79Å; I887-Q890 WeakPolarHBondContact O-CB 3.09Å; I887-Q890 PolarHBondContact O-N 2.61Å; I887-I891 HydrophobicContact CB-CD1 4.46Å; I887-I891 HydrophobicContact CD1-CD1 3.64Å; I887-I891 HydrophobicContact CG1-CD1 3.77Å; I887-F896 HydrophobicContact CD1-CE2 4.32Å; I887-F896 HydrophobicContact CG1-CE2 4.32Å; I887-F896 HydrophobicContact CG1-CZ 4.18Å; I887-L898 HydrophobicContact CD1-CD1 4.31Å; I887-L898 HydrophobicContact CD1-CD2 4.43Å
888	S	87.6	Confident	86.1	Confident	29 Å²	29	30.9 Å²	30.9	20%	0.203	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-60.8	-30.5	-168.7	62.2	0	0	0	0	115.2	T885 G886 Q890 G938	T885-S888 VanDerWaalsContact O-CB 3.23Å; T885-S888 WeakPolarHBondContact O-CB 3.34Å; T885-S888 PolarHBondContact O-N 3.49Å; T885-S888 PolarHBondContact O-OG 3.25Å; G886-S888 PolarHBondContact O-N 3.49Å; G886-S888 VanDerWaalsContact O-N 3.08Å; S888-Q890 VanDerWaalsContact C-N 3.32Å; S888-G938 WeakPolarHBondContact OG-CA 3.23Å
889	S	78.8	Confident	86.6	Confident	86 Å²	86	30.6 Å²	30.6	60%	0.601	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-78.8	-13.2	174.5	61.6	0	0	0	0	113.9	I825 I887	I825-S889 VanDerWaalsContact CG2-OG 3.31Å; I825-S889 WeakPolarHBondContact CG2-OG 3.24Å; I887-S889 VanDerWaalsContact C-N 3.29Å; I887-S889 PolarHBondContact O-N 2.79Å
890	Q	77.9	Confident	86.6	Confident	33 Å²	33	28.9 Å²	28.9	15%	0.154	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-87.2	-14.7	176.4	-41.3	-145.7	-24	0	0	112.6	I825 H826 I887 S888 P892	I825-Q890 HydrophobicContact CD1-CG 4.28Å; I825-Q890 HydrophobicContact CG2-CG 3.63Å; H826-Q890 PolarHBondContact O-NE2 3.18Å; I887-Q890 WeakPolarHBondContact O-CB 3.09Å; I887-Q890 PolarHBondContact O-N 2.61Å; S888-Q890 VanDerWaalsContact C-N 3.32Å; Q890-P892 WeakPolarHBondContact O-CD 3.31Å
891	I	81.1	Confident	86.2	Confident	9 Å²	9	34.3 Å²	34.3	5%	0.046	21%	0.209	C	C	.	.	S	Bend	trans	-106.2	107.3	-168.8	-67.9	-173.9	0	0	0	109.1	L864 I887 V893 F896	L864-I891 HydrophobicContact CD2-CD1 3.84Å; L864-I891 HydrophobicContact CD2-CG1 3.72Å; I887-I891 HydrophobicContact CB-CD1 4.46Å; I887-I891 HydrophobicContact CD1-CD1 3.64Å; I887-I891 HydrophobicContact CG1-CD1 3.77Å; I891-V893 HydrophobicContact CG2-CG2 3.55Å; I891-V893 PolarHBondContact O-N 2.93Å; I891-F896 HydrophobicContact CB-CD1 4.15Å; I891-F896 HydrophobicContact CB-CE1 3.93Å; I891-F896 HydrophobicContact CB-CZ 4.32Å; I891-F896 HydrophobicContact CD1-CD2 4.01Å; I891-F896 HydrophobicContact CD1-CE1 4.21Å; I891-F896 HydrophobicContact CD1-CE2 3.64Å; I891-F896 HydrophobicContact CD1-CG 4.46Å; I891-F896 HydrophobicContact CD1-CZ 3.75Å; I891-F896 HydrophobicContact CG1-CZ 4.49Å; I891-F896 HydrophobicContact CG2-CB 4.35Å; I891-F896 HydrophobicContact CG2-CD1 3.53Å; I891-F896 HydrophobicContact CG2-CD2 4.41Å; I891-F896 HydrophobicContact CG2-CE1 3.86Å; I891-F896 HydrophobicContact CG2-CG 3.84Å; I891-F896 HydrophobicContact CG2-CZ 4.44Å
892	P	79.8	Confident	86	Confident	129 Å²	129	40.6 Å²	40.6	84%	0.838	24%	0.237	S	C	*	.			trans	-81.1	42.4	-167.8	34.7	-38.5	0	0	0	113.4	Q890	Q890-P892 WeakPolarHBondContact O-CD 3.31Å
893	V	82.6	Confident	85.8	Confident	38 Å²	38	40.3 Å²	40.3	23%	0.23	25%	0.246	C	C	.	.	S	Bend	trans	-133	142.5	176	-66	0	0	0	0	110.7	L865 I891 A895 F896 L923	L865-V893 HydrophobicContact CD1-CB 4.38Å; L865-V893 HydrophobicContact CD1-CG1 3.88Å; L865-V893 HydrophobicContact CD1-CG2 3.66Å; I891-V893 HydrophobicContact CG2-CG2 3.55Å; I891-V893 PolarHBondContact O-N 2.93Å; V893-A895 VanDerWaalsContact C-N 3.26Å; V893-A895 PolarHBondContact O-N 3.26Å; V893-F896 HydrophobicContact CG2-CB 3.97Å; V893-F896 HydrophobicContact CG2-CD1 4.43Å; V893-L923 HydrophobicContact CB-CD2 3.96Å; V893-L923 HydrophobicContact CG1-CD2 3.87Å; V893-L923 HydrophobicContact CG2-CD2 4.1Å
894	P	83	Confident	85.6	Confident	100 Å²	100	45.8 Å²	45.8	65%	0.649	27%	0.271	S	S	*	.	S	Bend	trans	-67.5	-23.2	-168.1	25.6	-35.4	0	0	0	114.2
895	A	90.4	Very high	85.4	Confident	6 Å²	6	50.4 Å²	50.4	5%	0.05	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	131.5	174.1	0	0	0	0	0	111.8	V893 A924 V935 K936	V893-A895 VanDerWaalsContact C-N 3.26Å; V893-A895 PolarHBondContact O-N 3.26Å; A895-A924 VanDerWaalsContact CB-O 3.3Å; A895-A924 WeakPolarHBondContact CB-O 3.32Å; A895-A924 PolarHBondContact O-N 3.24Å; A895-V935 VanDerWaalsContact CA-O 3.32Å; A895-V935 WeakPolarHBondContact CA-O 3.38Å; A895-K936 HydrophobicContact CB-CB 4.06Å; A895-K936 HydrophobicContact CB-CD 4.2Å; A895-K936 HydrophobicContact CB-CG 4.12Å
896	F	92.9	Very high	85.5	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	166.1	-178.2	69.2	-86.7	0	0	0	112.4	A884 I887 I891 V893 L898 T922 R934 V935	A884-F896 HydrophobicContact CB-CE2 4.45Å; A884-F896 WeakPolarHBondContact O-CZ 3.45Å; I887-F896 HydrophobicContact CD1-CE2 4.32Å; I887-F896 HydrophobicContact CG1-CE2 4.32Å; I887-F896 HydrophobicContact CG1-CZ 4.18Å; I891-F896 HydrophobicContact CB-CD1 4.15Å; I891-F896 HydrophobicContact CB-CE1 3.93Å; I891-F896 HydrophobicContact CB-CZ 4.32Å; I891-F896 HydrophobicContact CD1-CD2 4.01Å; I891-F896 HydrophobicContact CD1-CE1 4.21Å; I891-F896 HydrophobicContact CD1-CE2 3.64Å; I891-F896 HydrophobicContact CD1-CG 4.46Å; I891-F896 HydrophobicContact CD1-CZ 3.75Å; I891-F896 HydrophobicContact CG1-CZ 4.49Å; I891-F896 HydrophobicContact CG2-CB 4.35Å; I891-F896 HydrophobicContact CG2-CD1 3.53Å; I891-F896 HydrophobicContact CG2-CD2 4.41Å; I891-F896 HydrophobicContact CG2-CE1 3.86Å; I891-F896 HydrophobicContact CG2-CG 3.84Å; I891-F896 HydrophobicContact CG2-CZ 4.44Å; V893-F896 HydrophobicContact CG2-CB 3.97Å; V893-F896 HydrophobicContact CG2-CD1 4.43Å; F896-L898 HydrophobicContact CD2-CD2 4.48Å; F896-L898 HydrophobicContact CE2-CD2 4.5Å; F896-T922 CarbonylContact C-O 3.6Å; F896-T922 VanDerWaalsContact CA-O 3.24Å; F896-T922 WeakPolarHBondContact CA-O 3.38Å; F896-T922 WeakPolarHBondContact CB-O 3.32Å; F896-R934 CarbonylContact O-C 3.58Å; F896-R934 WeakPolarHBondContact O-CA 3.22Å; F896-R934 VanDerWaalsContact O-CB 3.24Å; F896-R934 WeakPolarHBondContact O-CB 3.31Å; F896-V935 HydrophobicContact CE1-CB 4.03Å; F896-V935 HydrophobicContact CE1-CG1 4.25Å; F896-V935 HydrophobicContact CE2-CB 4.36Å; F896-V935 HydrophobicContact CZ-CB 3.88Å; F896-V935 HydrophobicContact CZ-CG1 4.24Å; F896-V935 HydrophobicContact CZ-CG2 4.46Å; F896-V935 PolarHBondContact N-O 2.87Å; F896-V935 VanDerWaalsContact N-O 3.09Å; F896-V935 PolarHBondContact O-N 3.07Å
897	S	93.7	Very high	86	Confident	8 Å²	8	52.8 Å²	52.8	6%	0.056	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	168.6	172.7	-165.1	0	0	0	0	110.2	T922 W933	S897-T922 PolarHBondContact N-O 2.73Å; S897-T922 PolarHBondContact O-N 3.25Å; S897-W933 VanDerWaalsContact CB-O 3.26Å; S897-W933 WeakPolarHBondContact CB-O 3.26Å; S897-W933 PolarHBondContact OG-O 3.44Å
898	L	93.9	Very high	86.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.5	177.6	-59.4	-177.1	0	0	0	111.3	I862 V880 A884 I887 F896 L919 C921 W933	I862-L898 HydrophobicContact CD1-CD1 4.07Å; I862-L898 HydrophobicContact CG2-CD2 3.84Å; V880-L898 HydrophobicContact CG1-CB 4.18Å; V880-L898 HydrophobicContact CG1-CD1 3.94Å; A884-L898 HydrophobicContact CB-CD1 3.79Å; A884-L898 HydrophobicContact CB-CG 4.2Å; I887-L898 HydrophobicContact CD1-CD1 4.31Å; I887-L898 HydrophobicContact CD1-CD2 4.43Å; F896-L898 HydrophobicContact CD2-CD2 4.48Å; F896-L898 HydrophobicContact CE2-CD2 4.5Å; L898-L919 HydrophobicContact CB-CD1 4.48Å; L898-L919 HydrophobicContact CD1-CD1 4Å; L898-C921 HydrophobicContact CD2-CB 4.23Å; L898-W933 HydrophobicContact CB-CH2 3.86Å; L898-W933 HydrophobicContact CB-CZ2 4.05Å; L898-W933 HydrophobicContact CD1-CH2 4.47Å; L898-W933 HydrophobicContact CG-CH2 4.06Å
899	V	92.6	Very high	86.3	Confident	22 Å²	22	56.9 Å²	56.9	13%	0.133	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	168.3	173.7	-64.6	0	0	0	0	109.7	Q904 L919 Q920 T922	V899-Q904 CarbonylContact C-O 3.56Å; V899-Q904 WeakPolarHBondContact CA-O 3.5Å; V899-Q904 WeakPolarHBondContact CB-O 3.42Å; V899-L919 CarbonylContact O-C 3.56Å; V899-L919 VanDerWaalsContact O-CA 3.25Å; V899-L919 WeakPolarHBondContact O-CA 3.41Å; V899-L919 WeakPolarHBondContact O-CD2 3.35Å; V899-Q920 HydrophobicContact CG2-CB 4.09Å; V899-Q920 WeakPolarHBondContact CG2-O 3.39Å; V899-Q920 PolarHBondContact N-O 3.07Å; V899-Q920 PolarHBondContact O-N 3.01Å; V899-T922 HydrophobicContact CG1-CG2 3.88Å; V899-T922 HydrophobicContact CG2-CG2 4.45Å
900	T	90.9	Very high	86.9	Confident	29 Å²	29	56.6 Å²	56.6	18%	0.178	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	166.1	167.5	71	0	0	0	0	110.8	E902 G903 Q904 V906	T900-E902 WeakPolarHBondContact CB-OE2 3.42Å; T900-E902 PolarHBondContact O-N 3.4Å; T900-E902 VanDerWaalsContact O-N 3.16Å; T900-E902 PolarHBondContact OG1-N 3.45Å; T900-E902 PolarHBondContact OG1-OE2 3Å; T900-G903 WeakPolarHBondContact O-CA 3.27Å; T900-G903 PolarHBondContact O-N 3.22Å; T900-Q904 HydrophobicContact CG2-CB 4.33Å; T900-Q904 PolarHBondContact N-O 3.2Å; T900-Q904 WeakPolarHBondContact OG1-CB 3.11Å; T900-Q904 PolarHBondContact OG1-N 3.48Å; T900-V906 HydrophobicContact CG2-CG2 3.59Å
901	K	82.8	Confident	87.6	Confident	114 Å²	114	59.9 Å²	59.9	50%	0.496	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.5	172.2	-170.4	-178.2	-165.9	166.7	0	113.5	G903 E918	K901-G903 VanDerWaalsContact C-N 3.25Å; K901-G903 PolarHBondContact O-N 3.2Å; K901-E918 HydrophobicContact CD-CB 4.46Å; K901-E918 WeakPolarHBondContact CD-OE2 3.36Å; K901-E918 WeakPolarHBondContact CE-OE2 3.49Å; K901-E918 IonicContact NZ-OE1 3.39Å; K901-E918 IonicContact NZ-OE2 2.64Å; K901-E918 PolarHBondContact NZ-OE2 3.25Å
902	E	83.2	Confident	87.8	Confident	133 Å²	133	59.8 Å²	59.8	62%	0.621	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	13.8	175.4	-55.5	67.5	-146	0	0	112.7	T900 Q904	T900-E902 WeakPolarHBondContact CB-OE2 3.42Å; T900-E902 PolarHBondContact O-N 3.4Å; T900-E902 VanDerWaalsContact O-N 3.16Å; T900-E902 PolarHBondContact OG1-N 3.45Å; T900-E902 PolarHBondContact OG1-OE2 3Å; E902-Q904 HydrophobicContact CB-CG 4.42Å; E902-Q904 PolarHBondContact O-N 3.03Å; E902-Q904 PolarHBondContact O-NE2 3.22Å
903	G	81.1	Confident	88.1	Confident	42 Å²	42	56.1 Å²	56.1	43%	0.433	30%	0.303	S	S	.	.			trans	70.8	9.4	177.7	0	0	0	0	0	115.4	T900 K901	T900-G903 WeakPolarHBondContact O-CA 3.27Å; T900-G903 PolarHBondContact O-N 3.22Å; K901-G903 VanDerWaalsContact C-N 3.25Å; K901-G903 PolarHBondContact O-N 3.2Å
904	Q	85.2	Confident	87.9	Confident	119 Å²	119	59.5 Å²	59.5	56%	0.556	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-77.9	138.2	-177.3	-55.9	-53.5	-62.3	0	0	111	V899 T900 E902 V906	V899-Q904 CarbonylContact C-O 3.56Å; V899-Q904 WeakPolarHBondContact CA-O 3.5Å; V899-Q904 WeakPolarHBondContact CB-O 3.42Å; T900-Q904 HydrophobicContact CG2-CB 4.33Å; T900-Q904 PolarHBondContact N-O 3.2Å; T900-Q904 WeakPolarHBondContact OG1-CB 3.11Å; T900-Q904 PolarHBondContact OG1-N 3.48Å; E902-Q904 HydrophobicContact CB-CG 4.42Å; E902-Q904 PolarHBondContact O-N 3.03Å; E902-Q904 PolarHBondContact O-NE2 3.22Å; Q904-V906 PolarHBondContact O-N 3.3Å
905	P	83.2	Confident	87.8	Confident	97 Å²	97	60.2 Å²	60.2	63%	0.63	33%	0.327	S	S	*	.	B	Isolated β-bridge	trans	-66.4	120.5	-179.9	27.4	-34.1	0	0	0	111.1
906	V	89.6	Confident	87.4	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.055	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-85.8	155.1	170.8	176.8	0	0	0	0	108.7	V880 T900 Q904 M910 L919 W933	V880-V906 HydrophobicContact CB-CG1 4.12Å; V880-V906 HydrophobicContact CG1-CG1 3.85Å; V880-V906 HydrophobicContact CG2-CG1 3.95Å; T900-V906 HydrophobicContact CG2-CG2 3.59Å; Q904-V906 PolarHBondContact O-N 3.3Å; V906-M910 HydrophobicContact CG1-CB 4.2Å; V906-M910 HydrophobicContact CG1-SD 3.83Å; V906-L919 HydrophobicContact CG2-CD2 3.83Å; V906-W933 PolarHBondContact O-NE1 3.35Å
907	H	91.1	Very high	87.3	Confident	100 Å²	100	61.8 Å²	61.8	46%	0.463	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-99	139.1	174	-167.7	-94.1	0	0	0	110.4	D909 M910	H907-D909 VanDerWaalsContact C-N 3.27Å; H907-D909 IonicContact CE1-OD2 2.81Å; H907-D909 PolarHBondContact ND1-N 2.95Å; H907-D909 PolarHBondContact O-N 3.45Å; H907-M910 WeakPolarHBondContact O-CB 3.33Å; H907-M910 PolarHBondContact O-N 3.23Å
908	Y	89.8	Confident	87.2	Confident	54 Å²	54	65.4 Å²	65.4	21%	0.212	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-35.5	-176.4	71	-90.3	0	0	0	113.1	G881 M910 W933 L940 N942	G881-Y908 PolarHBondContact N-O 3.44Å; Y908-M910 PolarHBondContact O-N 3.06Å; Y908-W933 HydrophobicContact CD1-CB 3.99Å; Y908-W933 HydrophobicContact CD1-CG 4.04Å; Y908-W933 HydrophobicContact CG-CG 4.46Å; Y908-L940 HydrophobicContact CD2-CD2 3.57Å; Y908-L940 HydrophobicContact CE2-CD2 4.16Å; Y908-L940 HydrophobicContact CG-CD2 3.92Å; Y908-N942 WeakPolarHBondContact CD1-OD1 3.36Å; Y908-N942 WeakPolarHBondContact CE1-ND2 3.29Å; Y908-N942 WeakPolarHBondContact CE1-OD1 3.37Å; Y908-N942 PolarHBondContact OH-ND2 3.23Å
909	D	88.9	Confident	87.2	Confident	62 Å²	62	65.6 Å²	65.6	33%	0.332	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-1.9	175.7	-80.6	-49.1	0	0	0	114.6	K879 H907 E911	K879-D909 IonicContact NZ-OD1 2.73Å; K879-D909 PolarHBondContact NZ-OD1 3.26Å; H907-D909 VanDerWaalsContact C-N 3.27Å; H907-D909 IonicContact CE1-OD2 2.81Å; H907-D909 PolarHBondContact ND1-N 2.95Å; H907-D909 PolarHBondContact O-N 3.45Å; D909-E911 PolarHBondContact O-N 3.44Å
910	M	91.5	Very high	87.2	Confident	81 Å²	81	67.8 Å²	67.8	40%	0.399	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-66.3	118.7	-179.5	-174.6	169.4	180	0	0	110.6	K879 V880 V906 H907 Y908	K879-M910 WeakPolarHBondContact CA-O 3.14Å; V880-M910 HydrophobicContact CG2-CB 4.37Å; V880-M910 PolarHBondContact N-O 2.76Å; V906-M910 HydrophobicContact CG1-CB 4.2Å; V906-M910 HydrophobicContact CG1-SD 3.83Å; H907-M910 WeakPolarHBondContact O-CB 3.33Å; H907-M910 PolarHBondContact O-N 3.23Å; Y908-M910 PolarHBondContact O-N 3.06Å
911	E	91.4	Very high	87.3	Confident	102 Å²	102	66.6 Å²	66.6	48%	0.477	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-67.4	135.7	168.4	-63.5	-176	-175.9	0	0	109.5	R877 K879 D909	R877-E911 HydrophobicContact CB-CB 4.43Å; R877-E911 HydrophobicContact CB-CG 4.28Å; R877-E911 WeakPolarHBondContact CB-OE2 3.29Å; R877-E911 WeakPolarHBondContact CD-OE2 3.47Å; R877-E911 WeakPolarHBondContact CG-OE2 3.48Å; K879-E911 HydrophobicContact CG-CG 4.4Å; D909-E911 PolarHBondContact O-N 3.44Å
912	V	87.1	Confident	87.7	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.036	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70	130	177.8	-179.6	0	0	0	0	110.1	V858 I860 T878 V880 I883 I917	V858-V912 HydrophobicContact CG1-CG1 3.65Å; I860-V912 HydrophobicContact CD1-CG1 4.45Å; I860-V912 HydrophobicContact CD1-CG2 4.32Å; I860-V912 HydrophobicContact CG1-CB 4.5Å; I860-V912 HydrophobicContact CG1-CG1 3.83Å; I860-V912 HydrophobicContact CG1-CG2 4.1Å; T878-V912 WeakPolarHBondContact O-CG2 3.14Å; T878-V912 PolarHBondContact O-N 3.45Å; V880-V912 HydrophobicContact CG2-CG2 4.14Å; I883-V912 HydrophobicContact CD1-CG2 3.66Å; V912-I917 HydrophobicContact CG1-CB 4.03Å; V912-I917 HydrophobicContact CG1-CG2 3.58Å; V912-I917 HydrophobicContact CG2-CG2 4.22Å
913	P	86.3	Confident	88.1	Confident	52 Å²	52	61.9 Å²	61.9	34%	0.338	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61.4	144.9	176.3	-23	34	0	0	0	112.8	V858 S915 G916	V858-P913 WeakPolarHBondContact CG1-O 3.5Å; P913-S915 PolarHBondContact O-N 3.07Å; P913-G916 WeakPolarHBondContact O-CA 3.28Å; P913-G916 PolarHBondContact O-N 3.44Å
914	D	76.4	Confident	88.4	Confident	110 Å²	110	59.9 Å²	59.9	59%	0.588	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-20	-178.5	-64.2	-48.6	0	0	0	114.2	H876 G916	H876-D914 IonicContact CE1-OD1 2.66Å; H876-D914 IonicContact CG-OD1 2.75Å; H876-D914 IonicContact ND1-OD1 3.87Å; H876-D914 PolarHBondContact ND1-OD1 2.81Å; D914-G916 PolarHBondContact O-N 3.27Å
915	S	81.4	Confident	88.5	Confident	115 Å²	115	57.5 Å²	57.5	80%	0.804	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.6	171.5	54.9	0	0	0	0	114.6	P913	P913-S915 PolarHBondContact O-N 3.07Å
916	G	83.5	Confident	88.4	Confident	15 Å²	15	57 Å²	57	16%	0.155	31%	0.309	C	S	.	.			trans	89.3	173.2	-167	0	0	0	0	0	114	K859 P913 D914	K859-G916 WeakPolarHBondContact O-CA 3.33Å; P913-G916 WeakPolarHBondContact O-CA 3.28Å; P913-G916 PolarHBondContact O-N 3.44Å; D914-G916 PolarHBondContact O-N 3.27Å
917	I	90.3	Very high	87.8	Confident	28 Å²	28	62.7 Å²	62.7	14%	0.144	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	145.5	179.1	-162.7	165.2	0	0	0	111.6	K859 I860 Q861 V912 L919	K859-I917 PolarHBondContact O-N 2.99Å; I860-I917 HydrophobicContact CB-CG2 4.41Å; I860-I917 HydrophobicContact CG1-CG2 4.07Å; I860-I917 HydrophobicContact CG2-CG2 4.04Å; Q861-I917 PolarHBondContact N-O 3.48Å; V912-I917 HydrophobicContact CG1-CB 4.03Å; V912-I917 HydrophobicContact CG1-CG2 3.58Å; V912-I917 HydrophobicContact CG2-CG2 4.22Å; I917-L919 HydrophobicContact CD1-CD2 3.82Å; I917-L919 HydrophobicContact CD1-CG 4.37Å; I917-L919 HydrophobicContact CG1-CD2 4.01Å; I917-L919 HydrophobicContact CG1-CG 4.21Å; I917-L919 HydrophobicContact CG2-CD1 4.18Å; I917-L919 HydrophobicContact CG2-CG 4.11Å
918	E	92.2	Very high	87.2	Confident	84 Å²	84	59.4 Å²	59.4	39%	0.393	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.5	167.4	-62.4	-166.5	-154.7	0	0	110.1	Q861 K901	Q861-E918 HydrophobicContact CB-CG 4.28Å; Q861-E918 WeakPolarHBondContact O-CA 3.19Å; K901-E918 HydrophobicContact CD-CB 4.46Å; K901-E918 WeakPolarHBondContact CD-OE2 3.36Å; K901-E918 WeakPolarHBondContact CE-OE2 3.49Å; K901-E918 IonicContact NZ-OE1 3.39Å; K901-E918 IonicContact NZ-OE2 2.64Å; K901-E918 PolarHBondContact NZ-OE2 3.25Å
919	L	93.4	Very high	86.4	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	162.2	-177.7	-62.3	175.1	0	0	0	110.5	Q861 I862 Q863 V880 L898 V899 V906 I917	Q861-L919 PolarHBondContact O-N 3.03Å; I862-L919 CarbonylContact C-O 3.56Å; I862-L919 WeakPolarHBondContact CA-O 3.3Å; I862-L919 HydrophobicContact CG1-CB 4.34Å; I862-L919 HydrophobicContact CG2-CB 4.46Å; Q863-L919 PolarHBondContact N-O 3.48Å; V880-L919 HydrophobicContact CG1-CD1 3.96Å; V880-L919 HydrophobicContact CG2-CD1 4.25Å; L898-L919 HydrophobicContact CB-CD1 4.48Å; L898-L919 HydrophobicContact CD1-CD1 4Å; V899-L919 CarbonylContact O-C 3.56Å; V899-L919 VanDerWaalsContact O-CA 3.25Å; V899-L919 WeakPolarHBondContact O-CA 3.41Å; V899-L919 WeakPolarHBondContact O-CD2 3.35Å; V906-L919 HydrophobicContact CG2-CD2 3.83Å; I917-L919 HydrophobicContact CD1-CD2 3.82Å; I917-L919 HydrophobicContact CD1-CG 4.37Å; I917-L919 HydrophobicContact CG1-CD2 4.01Å; I917-L919 HydrophobicContact CG1-CG 4.21Å; I917-L919 HydrophobicContact CG2-CD1 4.18Å; I917-L919 HydrophobicContact CG2-CG 4.11Å
920	Q	93.1	Very high	85.7	Confident	68 Å²	68	65.7 Å²	65.7	32%	0.318	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.7	173.7	-175.7	176.5	41.2	0	0	109.9	Q863 V899	Q863-Q920 HydrophobicContact CB-CB 4.46Å; Q863-Q920 HydrophobicContact CB-CG 4.29Å; Q863-Q920 WeakPolarHBondContact O-CA 3.28Å; V899-Q920 HydrophobicContact CG2-CB 4.09Å; V899-Q920 WeakPolarHBondContact CG2-O 3.39Å; V899-Q920 PolarHBondContact N-O 3.07Å; V899-Q920 PolarHBondContact O-N 3.01Å
921	C	92.6	Very high	85.4	Confident	4 Å²	4	62.9 Å²	62.9	3%	0.027	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.8	175	-176.5	0	0	0	0	110.5	Q863 L865 L898	Q863-C921 WeakPolarHBondContact O-CB 3.15Å; Q863-C921 PolarHBondContact O-N 3.43Å; L865-C921 VanDerWaalsContact CD2-O 3.28Å; L865-C921 WeakPolarHBondContact CD2-O 3.35Å; L865-C921 HydrophobicContact CG-CB 4.34Å; L898-C921 HydrophobicContact CD2-CB 4.23Å
922	T	91.3	Very high	85	Confident	57 Å²	57	62.1 Å²	62.1	35%	0.35	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	150	177.9	-167.5	0	0	0	0	112	F896 S897 V899	F896-T922 CarbonylContact C-O 3.6Å; F896-T922 VanDerWaalsContact CA-O 3.24Å; F896-T922 WeakPolarHBondContact CA-O 3.38Å; F896-T922 WeakPolarHBondContact CB-O 3.32Å; S897-T922 PolarHBondContact N-O 2.73Å; S897-T922 PolarHBondContact O-N 3.25Å; V899-T922 HydrophobicContact CG1-CG2 3.88Å; V899-T922 HydrophobicContact CG2-CG2 4.45Å
923	L	90.3	Very high	85.3	Confident	91 Å²	91	62 Å²	62	48%	0.476	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130.5	-177.6	-74.3	169.5	0	0	0	111.6	L865 V893 P925	L865-L923 HydrophobicContact CD1-CD2 3.67Å; L865-L923 HydrophobicContact CD1-CG 3.89Å; L865-L923 HydrophobicContact CD2-CG 4.2Å; V893-L923 HydrophobicContact CB-CD2 3.96Å; V893-L923 HydrophobicContact CG1-CD2 3.87Å; V893-L923 HydrophobicContact CG2-CD2 4.1Å; L923-P925 WeakPolarHBondContact O-CD 3.3Å
924	A	88.8	Confident	85.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.351	C	S	.	.			trans	-123.4	56.3	-178.6	0	0	0	0	0	113.3	A895 W931 R934	A895-A924 VanDerWaalsContact CB-O 3.3Å; A895-A924 WeakPolarHBondContact CB-O 3.32Å; A895-A924 PolarHBondContact O-N 3.24Å; A924-W931 HydrophobicContact CB-CB 3.94Å; A924-W931 HydrophobicContact CB-CD2 4.42Å; A924-W931 HydrophobicContact CB-CG 3.8Å; A924-R934 HydrophobicContact CB-CB 3.56Å; A924-R934 HydrophobicContact CB-CG 4.41Å; A924-R934 WeakPolarHBondContact O-CD 3.32Å; A924-R934 PolarHBondContact O-NH1 3.21Å
925	P	86.5	Confident	86.3	Confident	68 Å²	68	54.9 Å²	54.9	44%	0.442	32%	0.323	S	S	.	.			trans	-68.9	157	-177.2	31	-36.2	0	0	0	112.3	L923 C927 S928 W931	L923-P925 WeakPolarHBondContact O-CD 3.3Å; P925-C927 VanDerWaalsContact C-N 3.27Å; P925-C927 PolarHBondContact O-N 2.84Å; P925-S928 PolarHBondContact O-N 3.34Å; P925-W931 PolarHBondContact O-NE1 3.4Å
926	D	80.6	Confident	86.7	Confident	86 Å²	86	51 Å²	51	46%	0.46	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-40.7	-174.9	-65.3	-26.4	0	0	0	113.4	S928 R934 K936	D926-S928 VanDerWaalsContact C-N 3.33Å; D926-S928 PolarHBondContact O-N 2.95Å; D926-R934 IonicContact OD1-CZ 3.52Å; D926-R934 IonicContact OD1-NH1 3.86Å; D926-R934 PolarHBondContact OD1-NH1 3.22Å; D926-R934 IonicContact OD1-NH2 2.68Å; D926-R934 PolarHBondContact OD1-NH2 2.79Å; D926-K936 IonicContact OD1-NZ 3.84Å; D926-K936 PolarHBondContact OD1-NZ 3.4Å; D926-K936 IonicContact OD2-NZ 3.73Å; D926-K936 PolarHBondContact OD2-NZ 3.34Å
927	C	77.7	Confident	86.7	Confident	130 Å²	130	57.9 Å²	57.9	88%	0.878	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-10.1	-179	-54.3	0	0	0	0	114.3	P925	P925-C927 VanDerWaalsContact C-N 3.27Å; P925-C927 PolarHBondContact O-N 2.84Å
928	S	78.2	Confident	86.2	Confident	30 Å²	30	58 Å²	58	21%	0.21	33%	0.328	C	S	.	.			trans	-81.9	143.7	176.7	-173.7	0	0	0	0	111.1	P925 D926 S930 W931 R943	P925-S928 PolarHBondContact O-N 3.34Å; D926-S928 VanDerWaalsContact C-N 3.33Å; D926-S928 PolarHBondContact O-N 2.95Å; S928-S930 WeakPolarHBondContact OG-CB 3.47Å; S928-S930 PolarHBondContact OG-N 2.98Å; S928-S930 PolarHBondContact OG-OG 3.46Å; S928-W931 PolarHBondContact O-NE1 2.91Å; S928-R943 PolarHBondContact O-NH1 3.23Å; S928-R943 PolarHBondContact O-NH2 2.6Å
929	I	72.7	Confident	85.9	Confident	160 Å²	160	60.9 Å²	60.9	82%	0.821	34%	0.341	S	S	*	.	S	Bend	trans	-97.3	1.8	169.1	57	172.3	0	0	0	112.9	W931	I929-W931 VanDerWaalsContact C-N 3.34Å; I929-W931 PolarHBondContact O-N 2.92Å
930	S	73.5	Confident	85.8	Confident	89 Å²	89	63.6 Å²	63.6	62%	0.622	36%	0.355	S	S	*	.	S	Bend	trans	-78.9	-8.2	-173.8	66.8	0	0	0	0	115.5	S928	S928-S930 WeakPolarHBondContact OG-CB 3.47Å; S928-S930 PolarHBondContact OG-N 2.98Å; S928-S930 PolarHBondContact OG-OG 3.46Å
931	W	85.3	Confident	85.7	Confident	22 Å²	22	63.4 Å²	63.4	8%	0.083	36%	0.355	C	S	.	.			trans	-114.2	135.3	-176.5	62.2	-93.8	0	0	0	111.3	A924 P925 S928 I929 R934 R943	A924-W931 HydrophobicContact CB-CB 3.94Å; A924-W931 HydrophobicContact CB-CD2 4.42Å; A924-W931 HydrophobicContact CB-CG 3.8Å; P925-W931 PolarHBondContact O-NE1 3.4Å; S928-W931 PolarHBondContact O-NE1 2.91Å; I929-W931 VanDerWaalsContact C-N 3.34Å; I929-W931 PolarHBondContact O-N 2.92Å; W931-R934 HydrophobicContact CD2-CB 4.39Å; W931-R934 HydrophobicContact CD2-CG 4.27Å; W931-R934 HydrophobicContact CE3-CB 4.1Å; W931-R934 HydrophobicContact CE3-CG 3.83Å; W931-R934 HydrophobicContact CH2-CG 4.25Å; W931-R934 HydrophobicContact CZ3-CG 3.81Å; W931-R943 VanDerWaalsContact CE2-NH1 3.27Å; W931-R943 HydrophobicContact CE3-CB 4.32Å; W931-R943 HydrophobicContact CH2-CB 4.31Å; W931-R943 HydrophobicContact CH2-CG 4.18Å; W931-R943 HydrophobicContact CZ3-CB 3.8Å; W931-R943 HydrophobicContact CZ3-CG 4.18Å
932	T	84.1	Confident	85.3	Confident	86 Å²	86	66.7 Å²	66.7	53%	0.528	37%	0.372	S	S	.	.	S	Bend	trans	-93.6	-36.2	173.9	49.4	0	0	0	0	111.6	R943	T932-R943 WeakPolarHBondContact O-CB 3.4Å; T932-R943 PolarHBondContact O-N 3.25Å
933	W	92.6	Very high	84.6	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.015	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	161.2	168.9	66.9	-83.6	0	0	0	109.6	V880 A884 S897 L898 V906 Y908 V935 L940 E941 N942	V880-W933 HydrophobicContact CG1-CH2 4.13Å; V880-W933 HydrophobicContact CG1-CZ2 4.12Å; A884-W933 HydrophobicContact CB-CH2 3.82Å; A884-W933 HydrophobicContact CB-CZ3 3.69Å; S897-W933 VanDerWaalsContact CB-O 3.26Å; S897-W933 WeakPolarHBondContact CB-O 3.26Å; S897-W933 PolarHBondContact OG-O 3.44Å; L898-W933 HydrophobicContact CB-CH2 3.86Å; L898-W933 HydrophobicContact CB-CZ2 4.05Å; L898-W933 HydrophobicContact CD1-CH2 4.47Å; L898-W933 HydrophobicContact CG-CH2 4.06Å; V906-W933 PolarHBondContact O-NE1 3.35Å; Y908-W933 HydrophobicContact CD1-CB 3.99Å; Y908-W933 HydrophobicContact CD1-CG 4.04Å; Y908-W933 HydrophobicContact CG-CG 4.46Å; W933-V935 HydrophobicContact CZ3-CG2 4.32Å; W933-L940 HydrophobicContact CE3-CD1 3.52Å; W933-L940 HydrophobicContact CZ3-CD1 3.9Å; W933-E941 CarbonylContact C-O 3.38Å; W933-E941 WeakPolarHBondContact CA-O 3.33Å; W933-N942 WeakPolarHBondContact CB-OD1 3.43Å
934	R	92.6	Very high	83	Confident	11 Å²	11	73.8 Å²	73.8	4%	0.042	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	168.8	177.5	65.6	-177.2	-175.3	176.8	-5.1	111.2	F896 A924 D926 W931 E941	F896-R934 CarbonylContact O-C 3.58Å; F896-R934 WeakPolarHBondContact O-CA 3.22Å; F896-R934 VanDerWaalsContact O-CB 3.24Å; F896-R934 WeakPolarHBondContact O-CB 3.31Å; A924-R934 HydrophobicContact CB-CB 3.56Å; A924-R934 HydrophobicContact CB-CG 4.41Å; A924-R934 WeakPolarHBondContact O-CD 3.32Å; A924-R934 PolarHBondContact O-NH1 3.21Å; D926-R934 IonicContact OD1-CZ 3.52Å; D926-R934 IonicContact OD1-NH1 3.86Å; D926-R934 PolarHBondContact OD1-NH1 3.22Å; D926-R934 IonicContact OD1-NH2 2.68Å; D926-R934 PolarHBondContact OD1-NH2 2.79Å; W931-R934 HydrophobicContact CD2-CB 4.39Å; W931-R934 HydrophobicContact CD2-CG 4.27Å; W931-R934 HydrophobicContact CE3-CB 4.1Å; W931-R934 HydrophobicContact CE3-CG 3.83Å; W931-R934 HydrophobicContact CH2-CG 4.25Å; W931-R934 HydrophobicContact CZ3-CG 3.81Å; R934-E941 HydrophobicContact CG-CB 3.91Å; R934-E941 IonicContact CZ-OE2 3.27Å; R934-E941 PolarHBondContact N-O 3.44Å; R934-E941 IonicContact NE-OE2 2.85Å; R934-E941 PolarHBondContact NE-OE2 2.92Å; R934-E941 IonicContact NH2-OE2 3.45Å; R934-E941 PolarHBondContact NH2-OE2 2.62Å; R934-E941 PolarHBondContact O-N 2.8Å
935	V	92.1	Very high	82.7	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.006	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.9	163.2	-179.5	0	0	0	0	108.8	A884 A895 F896 W933 Q939 L940	A884-V935 HydrophobicContact CB-CG2 3.82Å; A895-V935 VanDerWaalsContact CA-O 3.32Å; A895-V935 WeakPolarHBondContact CA-O 3.38Å; F896-V935 HydrophobicContact CE1-CB 4.03Å; F896-V935 HydrophobicContact CE1-CG1 4.25Å; F896-V935 HydrophobicContact CE2-CB 4.36Å; F896-V935 HydrophobicContact CZ-CB 3.88Å; F896-V935 HydrophobicContact CZ-CG1 4.24Å; F896-V935 HydrophobicContact CZ-CG2 4.46Å; F896-V935 PolarHBondContact N-O 2.87Å; F896-V935 VanDerWaalsContact N-O 3.09Å; F896-V935 PolarHBondContact O-N 3.07Å; W933-V935 HydrophobicContact CZ3-CG2 4.32Å; V935-Q939 WeakPolarHBondContact CA-O 3.45Å; V935-L940 HydrophobicContact CG2-CD1 3.89Å
936	K	89.9	Confident	82.5	Confident	34 Å²	34	77.9 Å²	77.9	15%	0.148	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.1	-179.4	-179.1	168.3	-175.7	-173.6	0	108.8	A895 D926 G938 Q939 E941	A895-K936 HydrophobicContact CB-CB 4.06Å; A895-K936 HydrophobicContact CB-CD 4.2Å; A895-K936 HydrophobicContact CB-CG 4.12Å; D926-K936 IonicContact OD1-NZ 3.84Å; D926-K936 PolarHBondContact OD1-NZ 3.4Å; D926-K936 IonicContact OD2-NZ 3.73Å; D926-K936 PolarHBondContact OD2-NZ 3.34Å; K936-G938 PolarHBondContact O-N 3.34Å; K936-G938 VanDerWaalsContact O-N 3.13Å; K936-Q939 PolarHBondContact N-O 3.03Å; K936-Q939 PolarHBondContact O-N 3.11Å; K936-E941 HydrophobicContact CB-CG 4.43Å; K936-E941 WeakPolarHBondContact CD-OE1 3.28Å
937	H	83.7	Confident	82.6	Confident	159 Å²	159	77.5 Å²	77.5	74%	0.736	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	35.4	-173.5	-48.9	121.8	0	0	0	114.8	Q939	H937-Q939 VanDerWaalsContact C-N 3.31Å; H937-Q939 PolarHBondContact O-N 3.42Å
938	G	79.3	Confident	82.8	Confident	30 Å²	30	74.4 Å²	74.4	31%	0.309	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	14	-177.8	0	0	0	0	0	115.7	T885 S888 K936	T885-G938 WeakPolarHBondContact CG2-O 3.36Å; S888-G938 WeakPolarHBondContact OG-CA 3.23Å; K936-G938 PolarHBondContact O-N 3.34Å; K936-G938 VanDerWaalsContact O-N 3.13Å
939	Q	85	Confident	83.1	Confident	144 Å²	144	77.2 Å²	77.2	67%	0.673	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.4	171.2	-62.3	-171.9	4.2	0	0	111	V935 K936 H937 E941	V935-Q939 WeakPolarHBondContact CA-O 3.45Å; K936-Q939 PolarHBondContact N-O 3.03Å; K936-Q939 PolarHBondContact O-N 3.11Å; H937-Q939 VanDerWaalsContact C-N 3.31Å; H937-Q939 PolarHBondContact O-N 3.42Å; Q939-E941 PolarHBondContact O-N 3.02Å
940	L	91.1	Very high	83.8	Confident	61 Å²	61	71.7 Å²	71.7	32%	0.319	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	115.6	175.7	-171.4	77.3	0	0	0	110	Y908 W933 V935	Y908-L940 HydrophobicContact CD2-CD2 3.57Å; Y908-L940 HydrophobicContact CE2-CD2 4.16Å; Y908-L940 HydrophobicContact CG-CD2 3.92Å; W933-L940 HydrophobicContact CE3-CD1 3.52Å; W933-L940 HydrophobicContact CZ3-CD1 3.9Å; V935-L940 HydrophobicContact CG2-CD1 3.89Å
941	E	90.9	Very high	84.6	Confident	65 Å²	65	70.4 Å²	70.4	30%	0.304	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.4	175.1	-69	-175.9	-176.4	0	0	110.3	W933 R934 K936 Q939	W933-E941 CarbonylContact C-O 3.38Å; W933-E941 WeakPolarHBondContact CA-O 3.33Å; R934-E941 HydrophobicContact CG-CB 3.91Å; R934-E941 IonicContact CZ-OE2 3.27Å; R934-E941 PolarHBondContact N-O 3.44Å; R934-E941 IonicContact NE-OE2 2.85Å; R934-E941 PolarHBondContact NE-OE2 2.92Å; R934-E941 IonicContact NH2-OE2 3.45Å; R934-E941 PolarHBondContact NH2-OE2 2.62Å; R934-E941 PolarHBondContact O-N 2.8Å; K936-E941 HydrophobicContact CB-CG 4.43Å; K936-E941 WeakPolarHBondContact CD-OE1 3.28Å; Q939-E941 PolarHBondContact O-N 3.02Å
942	N	85.7	Confident	84.5	Confident	72 Å²	72	74.2 Å²	74.2	39%	0.385	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.9	173.4	-65.4	-26.6	0	0	0	110.2	Y908 W933	Y908-N942 WeakPolarHBondContact CD1-OD1 3.36Å; Y908-N942 WeakPolarHBondContact CE1-ND2 3.29Å; Y908-N942 WeakPolarHBondContact CE1-OD1 3.37Å; Y908-N942 PolarHBondContact OH-ND2 3.23Å; W933-N942 WeakPolarHBondContact CB-OD1 3.43Å
943	R	75.6	Confident	84.6	Confident	103 Å²	103	73.2 Å²	73.2	39%	0.389	38%	0.382	S	S	.	.			trans	-89.9	125.6	169.1	-139.7	-179.4	-154.6	138.8	3.3	108.8	S928 W931 T932	S928-R943 PolarHBondContact O-NH1 3.23Å; S928-R943 PolarHBondContact O-NH2 2.6Å; W931-R943 VanDerWaalsContact CE2-NH1 3.27Å; W931-R943 HydrophobicContact CE3-CB 4.32Å; W931-R943 HydrophobicContact CH2-CB 4.31Å; W931-R943 HydrophobicContact CH2-CG 4.18Å; W931-R943 HydrophobicContact CZ3-CB 3.8Å; W931-R943 HydrophobicContact CZ3-CG 4.18Å; T932-R943 WeakPolarHBondContact O-CB 3.4Å; T932-R943 PolarHBondContact O-N 3.25Å
944	P	56.1	Low	83.8	Confident	194 Å²	194	79.5 Å²	79.5	100%	1.26	42%	0.415	S	S	*	.			trans	-75.5	0	175	33.7	-36.1	0	0	0	112.5

Retrieved 944 of 944 residues in 185.3 ms (Link to these results)

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