X2JI97_DROME Loading...

Bifid, isoform G

AlphaFold DB , UniProt , Accession X2JI97, Species DROME (Drosophila melanogaster, Fruit fly), Gene bi, Length 971 aa.

						>X2JI97_DROME|X2JI97|bi
MRYDVQELLFHQSAEDPFARFANGMAYHPFLQLTQRPTDFSVSSLLTAGSNNNNSGNTNSGNNNSNSNNNTNSNTNNTNNLVAVSPTGGGAQLSPQSNHSSSNTTTTSNTNNSSSNNNNNNSTHNNNNNHTNNNNNNNNNTSQKQGHHLSTTEEPPSPAGTPPPTIVGLPPIPPPNNNSSSSSSNNSASAAAHPSHHPTAAHHSPSTGAAAPPAGATGLPPPTPPHHLQQQQQQQQHPAPPPPPYFPAAALAALAGSPAGPHPGLYPGGGLRFPPHHPGAHPHAHHLGSAYTTAEDVVLASAVAHQLHPAMRPLRALQPEDDGVVDDPKVTLEGKDLWEKFHKLGTEMVITKSGRQMFPQMKFRVSGLDAKAKYILLLDIVAADDYRYKFHNSRWMVAGKADPEMPKRMYIHPDSPTTGEQWMQKVVSFHKLKLTNNISDKHGFTILNSMHKYQPRFHLVRANDILKLPYSTFRTYVFKETEFIAVTAYQNEKITQLKIDNNPFAKGFRDTGAGKREKNCYRQALMSNRGSDSDKLNPTHVSSSRAPLHLGHAGRPPHLHPHAALLDNQQDDDDKLLDVVGPPQSPLLPLSHSLQQMHAHQHSALAAWFNHLAGAGAGASEHAAAAAANASAEDALRRRLQADADVERDGSDSSCSESVGGSTGGAFRPTSTGSPKEAVGAAAAAAAAGLNPGGGSYPSPNISVGPPIHPSPHLLPYLYPHGLYPPPHLGLLHNPAAAAAMSPAGLNPGLLFNAQLALAAQHPALFGHAYAAAGHTPVSPLQGLKSHRFSPYSLPGSLGSAFDAVTPGSNANRSGDPPGGGGGGLGGGVVENGPRSLSSSPRPRPASHSPPTRPISMSPTTPPSLMKQPRGGGAGAGVAQSQHSPSELKSMEKMVNGLEVQHNGSAAAAAAALQLAEEAAQHHHHTQAHHQQQQHQSHHQQQHHQQPAQPHPHHQTHLHSHHGATTGGTDQ
					

Structure Viewer

Loading PAE data...

(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	33	Very low	32.7	Very low	242 Å²	242	143.9 Å²	143.9	100%	1.192	67%	0.673	S	S	*	*				0	174.8	0	-65.6	-163.8	-68.1	0	0	108.5
2	R	37.8	Very low	32.2	Very low	194 Å²	194	145.6 Å²	145.6	73%	0.732	68%	0.681	S	S	*	*			trans	-62	169.5	149.8	-67.3	-175.9	-177.7	-154.9	8.2	108.7	D4	R2-D4 WeakPolarHBondContact CD-OD2 3.15Å; R2-D4 IonicContact NH1-OD2 3.24Å
3	Y	33.8	Very low	31.7	Very low	150 Å²	150	142.4 Å²	142.4	59%	0.588	68%	0.684	S	S	*	*			cis	-121.7	152.7	30.3	-82.8	-111.3	0	0	0	110.3	V5 P242	Y3-V5 HydrophobicContact CD1-CG2 4.24Å; Y3-P242 HydrophobicContact CD1-CB 4.4Å; Y3-P242 HydrophobicContact CD2-CB 4.21Å; Y3-P242 HydrophobicContact CG-CB 4.12Å
4	D	35.3	Very low	31.6	Very low	104 Å²	104	138.5 Å²	138.5	56%	0.556	69%	0.688	S	S	*	*				60.9	173.3	53.1	-61.5	-49.9	0	0	0	111.9	R2	R2-D4 WeakPolarHBondContact CD-OD2 3.15Å; R2-D4 IonicContact NH1-OD2 3.24Å
5	V	36.1	Very low	31.4	Very low	47 Å²	47	142.2 Å²	142.2	29%	0.285	70%	0.702	S	S	.	*			trans	75.5	120.1	177.3	176.4	0	0	0	0	113.6	Y3	Y3-V5 HydrophobicContact CD1-CG2 4.24Å
6	Q	31.4	Very low	31.3	Very low	139 Å²	139	142.9 Å²	142.9	65%	0.65	71%	0.71	S	S	*	*			cis	-172	172.4	-4.7	-110.9	-15.9	57.4	0	0	105.9
7	E	32.6	Very low	31.8	Very low	133 Å²	133	141.8 Å²	141.8	62%	0.621	72%	0.715	S	S	*	*			cis	-177	-175.3	-8.4	-176.4	178	-113.7	0	0	108.4
8	L	31.5	Very low	31.6	Very low	133 Å²	133	145.3 Å²	145.3	70%	0.696	73%	0.725	S	S	*	*			trans	77.5	143.1	161.2	-49.3	173.2	0	0	0	115.2
9	L	29.8	Very low	31.4	Very low	132 Å²	132	142.5 Å²	142.5	69%	0.691	73%	0.728	S	S	*	*			cis	-147.4	133.2	5.9	-159.3	69.9	0	0	0	112.1
10	F	29.3	Very low	31.4	Very low	157 Å²	157	146.8 Å²	146.8	69%	0.689	73%	0.734	S	S	*	*			trans	40.2	131.4	146.3	-75.4	-131.9	0	0	0	122.5
11	H	28.7	Very low	31.4	Very low	152 Å²	152	148.9 Å²	148.9	70%	0.704	74%	0.739	S	S	*	*			trans	64.7	157.1	139.5	-70.2	-132.3	0	0	0	116.9
12	Q	27.1	Very low	31.2	Very low	164 Å²	164	141 Å²	141	77%	0.766	71%	0.712	S	S	*	*			cis	-149	161.4	5.7	-141.3	164.6	-7.6	0	0	110.8
13	S	26	Very low	30.9	Very low	104 Å²	104	140 Å²	140	73%	0.727	72%	0.722	S	S	*	*			trans	-7.6	143.6	160.9	55.3	0	0	0	0	122
14	A	29.9	Very low	30.7	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	73%	0.728	S	S	*	*			trans	127.1	118.4	130.7	0	0	0	0	0	118.7
15	E	29.3	Very low	30.4	Very low	194 Å²	194	140.1 Å²	140.1	91%	0.907	75%	0.745	S	S	*	*			trans	68.4	167.4	135.3	-63	-168.7	163.5	0	0	123.8
16	D	29.3	Very low	30.1	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	76%	0.764	S	S	*	*			trans	-70.7	141.1	-166.3	-83.8	-54.6	0	0	0	115.9	F18	D16-F18 PolarHBondContact O-N 2.85Å
17	P	39.3	Very low	29.8	Very low	124 Å²	124	144.9 Å²	144.9	81%	0.805	77%	0.771	S	S	*	*			trans	-97	69.9	169.1	37.7	-33.3	0	0	0	112.8
18	F	28	Very low	29.8	Very low	204 Å²	204	146.4 Å²	146.4	90%	0.895	78%	0.778	S	S	*	*			trans	-134.6	34.6	171.1	-123.5	-62.1	0	0	0	115.8	D16	D16-F18 PolarHBondContact O-N 2.85Å
19	A	29.5	Very low	30.7	Very low	93 Å²	93	144.9 Å²	144.9	77%	0.769	78%	0.776	S	S	*	*			trans	-154.3	108.4	167.2	0	0	0	0	0	115.1
20	R	31.4	Very low	30.6	Very low	228 Å²	228	147.1 Å²	147.1	86%	0.86	78%	0.781	S	S	*	*			trans	179.5	133.5	150.4	-101.3	163.6	-166.1	-172.6	5.6	107.4
21	F	30	Very low	30.8	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.833	78%	0.782	S	S	*	*			cis	-133	162.8	11.5	-108.9	-86.8	0	0	0	112.5
22	A	29.8	Very low	31	Very low	77 Å²	77	145.9 Å²	145.9	64%	0.636	78%	0.781	S	S	*	*			trans	-141.3	149.7	159.3	0	0	0	0	0	109.4
23	N	31.1	Very low	31.2	Very low	174 Å²	174	144.9 Å²	144.9	93%	0.93	78%	0.78	S	S	*	*			trans	149.7	156.9	150.3	-77.8	-18.7	0	0	0	113.3
24	G	28.6	Very low	31.5	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	78%	0.782	S	S	*	*			trans	95.7	95.8	179.5	0	0	0	0	0	112.8
25	M	30.1	Very low	31.6	Very low	185 Å²	185	148.8 Å²	148.8	91%	0.911	78%	0.781	S	S	*	*			cis	76.7	119.6	30.8	-73.8	-74.6	-78.5	0	0	116.9
26	A	29.1	Very low	31.6	Very low	83 Å²	83	150.2 Å²	150.2	69%	0.686	78%	0.778	S	S	*	*			trans	94.1	112.6	149.6	0	0	0	0	0	123
27	Y	26.6	Very low	32.1	Very low	204 Å²	204	148.3 Å²	148.3	80%	0.8	77%	0.774	S	S	*	*			trans	59.4	108.7	133.7	-77.5	-100.6	0	0	0	123.5
28	H	31.1	Very low	31.7	Very low	164 Å²	164	149 Å²	149	76%	0.759	78%	0.776	S	S	*	*				53	167.7	112.9	-76.5	-66.1	0	0	0	122.5
29	P	50.2	Low	31.6	Very low	101 Å²	101	146.1 Å²	146.1	66%	0.656	77%	0.77	S	S	*	*			cis	-134.8	-169.6	-8.7	18.9	8.7	0	0	0	115.8
30	F	28.3	Very low	31.6	Very low	179 Å²	179	151.1 Å²	151.1	79%	0.785	77%	0.774	S	S	*	*			trans	111	132.1	146.4	-92.5	-78.2	0	0	0	122.4
31	L	34.1	Very low	31.4	Very low	136 Å²	136	145.3 Å²	145.3	71%	0.712	77%	0.769	S	S	*	*			trans	66.3	144.3	163.5	-57.6	-175.3	0	0	0	119
32	Q	32.4	Very low	31.4	Very low	147 Å²	147	142.8 Å²	142.8	69%	0.687	77%	0.769	S	S	*	*			cis	-169.2	141.8	-29.2	-130.9	-173.1	-10.3	0	0	110
33	L	31.8	Very low	31.3	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	77%	0.773	S	S	*	*			trans	62.9	164.1	158.7	-56.2	158.3	0	0	0	116
34	T	32.5	Very low	31.1	Very low	125 Å²	125	141.5 Å²	141.5	77%	0.767	77%	0.768	S	S	*	*			cis	-142.5	162.9	-5.8	-17.3	0	0	0	0	112.5
35	Q	31.5	Very low	31.2	Very low	150 Å²	150	145.4 Å²	145.4	70%	0.701	77%	0.772	S	S	*	*			trans	-50.8	147	-177.2	-65.5	-171	67.2	0	0	121.4
36	R	29.1	Very low	31.2	Very low	224 Å²	224	144 Å²	144	85%	0.845	77%	0.767	S	S	*	*				83.2	152.4	129.3	-83.3	-177.3	172.5	-179.2	-2	122.6
37	P	39.3	Very low	31.2	Very low	114 Å²	114	146.9 Å²	146.9	74%	0.74	78%	0.777	S	S	*	*			trans	-105.9	178.4	-177.9	43.3	-36.1	0	0	0	113.9
38	T	31.3	Very low	31.2	Very low	138 Å²	138	141.9 Å²	141.9	85%	0.847	78%	0.778	S	S	*	*			trans	-136.7	120.2	165.5	51.2	0	0	0	0	111.6
39	D	26.8	Very low	30.9	Very low	144 Å²	144	137.7 Å²	137.7	77%	0.77	78%	0.779	S	S	*	*			trans	-66.7	161.8	154	-79.7	-71.6	0	0	0	110.6
40	F	28.7	Very low	29.9	Very low	197 Å²	197	139 Å²	139	86%	0.864	79%	0.79	S	S	*	*				-178.4	144.7	114.8	-106.7	-70.5	0	0	0	115
41	S	26.3	Very low	30	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	79%	0.791	S	S	*	*			trans	69.4	128.5	149.1	-67	0	0	0	0	122.1
42	V	30.8	Very low	29.8	Very low	138 Å²	138	137.9 Å²	137.9	84%	0.836	79%	0.793	S	S	*	*			trans	-134.9	148.2	155.4	-179.3	0	0	0	0	107.6
43	S	28.7	Very low	29.8	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	80%	0.8	S	S	*	*			trans	103.7	111	163.7	-43.2	0	0	0	0	118.5
44	S	26.9	Very low	29.6	Very low	118 Å²	118	138.5 Å²	138.5	83%	0.825	80%	0.802	S	S	*	*			trans	177.1	98.1	137.4	-76.7	0	0	0	0	107.1
45	L	30.8	Very low	29.5	Very low	152 Å²	152	137.8 Å²	137.8	80%	0.796	80%	0.802	S	S	*	*				63.9	109.9	75.4	-75.6	171.3	0	0	0	115.8
46	L	29.9	Very low	29.4	Very low	155 Å²	155	134.6 Å²	134.6	81%	0.812	81%	0.81	S	S	*	*			trans	59.5	124.2	145.6	-60.3	170.2	0	0	0	120.2
47	T	27.9	Very low	29.5	Very low	144 Å²	144	131.2 Å²	131.2	88%	0.883	81%	0.809	S	S	*	*				-164.6	156.2	111.3	-78	0	0	0	0	110
48	A	26.4	Very low	29	Very low	99 Å²	99	131.4 Å²	131.4	82%	0.818	81%	0.808	S	S	*	*			trans	-84.2	174.3	177.9	0	0	0	0	0	112.4
49	G	25.9	Very low	28.9	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	81%	0.807	S	S	*	*			trans	177.1	118	171.7	0	0	0	0	0	115.4
50	S	29.6	Very low	28.9	Very low	127 Å²	127	131.1 Å²	131.1	89%	0.888	81%	0.81	S	S	*	*			trans	-55.6	169.7	179	-53.6	0	0	0	0	117.3
51	N	29.3	Very low	28.8	Very low	150 Å²	150	125.1 Å²	125.1	80%	0.802	80%	0.804	S	S	*	*	S	Bend	trans	-50	153.8	170.1	-70.6	-24.5	0	0	0	115.3
52	N	30.9	Very low	28.9	Very low	142 Å²	142	127 Å²	127	76%	0.759	81%	0.806	S	S	*	*			trans	64.1	104.2	153.7	-68.8	-8.2	0	0	0	119.6
53	N	30.7	Very low	28.9	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	80%	0.802	S	S	*	*				23.9	122.8	121	-54.1	-8	0	0	0	118.1
54	N	29.3	Very low	28.9	Very low	148 Å²	148	128.7 Å²	128.7	79%	0.791	80%	0.802	S	S	*	*				-173.9	150.4	91.3	-161.9	17.3	0	0	0	113.2
55	S	30.4	Very low	29.2	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	80%	0.795	S	S	*	*			trans	41.9	136.1	155.4	-72.6	0	0	0	0	123.2
56	G	28.3	Very low	29.2	Very low	84 Å²	84	126.9 Å²	126.9	87%	0.866	79%	0.792	S	S	*	*			trans	155.2	115.2	156	0	0	0	0	0	113.9
57	N	31	Very low	29.3	Very low	152 Å²	152	123.4 Å²	123.4	81%	0.813	78%	0.78	S	S	*	*			trans	-123	164.3	170.1	-168.3	15.2	0	0	0	110.1
58	T	30	Very low	29.5	Very low	119 Å²	119	123.3 Å²	123.3	73%	0.73	77%	0.774	S	S	*	*			trans	70.8	89.9	173.3	61.1	0	0	0	0	118.9
59	N	28.3	Very low	29.7	Very low	156 Å²	156	125 Å²	125	83%	0.834	77%	0.77	S	S	*	*				66.1	110.6	113	-149.7	21.3	0	0	0	121.9
60	S	27.3	Very low	30	Very low	119 Å²	119	127.5 Å²	127.5	83%	0.832	77%	0.765	S	S	*	*			trans	65.3	125.3	145	-152.3	0	0	0	0	120.8
61	G	26.5	Very low	30	Very low	71 Å²	71	127.3 Å²	127.3	73%	0.732	76%	0.758	S	S	*	*			trans	-176.1	18.9	-177.8	0	0	0	0	0	122.9
62	N	28.1	Very low	30.2	Very low	147 Å²	147	126.9 Å²	126.9	79%	0.786	76%	0.756	S	S	*	*			trans	61.8	151.1	163.2	-89.3	-1.7	0	0	0	122.4
63	N	30.1	Very low	30.1	Very low	141 Å²	141	124 Å²	124	75%	0.754	75%	0.747	S	S	*	*			trans	71	137.6	148.3	-69.1	-6.9	0	0	0	120
64	N	30.1	Very low	30.1	Very low	136 Å²	136	123.2 Å²	123.2	73%	0.727	74%	0.743	S	S	*	*			cis	-164.1	154.7	-8.7	-170.5	4.8	0	0	0	111.3
65	S	32.6	Very low	30.3	Very low	96 Å²	96	121.9 Å²	121.9	67%	0.671	74%	0.74	S	S	*	*			trans	70.1	146.8	151.8	-74.1	0	0	0	0	120.7
66	N	31	Very low	30.3	Very low	137 Å²	137	122.9 Å²	122.9	73%	0.733	74%	0.737	S	S	*	*			cis	-169.6	140.7	-16.4	179.8	24.9	0	0	0	111.6
67	S	31.6	Very low	30.4	Very low	81 Å²	81	125.3 Å²	125.3	57%	0.566	73%	0.73	S	S	*	*			trans	61.6	151.6	158.1	-69.5	0	0	0	0	118.9
68	N	32.2	Very low	30.4	Very low	143 Å²	143	122.5 Å²	122.5	77%	0.765	72%	0.719	S	S	*	*			cis	-163.5	-174.2	-15.4	-102.3	-14.2	0	0	0	107
69	N	31.3	Very low	30.4	Very low	135 Å²	135	123.1 Å²	123.1	72%	0.722	72%	0.718	S	S	*	*			cis	-154.4	176	17.1	-155.4	7.6	0	0	0	114
70	N	31	Very low	30.4	Very low	129 Å²	129	121.2 Å²	121.2	69%	0.69	71%	0.707	S	S	*	*			trans	-60.8	167.6	167.4	-75.4	-28.6	0	0	0	115.8
71	T	30.9	Very low	30.2	Very low	122 Å²	122	121.9 Å²	121.9	75%	0.748	70%	0.701	S	S	*	*			cis	-169	166.8	2.9	20.7	0	0	0	0	108.1
72	N	32.3	Very low	30.1	Very low	141 Å²	141	125.5 Å²	125.5	75%	0.754	71%	0.708	S	S	*	*			cis	-175.2	-171.6	-26.1	-170.7	17.7	0	0	0	109.4
73	S	29.7	Very low	29.9	Very low	82 Å²	82	121.8 Å²	121.8	57%	0.573	70%	0.698	S	S	*	*			trans	-35.1	163.2	168.4	66.6	0	0	0	0	118.4
74	N	29.6	Very low	29.6	Very low	138 Å²	138	121.2 Å²	121.2	74%	0.738	70%	0.7	S	S	*	*			cis	-163.7	171.6	37	-154.1	11.8	0	0	0	115.6
75	T	33.1	Very low	29.6	Very low	121 Å²	121	120 Å²	120	74%	0.742	70%	0.702	S	S	*	*			trans	-101.9	154.5	168.6	34.1	0	0	0	0	112.6
76	N	31.6	Very low	30	Very low	130 Å²	130	120.6 Å²	120.6	70%	0.695	70%	0.703	S	S	*	*			trans	-162.1	176.1	160.8	-124.1	-26.9	0	0	0	114.5
77	N	30.6	Very low	30.1	Very low	135 Å²	135	120.6 Å²	120.6	72%	0.722	71%	0.708	S	S	*	*			trans	-133.4	175.4	-165.2	-164.9	2.8	0	0	0	113
78	T	31	Very low	29.9	Very low	94 Å²	94	120.8 Å²	120.8	58%	0.577	72%	0.723	S	S	*	*			trans	70.1	134.9	161.9	52.4	0	0	0	0	121.9
79	N	29.6	Very low	29.7	Very low	132 Å²	132	118 Å²	118	71%	0.706	73%	0.728	S	S	*	*			trans	11.9	152.4	130.3	-49	-17.1	0	0	0	118.5
80	N	27.7	Very low	29.5	Very low	116 Å²	116	115.1 Å²	115.1	62%	0.62	73%	0.73	S	S	*	*			cis	-171.5	169.9	41.4	-154.7	14.5	0	0	0	114.7
81	L	23.6	Very low	29.4	Very low	133 Å²	133	113.9 Å²	113.9	70%	0.696	74%	0.738	S	S	*	*			trans	25.9	125	150	-109.1	67.7	0	0	0	121.7
82	V	24.5	Very low	29.3	Very low	147 Å²	147	116.1 Å²	116.1	89%	0.891	74%	0.74	S	S	*	*				-132.8	144.1	116.8	176.6	0	0	0	0	108
83	A	23.8	Very low	29.1	Very low	69 Å²	69	116 Å²	116	57%	0.57	74%	0.738	S	S	*	*			trans	-134.5	-176	174	0	0	0	0	0	109.4
84	V	24.9	Very low	29.1	Very low	129 Å²	129	117.1 Å²	117.1	78%	0.782	75%	0.747	S	S	*	*			trans	73.4	118.3	-176.7	-157.5	0	0	0	0	110.1
85	S	28.3	Very low	30	Very low	110 Å²	110	116 Å²	116	77%	0.769	75%	0.747	S	S	*	*				69.7	161.1	51	-45.4	0	0	0	0	112.8
86	P	41.2	Very low	29.8	Very low	108 Å²	108	118.1 Å²	118.1	70%	0.701	75%	0.748	S	S	*	*			cis	-129.2	-177.5	-1.8	43.5	-27.8	0	0	0	115
87	T	32.9	Very low	29.8	Very low	138 Å²	138	116.6 Å²	116.6	85%	0.847	75%	0.748	S	S	*	*			trans	12.5	123.8	151.5	56.2	0	0	0	0	121.6
88	G	29.3	Very low	29.8	Very low	84 Å²	84	115.7 Å²	115.7	87%	0.866	74%	0.743	S	S	*	*			trans	174.2	140	151.6	0	0	0	0	0	111.7
89	G	26.8	Very low	29.8	Very low	86 Å²	86	118.7 Å²	118.7	89%	0.887	75%	0.75	S	S	*	*			cis	144.2	58.6	-6	0	0	0	0	0	114.8
90	G	27.8	Very low	29.6	Very low	74 Å²	74	116.5 Å²	116.5	76%	0.763	75%	0.745	S	S	*	*			trans	169.3	135.9	173.2	0	0	0	0	0	116.7
91	A	28.9	Very low	29.6	Very low	103 Å²	103	115.8 Å²	115.8	85%	0.851	75%	0.749	S	S	*	*			trans	20.9	144.9	138.8	0	0	0	0	0	121.4
92	Q	28.1	Very low	29.9	Very low	169 Å²	169	114.2 Å²	114.2	79%	0.79	75%	0.749	S	S	*	*			cis	-171.4	177.5	-10.4	-165	-169.1	4.6	0	0	108.1
93	L	28.9	Very low	30	Very low	137 Å²	137	113.8 Å²	113.8	72%	0.717	74%	0.742	S	S	*	*			trans	88.6	98.5	161.4	-52.2	175.8	0	0	0	117.8
94	S	29.3	Very low	30.1	Very low	107 Å²	107	116.1 Å²	116.1	75%	0.748	75%	0.75	S	S	*	*				39.4	142	104	-56	0	0	0	0	119.6
95	P	47.9	Very low	30.3	Very low	114 Å²	114	115.5 Å²	115.5	74%	0.74	75%	0.746	S	S	*	*			cis	-138.7	-175.8	42.9	38	-18	0	0	0	118
96	Q	29.3	Very low	30.3	Very low	166 Å²	166	116.1 Å²	116.1	78%	0.776	75%	0.745	S	S	*	*			trans	-30.2	167.6	175.7	-78.7	99.9	-53.9	0	0	120.3
97	S	32.4	Very low	29.6	Very low	98 Å²	98	117.2 Å²	117.2	69%	0.685	75%	0.75	S	S	*	*			cis	168.9	174.9	-23.5	73.2	0	0	0	0	107.7
98	N	29.2	Very low	29.6	Very low	115 Å²	115	115.4 Å²	115.4	62%	0.615	74%	0.743	S	S	*	*			cis	-160.9	168.4	-5	-146.5	-19.3	0	0	0	109.7
99	H	30.6	Very low	29.5	Very low	157 Å²	157	118 Å²	118	73%	0.727	74%	0.737	S	S	*	*			trans	62.2	159.1	156.1	-63.5	-40.8	0	0	0	117.8
100	S	26.9	Very low	29.5	Very low	87 Å²	87	118.6 Å²	118.6	61%	0.608	72%	0.724	S	S	*	*			cis	-164.4	166.6	-22.8	-97.4	0	0	0	0	109.6
101	S	27.2	Very low	29.4	Very low	101 Å²	101	121.6 Å²	121.6	71%	0.706	72%	0.722	S	S	*	*			trans	57.5	120.7	145	60.2	0	0	0	0	122.3
102	S	28.7	Very low	29.5	Very low	100 Å²	100	124.3 Å²	124.3	70%	0.699	72%	0.722	S	S	*	*			trans	89.8	142.6	130.5	80.4	0	0	0	0	121.7
103	N	27.2	Very low	29.4	Very low	137 Å²	137	120.6 Å²	120.6	73%	0.733	72%	0.715	S	S	*	*			trans	76.4	125.6	141.4	-72.6	-1.7	0	0	0	123.3
104	T	27.3	Very low	29.3	Very low	119 Å²	119	119.3 Å²	119.3	73%	0.73	72%	0.718	S	S	*	*			trans	76.7	128.9	132.7	52.4	0	0	0	0	122.2
105	T	27.6	Very low	29.3	Very low	116 Å²	116	119 Å²	119	71%	0.712	72%	0.716	S	S	*	*			trans	71.7	103.2	132.9	-56.2	0	0	0	0	119
106	T	28.5	Very low	28.4	Very low	122 Å²	122	120.1 Å²	120.1	75%	0.748	72%	0.715	S	S	*	*				35.7	102.4	122	-37.9	0	0	0	0	118.3
107	T	26.5	Very low	28.5	Very low	132 Å²	132	117.6 Å²	117.6	81%	0.81	71%	0.707	S	S	*	*				-164.8	160.6	106.3	25	0	0	0	0	112.1
108	S	33.1	Very low	28.4	Very low	99 Å²	99	118.2 Å²	118.2	69%	0.692	70%	0.703	S	S	*	*			trans	-61.5	143.8	167.1	50.3	0	0	0	0	112.7
109	N	26.8	Very low	28.5	Very low	140 Å²	140	118.9 Å²	118.9	75%	0.749	71%	0.706	S	S	*	*				-164.4	148.5	120.7	-116.3	-7	0	0	0	117.2
110	T	27.7	Very low	28.6	Very low	98 Å²	98	118.1 Å²	118.1	60%	0.601	71%	0.708	S	S	*	*			trans	55.9	124.8	147.1	52.4	0	0	0	0	122.5
111	N	26.2	Very low	28.7	Very low	137 Å²	137	121.2 Å²	121.2	73%	0.733	72%	0.717	S	S	*	*				65.7	117.9	129.8	-53.3	-3.2	0	0	0	119.3
112	N	29	Very low	28.7	Very low	159 Å²	159	120.4 Å²	120.4	85%	0.85	71%	0.712	S	S	*	*				-141	148.6	92.6	-146	-9.8	0	0	0	112.4
113	S	26.2	Very low	28.7	Very low	92 Å²	92	120.7 Å²	120.7	64%	0.643	71%	0.71	S	S	*	*			trans	-84.4	160.8	177.2	-53.7	0	0	0	0	110.6
114	S	28.1	Very low	28.9	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	71%	0.709	S	S	*	*				179.9	141.5	110.9	-79.8	0	0	0	0	113.7
115	S	29.3	Very low	28.9	Very low	101 Å²	101	122 Å²	122	71%	0.706	71%	0.706	S	S	*	*			trans	66	118	155	-62.9	0	0	0	0	118.1
116	N	28.8	Very low	29	Very low	137 Å²	137	122.4 Å²	122.4	73%	0.733	70%	0.704	S	S	*	*				78.3	142.1	61.9	-73.1	2	0	0	0	112.4
117	N	30.5	Very low	29	Very low	114 Å²	114	123 Å²	123	61%	0.61	70%	0.703	S	S	*	*			cis	-155.4	160.5	13.8	-132.1	-6.5	0	0	0	114.4
118	N	31.2	Very low	29.1	Very low	110 Å²	110	124 Å²	124	59%	0.588	70%	0.703	S	S	*	*			trans	47.4	120.7	142.1	-69.3	-13.5	0	0	0	120.7
119	N	30.3	Very low	28.8	Very low	129 Å²	129	126.5 Å²	126.5	69%	0.69	71%	0.709	S	S	*	*				74.6	125.4	66.3	-64.9	-15.4	0	0	0	114.1
120	N	32.6	Very low	28.9	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	71%	0.71	S	S	*	*				170.9	105.3	110.9	-86.9	-27.8	0	0	0	113.6
121	N	29.7	Very low	28.9	Very low	151 Å²	151	129.5 Å²	129.5	81%	0.807	72%	0.721	S	S	*	*				-172	133.4	106.9	-112.2	2.2	0	0	0	108.4
122	S	28.3	Very low	28.9	Very low	84 Å²	84	129.1 Å²	129.1	59%	0.587	72%	0.719	S	S	*	*			cis	73.5	127.9	26.9	-131.3	0	0	0	0	112.8
123	T	27.5	Very low	28.8	Very low	107 Å²	107	127.4 Å²	127.4	66%	0.656	71%	0.709	S	S	*	*			cis	-166.4	146.5	-4.9	-124.4	0	0	0	0	115.3
124	H	30.8	Very low	29.1	Very low	156 Å²	156	129.2 Å²	129.2	72%	0.722	71%	0.712	S	S	*	*			trans	76.3	154.9	148.1	-83	48.7	0	0	0	125
125	N	28.6	Very low	29.3	Very low	126 Å²	126	130.9 Å²	130.9	67%	0.674	71%	0.712	S	S	*	*			trans	77.5	127.4	154	-69.6	-3.9	0	0	0	119.5
126	N	29.1	Very low	29.6	Very low	125 Å²	125	132.5 Å²	132.5	67%	0.668	71%	0.713	S	S	*	*			cis	-158	162.1	-12	-138.3	-6.9	0	0	0	114.7
127	N	28.3	Very low	29.9	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	71%	0.712	S	S	*	*			trans	59	111.4	157.2	-76.7	-2.2	0	0	0	121.3
128	N	28.7	Very low	30.1	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	72%	0.716	S	S	*	*			trans	-30.1	154.6	132.9	-56.4	-28.9	0	0	0	113
129	N	27.9	Very low	30.2	Very low	152 Å²	152	134 Å²	134	81%	0.813	72%	0.721	S	S	*	*			cis	-154.3	162.6	39.8	-161.8	11.2	0	0	0	113.2
130	H	28.6	Very low	30.2	Very low	167 Å²	167	134.6 Å²	134.6	77%	0.773	73%	0.725	S	S	*	*			trans	-64.8	146.6	166.8	-93.7	18.9	0	0	0	111.8
131	T	26.7	Very low	30	Very low	135 Å²	135	133.3 Å²	133.3	83%	0.828	72%	0.722	S	S	*	*				-163.4	99.4	117.1	-68.8	0	0	0	0	111
132	N	27.1	Very low	29.8	Very low	128 Å²	128	132 Å²	132	68%	0.684	73%	0.725	S	S	*	*			trans	43.3	128.1	133	-138.2	17	0	0	0	124.1
133	N	27.3	Very low	30	Very low	123 Å²	123	136.8 Å²	136.8	66%	0.658	74%	0.738	S	S	*	*			trans	83.6	141.1	134.7	-93.9	-7.6	0	0	0	126
134	N	30.7	Very low	30.2	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	74%	0.744	S	S	*	*			trans	69.6	94	146.3	-66.8	-12.3	0	0	0	123.5
135	N	33.3	Very low	30.3	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	75%	0.75	S	S	*	*				35.2	143.9	110.4	-78.8	-5.5	0	0	0	123.5
136	N	34.6	Very low	30.4	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	76%	0.755	S	S	*	*			trans	90.9	103.2	147.4	-72.1	-1.2	0	0	0	121.7
137	N	35.6	Very low	30.9	Very low	133 Å²	133	142.3 Å²	142.3	71%	0.711	77%	0.765	S	S	*	*				49.3	119.1	117.8	-70.7	7	0	0	0	122.5
138	N	36	Very low	31.3	Very low	130 Å²	130	143.6 Å²	143.6	70%	0.695	77%	0.766	S	S	*	*				89.8	124.8	122.2	-71.2	9.4	0	0	0	122.9
139	N	32.7	Very low	31.6	Very low	129 Å²	129	142.7 Å²	142.7	69%	0.69	76%	0.761	S	S	*	*				103.3	131.7	129.7	-76.2	5.9	0	0	0	121.5
140	N	29.4	Very low	31.8	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	75%	0.753	S	S	*	*			trans	66.5	160.6	155	-56.3	-14.2	0	0	0	116.1
141	T	28.8	Very low	32	Very low	114 Å²	114	137.7 Å²	137.7	70%	0.699	75%	0.752	S	S	*	*			cis	-144	150.5	5.8	-33.2	0	0	0	0	110.7	Q143	T141-Q143 HydrophobicContact CG2-CG 4.38Å
142	S	24.9	Very low	32.3	Very low	125 Å²	125	136.7 Å²	136.7	87%	0.874	75%	0.745	S	S	*	*			trans	-103.1	98.4	154.4	-67	0	0	0	0	110.2
143	Q	33.3	Very low	32.6	Very low	184 Å²	184	138.8 Å²	138.8	86%	0.86	75%	0.751	S	S	*	*			trans	-134.6	163.2	157.3	-79	-158.1	-8.1	0	0	110	T141	T141-Q143 HydrophobicContact CG2-CG 4.38Å
144	K	31.3	Very low	32.9	Very low	182 Å²	182	141.5 Å²	141.5	79%	0.791	76%	0.76	S	S	*	*			trans	-74	143.7	-164.8	-72.5	179.3	173.9	-179.9	0	113.8
145	Q	33.4	Very low	34.3	Very low	182 Å²	182	140 Å²	140	85%	0.85	76%	0.757	S	S	*	*			trans	47.5	113.7	136.9	-62	170	-52.4	0	0	119
146	G	30.3	Very low	35.2	Very low	75 Å²	75	138.2 Å²	138.2	77%	0.773	75%	0.754	S	S	*	*			trans	-175.3	146.8	163.7	0	0	0	0	0	111.7
147	H	40.8	Very low	35.3	Very low	191 Å²	191	136.8 Å²	136.8	88%	0.884	75%	0.754	S	S	*	*			trans	-116	152.2	178.6	-81.1	-114.8	0	0	0	111.7
148	H	36.4	Very low	36.2	Very low	162 Å²	162	136 Å²	136	75%	0.75	76%	0.756	S	S	*	*			trans	84.2	111.5	147.8	-122.8	-117.1	0	0	0	122.3
149	L	34.3	Very low	36.3	Very low	133 Å²	133	135 Å²	135	70%	0.696	77%	0.767	S	S	*	*			trans	62.1	124.2	136.6	-94.6	65.5	0	0	0	125.5
150	S	31.3	Very low	36.3	Very low	92 Å²	92	131.9 Å²	131.9	64%	0.643	76%	0.764	S	S	*	*				91.9	116.9	124.3	-67.6	0	0	0	0	125.7
151	T	32.8	Very low	36.4	Very low	121 Å²	121	132.2 Å²	132.2	74%	0.742	77%	0.772	S	S	*	*				85.3	127	126.2	54.7	0	0	0	0	126.2
152	T	33.6	Very low	37.5	Very low	114 Å²	114	132.2 Å²	132.2	70%	0.699	77%	0.774	S	S	*	*			trans	79	113.7	137.3	46.4	0	0	0	0	125.9
153	E	34.3	Very low	39.3	Very low	172 Å²	172	131.5 Å²	131.5	80%	0.804	77%	0.766	S	S	*	*				80.1	120.2	121.5	-69.8	178	145.9	0	0	127
154	E	33.8	Very low	40.5	Very low	180 Å²	180	127.4 Å²	127.4	84%	0.841	76%	0.755	S	S	*	*			trans	72.8	156.9	132.4	-70.9	-114.4	87	0	0	125.2
155	P	58.6	Low	40.9	Very low	100 Å²	100	124.7 Å²	124.7	65%	0.649	75%	0.754	S	S	*	*			trans	-124.3	-141	-160.7	45.3	-27.9	0	0	0	112.6
156	P	53	Low	41.3	Very low	106 Å²	106	123.1 Å²	123.1	69%	0.688	75%	0.75	S	S	*	*			cis	-140.4	-173.5	-17.7	38.2	-17.1	0	0	0	117.8
157	S	37.6	Very low	41.4	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	75%	0.753	S	S	*	*			trans	85.9	179.1	149.6	-52.9	0	0	0	0	120.1
158	P	54.3	Low	41.2	Very low	116 Å²	116	119.7 Å²	119.7	75%	0.753	74%	0.739	S	S	*	*				-141.8	178.5	-76.8	44.9	-28.2	0	0	0	118
159	A	36.5	Very low	41.3	Very low	110 Å²	110	120.1 Å²	120.1	91%	0.909	75%	0.746	S	S	*	*			trans	67.8	165.2	162.3	0	0	0	0	0	118.6
160	G	32.7	Very low	43	Very low	62 Å²	62	118.9 Å²	118.9	64%	0.639	75%	0.745	S	S	*	*			cis	169.4	178.2	-8.5	0	0	0	0	0	114.4
161	T	32.8	Very low	44.3	Very low	149 Å²	149	120.5 Å²	120.5	91%	0.914	75%	0.754	S	S	*	*			trans	75.4	161.3	163.1	45.1	0	0	0	0	123
162	P	51.7	Low	44.5	Very low	114 Å²	114	122.1 Å²	122.1	74%	0.74	76%	0.757	S	S	*	*			trans	-131.3	-134.4	-162.4	44.3	-22.5	0	0	0	112.5
163	P	62.3	Low	46	Very low	111 Å²	111	122.1 Å²	122.1	72%	0.721	76%	0.759	S	S	*	*			cis	-126	-36.2	-29.5	28.1	-14.3	0	0	0	126.9
164	P	58.6	Low	47.6	Very low	97 Å²	97	119.3 Å²	119.3	63%	0.63	76%	0.755	S	S	*	*				-136.7	167.3	-120.5	40	-21.8	0	0	0	122.3
165	T	40.3	Very low	48.9	Very low	125 Å²	125	116 Å²	116	77%	0.767	75%	0.749	S	S	*	*			trans	74.3	150	143.7	37.1	0	0	0	0	122.4
166	I	41	Very low	48.1	Very low	150 Å²	150	118.1 Å²	118.1	77%	0.769	76%	0.755	S	S	*	*			cis	-159.1	156.8	-13.6	-155.6	165.8	0	0	0	112.6
167	V	33.3	Very low	47.2	Very low	137 Å²	137	119.2 Å²	119.2	83%	0.83	76%	0.755	S	S	*	*			trans	176.8	151	146.9	138.6	0	0	0	0	108.3
168	G	36.3	Very low	46.9	Very low	57 Å²	57	120.8 Å²	120.8	59%	0.588	76%	0.755	S	S	*	*			cis	132.2	135.7	-11.6	0	0	0	0	0	114.1
169	L	38.2	Very low	45.8	Very low	170 Å²	170	120.4 Å²	120.4	89%	0.89	76%	0.755	S	S	*	*			cis	-154.2	131.9	-16.1	-74.9	175.4	0	0	0	108.7
170	P	69.9	Low	45.4	Very low	107 Å²	107	120 Å²	120	70%	0.695	75%	0.746	S	S	*	*			trans	-114	155.3	-175.4	39.3	-33	0	0	0	116.8
171	P	58	Low	45.2	Very low	127 Å²	127	121.9 Å²	121.9	83%	0.825	75%	0.749	S	S	*	*			trans	-90.1	159.1	169.1	36.6	-34.3	0	0	0	113.5
172	I	38.7	Very low	45	Very low	155 Å²	155	119.8 Å²	119.8	80%	0.795	74%	0.741	S	S	*	*			trans	-139	-57.9	-168.7	-69.5	166.6	0	0	0	118
173	P	64.8	Low	43.9	Very low	114 Å²	114	119.2 Å²	119.2	74%	0.74	74%	0.74	S	S	*	*			trans	-91.7	176.4	-162.6	38.2	-38.3	0	0	0	113.8
174	P	66.2	Low	42.4	Very low	112 Å²	112	118.6 Å²	118.6	73%	0.727	74%	0.738	S	S	*	*			cis	-127.4	-145.4	8.7	44.7	-25.8	0	0	0	111.6
175	P	62.8	Low	41.1	Very low	111 Å²	111	120.7 Å²	120.7	72%	0.721	74%	0.744	S	S	*	*			cis	-136.9	88.1	-12.5	36.1	-12.3	0	0	0	116.4
176	N	40.4	Very low	40.7	Very low	144 Å²	144	122 Å²	122	77%	0.77	75%	0.746	S	S	*	*			trans	26.2	137.4	139.3	-66.4	8.5	0	0	0	125.9
177	N	35.1	Very low	40.2	Very low	130 Å²	130	120.3 Å²	120.3	70%	0.695	75%	0.748	S	S	*	*				96.7	125.2	124.3	-80	12.1	0	0	0	125.6
178	N	31	Very low	40	Very low	138 Å²	138	117.6 Å²	117.6	74%	0.738	74%	0.739	S	S	*	*			trans	83.7	139.1	131.8	-76.6	0.9	0	0	0	125.5
179	S	30.5	Very low	39.8	Very low	109 Å²	109	120.8 Å²	120.8	76%	0.762	75%	0.752	S	S	*	*			trans	85	115.7	142.8	55.4	0	0	0	0	123.4
180	S	29.1	Very low	39.5	Very low	102 Å²	102	117.3 Å²	117.3	71%	0.713	75%	0.749	S	S	*	*			trans	42	126.9	134.3	62.5	0	0	0	0	124.4
181	S	28.3	Very low	37.6	Very low	101 Å²	101	117.1 Å²	117.1	71%	0.706	76%	0.756	S	S	*	*			trans	69.3	131	133.8	61.1	0	0	0	0	123.4
182	S	28.7	Very low	36.5	Very low	105 Å²	105	115.4 Å²	115.4	73%	0.734	75%	0.753	S	S	*	*			trans	73.5	137.3	143.2	51.2	0	0	0	0	123.1
183	S	29.1	Very low	36.2	Very low	102 Å²	102	116.3 Å²	116.3	71%	0.713	75%	0.753	S	S	*	*			trans	67.5	105.2	144.8	55	0	0	0	0	122.8
184	S	30.9	Very low	35.4	Very low	98 Å²	98	116.2 Å²	116.2	69%	0.685	75%	0.753	S	S	*	*				69.3	121.1	124.4	66.7	0	0	0	0	124
185	N	30.6	Very low	33.9	Very low	141 Å²	141	115 Å²	115	75%	0.754	75%	0.747	S	S	*	*			trans	77.3	125.4	133.5	-62.5	-5.1	0	0	0	122.6
186	N	31.3	Very low	32.6	Very low	153 Å²	153	118.1 Å²	118.1	82%	0.818	75%	0.751	S	S	*	*			trans	65.6	143.4	151.6	-59.2	-15.2	0	0	0	118.2
187	S	30.6	Very low	32.3	Very low	114 Å²	114	118.5 Å²	118.5	80%	0.797	75%	0.748	S	S	*	*			cis	-171.1	178.5	-15.2	61.2	0	0	0	0	107.3
188	A	29.5	Very low	33	Very low	80 Å²	80	117.2 Å²	117.2	66%	0.661	75%	0.747	S	S	*	*			cis	-158.5	-179	7	0	0	0	0	0	110.5
189	S	31.4	Very low	33	Very low	123 Å²	123	116 Å²	116	86%	0.86	74%	0.744	S	S	*	*			trans	72.8	146	162.7	83.7	0	0	0	0	117.2
190	A	31.8	Very low	32.9	Very low	98 Å²	98	115.5 Å²	115.5	81%	0.81	75%	0.747	S	S	*	*			cis	-151.9	143.4	-1.1	0	0	0	0	0	112.5
191	A	31.4	Very low	32.9	Very low	102 Å²	102	114.7 Å²	114.7	84%	0.843	75%	0.746	S	S	*	*			trans	-179.1	156.1	151.1	0	0	0	0	0	113.5
192	A	34.4	Very low	32.9	Very low	92 Å²	92	117.5 Å²	117.5	76%	0.76	75%	0.748	S	S	*	*			trans	65.5	95.3	155.4	0	0	0	0	0	122.3
193	H	32	Very low	33.1	Very low	174 Å²	174	120.7 Å²	120.7	81%	0.806	75%	0.751	S	S	*	*			trans	178.5	152.5	132.6	-103.9	-65.4	0	0	0	111.2
194	P	48.2	Very low	33.2	Very low	112 Å²	112	118.1 Å²	118.1	73%	0.727	73%	0.733	S	S	*	*				-126.2	165.7	91.6	6.4	17.1	0	0	0	112.3
195	S	35.7	Very low	33.9	Very low	87 Å²	87	119.2 Å²	119.2	61%	0.608	74%	0.738	S	S	*	*			cis	82.7	134.7	34.5	-48.1	0	0	0	0	113.1
196	H	33.8	Very low	33.8	Very low	175 Å²	175	117 Å²	117	81%	0.81	73%	0.733	S	S	*	*			cis	-139.3	155.3	19.6	-75.3	-84.4	0	0	0	111.4
197	H	34.2	Very low	33.9	Very low	153 Å²	153	116.7 Å²	116.7	71%	0.708	74%	0.737	S	S	*	*				70.9	148.4	79.2	-130.5	-123.9	0	0	0	115.2
198	P	51	Low	33.8	Very low	103 Å²	103	114.7 Å²	114.7	67%	0.669	74%	0.735	S	S	*	*			cis	-144.7	155	25.5	44.3	-24.2	0	0	0	122.1
199	T	29.7	Very low	33.8	Very low	112 Å²	112	115.8 Å²	115.8	69%	0.687	74%	0.744	S	S	*	*			trans	53.3	127.8	140.4	59.5	0	0	0	0	125
200	A	28.7	Very low	33.7	Very low	98 Å²	98	115.2 Å²	115.2	81%	0.81	75%	0.746	S	S	*	*				137.9	147.1	111.6	0	0	0	0	0	118.9
201	A	28.8	Very low	33.5	Very low	85 Å²	85	115 Å²	115	70%	0.702	74%	0.744	S	S	*	*			trans	73.2	119.7	141	0	0	0	0	0	125.3
202	H	29.8	Very low	34.7	Very low	160 Å²	160	115.8 Å²	115.8	74%	0.741	74%	0.741	S	S	*	*				47.9	127.1	126.2	-65.3	-87.6	0	0	0	125.2
203	H	31.8	Very low	35.4	Very low	173 Å²	173	117.2 Å²	117.2	80%	0.801	74%	0.743	S	S	*	*				74.6	146.1	128.1	-68.9	-156.3	0	0	0	123
204	S	32.8	Very low	35.2	Very low	47 Å²	47	113.8 Å²	113.8	33%	0.329	74%	0.744	S	S	.	*			trans	-71.6	160	155.5	-63.6	0	0	0	0	111.4	T956	S204-T956 WeakPolarHBondContact OG-CB 3.34Å; S204-T956 PolarHBondContact OG-OG1 3.1Å
205	P	45.2	Very low	34.3	Very low	121 Å²	121	111.6 Å²	111.6	79%	0.786	74%	0.742	S	S	*	*				-148.8	-127.2	73.2	41	-18.3	0	0	0	115.3
206	S	28.8	Very low	34.1	Very low	94 Å²	94	112 Å²	112	66%	0.657	75%	0.751	S	S	*	*			trans	-148.5	-176.9	-141.7	58.3	0	0	0	0	114.9
207	T	31.6	Very low	34	Very low	147 Å²	147	110.6 Å²	110.6	90%	0.902	76%	0.755	S	S	*	*			trans	78.9	151.6	160.5	59.7	0	0	0	0	120.9
208	G	29.9	Very low	33.8	Very low	73 Å²	73	106.8 Å²	106.8	75%	0.753	76%	0.756	S	S	*	*			trans	133	93.2	-176.7	0	0	0	0	0	110.8
209	A	28.6	Very low	32.8	Very low	103 Å²	103	110 Å²	110	85%	0.851	77%	0.767	S	S	*	*			cis	97.9	148.2	28.3	0	0	0	0	0	114.6
210	A	29.3	Very low	33.9	Very low	110 Å²	110	110.2 Å²	110.2	91%	0.909	77%	0.77	S	S	*	*			trans	77.8	144.2	176.7	0	0	0	0	0	119.5
211	A	28.2	Very low	35.3	Very low	93 Å²	93	111 Å²	111	77%	0.769	77%	0.768	S	S	*	*			trans	-142.6	-158.4	176.5	0	0	0	0	0	106.9
212	P	55.9	Low	36.2	Very low	119 Å²	119	112.4 Å²	112.4	77%	0.773	77%	0.769	S	S	*	*			cis	-97	-94	11.2	16.9	6.1	0	0	0	113.3
213	P	48.4	Very low	36.3	Very low	123 Å²	123	110.8 Å²	110.8	80%	0.799	77%	0.771	S	S	*	*			cis	-99.5	-155.3	-0.7	42.6	-36.1	0	0	0	113.4
214	A	29.6	Very low	37.3	Very low	102 Å²	102	108.1 Å²	108.1	84%	0.843	77%	0.769	S	S	*	*			trans	-108.2	161.6	-176.6	0	0	0	0	0	112.7
215	G	28.3	Very low	38.4	Very low	66 Å²	66	110.4 Å²	110.4	68%	0.68	78%	0.783	S	S	*	*			cis	159.8	-168.3	-4.5	0	0	0	0	0	112.7
216	A	30.8	Very low	38.1	Very low	96 Å²	96	112.3 Å²	112.3	79%	0.793	78%	0.781	S	S	*	*			trans	67.5	149.1	174.3	0	0	0	0	0	116.5
217	T	31.9	Very low	38.4	Very low	145 Å²	145	115.2 Å²	115.2	89%	0.89	78%	0.783	S	S	*	*			cis	-165.4	156.3	-13.6	18.2	0	0	0	0	108.5
218	G	30.7	Very low	38.4	Very low	72 Å²	72	113.3 Å²	113.3	74%	0.742	77%	0.767	S	S	*	*			trans	133.9	124.7	153.7	0	0	0	0	0	117.7
219	L	30.7	Very low	38.6	Very low	172 Å²	172	115.8 Å²	115.8	90%	0.901	76%	0.759	S	S	*	*			trans	-116.3	-159.8	157.9	-67.6	167.8	0	0	0	107.8
220	P	52.1	Low	38.9	Very low	115 Å²	115	117.2 Å²	117.2	75%	0.747	75%	0.748	S	S	*	*				-110.9	-161.6	-105.7	39.9	-21.7	0	0	0	112.5
221	P	57.9	Low	39.3	Very low	116 Å²	116	118.3 Å²	118.3	75%	0.753	74%	0.735	S	S	*	*			cis	-111.8	-102.5	-8	24.6	1	0	0	0	112.8
222	P	47.9	Very low	39.7	Very low	113 Å²	113	120.3 Å²	120.3	73%	0.734	73%	0.728	S	S	*	*			cis	-117.8	-170	2.1	43.8	-29.6	0	0	0	115.2
223	T	31.8	Very low	38.7	Very low	127 Å²	127	121.2 Å²	121.2	78%	0.779	72%	0.722	S	S	*	*			trans	-149.9	-175.3	173.6	54	0	0	0	0	108.6
224	P	53.7	Low	38	Very low	117 Å²	117	121.8 Å²	121.8	76%	0.76	71%	0.714	S	S	*	*			cis	-116.6	-116.3	-5.6	24.3	3.2	0	0	0	109.3
225	P	55.4	Low	38.3	Very low	95 Å²	95	123.7 Å²	123.7	62%	0.617	71%	0.706	S	S	*	*			cis	-137.6	152	-28.7	37	-17.5	0	0	0	118.4
226	H	38.5	Very low	38.5	Very low	160 Å²	160	127.5 Å²	127.5	74%	0.741	71%	0.706	S	S	*	*			trans	63.3	154.2	149.1	-72.4	-45.1	0	0	0	120.8
227	H	36	Very low	38.8	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.718	71%	0.708	S	S	*	*			cis	-156.5	156.9	14.8	-132	44.2	0	0	0	107
228	L	30	Very low	39.2	Very low	107 Å²	107	131.1 Å²	131.1	56%	0.56	71%	0.707	S	S	*	*			cis	-172.8	154.2	-13.1	-170.2	70.2	0	0	0	109
229	Q	34.6	Very low	39.3	Very low	126 Å²	126	132 Å²	132	59%	0.589	71%	0.707	S	S	*	*			trans	64	147.8	152.8	-89.3	12.2	38.1	0	0	121
230	Q	35.9	Very low	40.2	Very low	132 Å²	132	128.4 Å²	128.4	62%	0.617	69%	0.694	S	S	*	*			cis	-159.9	138.6	-9.8	-149.9	164	-1.7	0	0	112.6
231	Q	36	Very low	39.7	Very low	134 Å²	134	127.3 Å²	127.3	63%	0.626	69%	0.687	S	S	*	*			trans	33.4	147.8	139.4	-58.6	176	-53.2	0	0	121.7
232	Q	36.4	Very low	39.1	Very low	135 Å²	135	126.1 Å²	126.1	63%	0.631	68%	0.679	S	S	*	*			cis	-167.2	-171.1	0.7	-117.4	166.8	-148.7	0	0	108.9
233	Q	35.6	Very low	39.2	Very low	138 Å²	138	125.4 Å²	125.4	65%	0.645	68%	0.675	S	S	*	*			cis	-145.3	-80.1	12.9	-151.4	157.7	-54.2	0	0	118.2
234	Q	35	Very low	39.7	Very low	134 Å²	134	125.7 Å²	125.7	63%	0.626	68%	0.679	S	S	*	*			trans	-162.9	157.1	-147.8	-93.7	-179.6	-77.9	0	0	110.4
235	Q	35.9	Very low	38.5	Very low	143 Å²	143	131 Å²	131	67%	0.668	69%	0.685	S	S	*	*			cis	-162.8	-159.3	-17.2	-127.5	179.7	-12.9	0	0	106.6
236	Q	31	Very low	37.5	Very low	146 Å²	146	135.6 Å²	135.6	68%	0.682	70%	0.696	S	S	*	*			cis	-154.9	166.7	11.1	-148.8	157.7	74.5	0	0	111
237	H	36.8	Very low	37.7	Very low	181 Å²	181	133.7 Å²	133.7	84%	0.838	70%	0.698	S	S	*	*			trans	-145.4	163.4	172.4	-73	-84.2	0	0	0	109.8
238	P	40.7	Very low	37.3	Very low	135 Å²	135	130.9 Å²	130.9	88%	0.877	70%	0.701	S	S	*	*				-148.5	-176.9	104.6	37.2	-18.7	0	0	0	116.1
239	A	33.5	Very low	37.1	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	72%	0.716	S	S	*	*			trans	-156	-174.5	179.3	0	0	0	0	0	109.8
240	P	49.2	Very low	36.7	Very low	97 Å²	97	128.7 Å²	128.7	63%	0.63	72%	0.72	S	S	*	*			cis	-110.9	-107.4	-13.3	34.5	-12.5	0	0	0	111
241	P	42.3	Very low	36.4	Very low	92 Å²	92	130.8 Å²	130.8	60%	0.597	74%	0.735	S	S	*	*			cis	-126.8	-178.7	-7.3	44.7	-27.7	0	0	0	116.3
242	P	44.2	Very low	35.9	Very low	91 Å²	91	128.7 Å²	128.7	59%	0.591	74%	0.74	S	S	*	*			trans	-106.1	158.2	-173.2	35.9	-27.6	0	0	0	118.6	Y3	Y3-P242 HydrophobicContact CD1-CB 4.4Å; Y3-P242 HydrophobicContact CD2-CB 4.21Å; Y3-P242 HydrophobicContact CG-CB 4.12Å
243	P	50.6	Low	35.5	Very low	99 Å²	99	126.5 Å²	126.5	64%	0.643	75%	0.746	S	S	*	*			trans	-113.7	-179.9	-170.8	43.6	-36.5	0	0	0	117.8
244	P	43.3	Very low	35.1	Very low	132 Å²	132	127.7 Å²	127.7	86%	0.857	76%	0.756	S	S	*	*			trans	-114.5	-137.3	-168.7	43.4	-32.8	0	0	0	117.9
245	Y	28.1	Very low	34.8	Very low	228 Å²	228	126.2 Å²	126.2	89%	0.894	77%	0.766	S	S	*	*			trans	-117.1	170.2	-156.9	-105.2	-103.4	0	0	0	117.4
246	F	34.3	Very low	34.3	Very low	192 Å²	192	122.9 Å²	122.9	84%	0.842	77%	0.771	S	S	*	*			trans	-52.7	157.2	167.3	-78.2	-83	0	0	0	115.8
247	P	42.8	Very low	34.2	Very low	120 Å²	120	121.8 Å²	121.8	78%	0.779	78%	0.779	S	S	*	*				-159.7	159.9	75.4	42.8	-21.2	0	0	0	122
248	A	26.1	Very low	34.9	Very low	96 Å²	96	119.1 Å²	119.1	79%	0.793	78%	0.777	S	S	*	*			trans	38.2	152.6	139.1	0	0	0	0	0	127.1
249	A	27	Very low	34.4	Very low	104 Å²	104	117.3 Å²	117.3	86%	0.86	77%	0.774	S	S	*	*			trans	73.4	163	155.1	0	0	0	0	0	119.3
250	A	25.7	Very low	34	Very low	83 Å²	83	116.4 Å²	116.4	69%	0.686	77%	0.774	S	S	*	*			cis	-172.7	171	-34.2	0	0	0	0	0	110.2
251	L	28.9	Very low	34.1	Very low	176 Å²	176	117.9 Å²	117.9	92%	0.921	78%	0.783	S	S	*	*			trans	68.1	156.6	169.4	-59.7	167.1	0	0	0	116.5
252	A	27.2	Very low	33.7	Very low	90 Å²	90	122.2 Å²	122.2	74%	0.744	80%	0.795	S	S	*	*			cis	-167.6	-177	-27.4	0	0	0	0	0	106.7
253	A	27.6	Very low	33.9	Very low	90 Å²	90	124 Å²	124	74%	0.744	81%	0.807	S	S	*	*			cis	-145.2	-138.2	2.6	0	0	0	0	0	107.2
254	L	27.3	Very low	32.9	Very low	163 Å²	163	122.7 Å²	122.7	85%	0.853	81%	0.811	S	S	*	*			cis	-162.6	145.5	-3.3	-171.5	61.2	0	0	0	110.2
255	A	28.3	Very low	32.3	Very low	102 Å²	102	124.9 Å²	124.9	84%	0.843	82%	0.815	S	S	*	*			trans	60.8	150.7	167.2	0	0	0	0	0	118.6
256	G	25.7	Very low	32.6	Very low	74 Å²	74	124.3 Å²	124.3	76%	0.763	81%	0.812	S	S	*	*			cis	-171.4	153.7	-6.2	0	0	0	0	0	112.5
257	S	29.5	Very low	33.2	Very low	122 Å²	122	120.9 Å²	120.9	85%	0.853	81%	0.809	S	S	*	*			trans	-87.7	-172.6	-178.9	-42.8	0	0	0	0	112.1
258	P	51.1	Low	32.7	Very low	125 Å²	125	119.2 Å²	119.2	81%	0.812	81%	0.813	S	S	*	*			cis	-128.7	-160.7	3.7	40.5	-18.2	0	0	0	113
259	A	28.9	Very low	32.8	Very low	98 Å²	98	118.8 Å²	118.8	81%	0.81	82%	0.818	S	S	*	*			cis	-154.9	-180	14.2	0	0	0	0	0	113.7
260	G	26.6	Very low	32.9	Very low	71 Å²	71	117.4 Å²	117.4	73%	0.732	82%	0.815	S	S	*	*			trans	-92	-150.9	177.3	0	0	0	0	0	115.2
261	P	50.8	Low	33.3	Very low	128 Å²	128	122 Å²	122	83%	0.831	83%	0.827	S	S	*	*			cis	-140	-165.1	23.8	42.8	-22.1	0	0	0	117.7
262	H	34.5	Very low	33.2	Very low	182 Å²	182	125.2 Å²	125.2	84%	0.843	83%	0.827	S	S	*	*			trans	-82.4	-174.6	-178.9	-59.5	-84.8	0	0	0	114.4
263	P	46.6	Very low	33.2	Very low	130 Å²	130	130.1 Å²	130.1	84%	0.844	83%	0.832	S	S	*	*			cis	-132.6	-163.6	4.4	44.4	-25.5	0	0	0	114.3
264	G	29.8	Very low	34.5	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	83%	0.832	S	S	*	*			cis	154.5	168.7	-14.3	0	0	0	0	0	115.5
265	L	31.4	Very low	35.7	Very low	179 Å²	179	128.2 Å²	128.2	94%	0.937	82%	0.821	S	S	*	*			trans	79.3	159	170.6	-73.5	172	0	0	0	122.4
266	Y	34.4	Very low	35.7	Very low	216 Å²	216	131.6 Å²	131.6	85%	0.847	82%	0.819	S	S	*	*			trans	-92.5	-172	-167.3	-88	-91.6	0	0	0	114.3
267	P	46.5	Very low	35.9	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	82%	0.821	S	S	*	*			cis	-136.7	178.5	-6.9	27.7	-4	0	0	0	117.4
268	G	31.8	Very low	37	Very low	84 Å²	84	136.9 Å²	136.9	87%	0.866	82%	0.822	S	S	*	*			trans	101.9	131.9	139.1	0	0	0	0	0	118.6
269	G	30	Very low	35.9	Very low	87 Å²	87	134.8 Å²	134.8	90%	0.897	82%	0.823	S	S	*	*			trans	-123.7	-177.2	-174.2	0	0	0	0	0	116.4
270	G	28.5	Very low	36	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	82%	0.82	S	S	*	*			trans	167.1	99.6	173.9	0	0	0	0	0	118.3
271	L	33.2	Very low	36.1	Very low	179 Å²	179	140 Å²	140	94%	0.937	83%	0.826	S	S	*	*			trans	33.9	131.7	144.8	-54.2	175	0	0	0	123.4
272	R	26.6	Very low	36.7	Very low	244 Å²	244	138.8 Å²	138.8	92%	0.921	82%	0.819	S	S	*	*				143.2	148	117.3	-159.9	168.7	-171.3	-178.7	1.8	115.9
273	F	27.7	Very low	36.5	Very low	193 Å²	193	139.1 Å²	139.1	85%	0.846	82%	0.82	S	S	*	*			trans	-83.7	-178.9	-178.8	-51.7	-97	0	0	0	114
274	P	55.3	Low	35.7	Very low	117 Å²	117	136.6 Å²	136.6	76%	0.76	81%	0.811	S	S	*	*			cis	-127.8	-128.4	-2.9	30.9	-3.8	0	0	0	111
275	P	51.9	Low	35.7	Very low	95 Å²	95	141.7 Å²	141.7	62%	0.617	82%	0.815	S	S	*	*			cis	-141.6	179	-25.4	42.3	-23	0	0	0	118.9
276	H	28.7	Very low	35.5	Very low	174 Å²	174	140.4 Å²	140.4	81%	0.806	80%	0.804	S	S	*	*			trans	72.6	166.8	150.6	-64.3	-43.3	0	0	0	124.1
277	H	30.8	Very low	35.3	Very low	174 Å²	174	137.1 Å²	137.1	81%	0.806	80%	0.8	S	S	*	*			trans	-123.9	-164	-161.4	-34.6	-106.7	0	0	0	112.7
278	P	52.4	Low	34.4	Very low	133 Å²	133	134.9 Å²	134.9	86%	0.864	80%	0.799	S	S	*	*			cis	-129.2	-178	-34.5	30.5	-9.6	0	0	0	113.7
279	G	28.4	Very low	34.2	Very low	81 Å²	81	136.2 Å²	136.2	84%	0.835	80%	0.795	S	S	*	*			trans	-178.6	156.7	169.8	0	0	0	0	0	115.1
280	A	30.7	Very low	34.2	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	79%	0.786	S	S	*	*			trans	-137.6	145.9	-159.5	0	0	0	0	0	118.6
281	H	29.1	Very low	34.5	Very low	186 Å²	186	143.5 Å²	143.5	86%	0.861	79%	0.792	S	S	*	*			trans	70.2	160.9	142	-77.8	-48.4	0	0	0	122.6
282	P	62.6	Low	34.8	Very low	104 Å²	104	139.5 Å²	139.5	68%	0.675	78%	0.775	S	S	*	*			trans	-132.8	-176.9	-138.1	46.4	-32.6	0	0	0	117.1
283	H	30.1	Very low	36	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.875	75%	0.754	S	S	*	*			trans	-172.4	166.2	149.4	-106.5	-45.6	0	0	0	116.8
284	A	29.8	Very low	36.7	Very low	77 Å²	77	126 Å²	126	64%	0.636	74%	0.744	S	S	*	*			trans	90.3	103.8	142.9	0	0	0	0	0	125.3
285	H	29.9	Very low	36.4	Very low	176 Å²	176	126.9 Å²	126.9	82%	0.815	74%	0.738	S	S	*	*				69.4	111.8	119.3	-69	-71.6	0	0	0	126.2
286	H	27.3	Very low	36	Very low	152 Å²	152	126 Å²	126	70%	0.704	73%	0.728	S	S	*	*				86.5	97.5	105.8	-159.5	88.8	0	0	0	123.6
287	L	30.8	Very low	37.1	Very low	147 Å²	147	122.1 Å²	122.1	77%	0.77	72%	0.716	S	S	*	*				70.1	130.2	123.1	-146.8	154	0	0	0	121.3
288	G	26.4	Very low	38.1	Very low	73 Å²	73	119 Å²	119	75%	0.753	71%	0.709	S	S	*	*			trans	-170.2	27.3	179.1	0	0	0	0	0	120.5
289	S	28.4	Very low	37.8	Very low	113 Å²	113	118.2 Å²	118.2	79%	0.79	70%	0.697	S	S	*	*			trans	36.7	109.2	163.5	-176.8	0	0	0	0	121.4
290	A	29.4	Very low	38.6	Very low	85 Å²	85	117.4 Å²	117.4	70%	0.702	68%	0.682	S	S	*	*			trans	-150.9	154.9	144.4	0	0	0	0	0	111.4
291	Y	35.9	Very low	39.2	Very low	231 Å²	231	116.4 Å²	116.4	91%	0.906	67%	0.67	S	S	*	*			trans	-53.5	131.7	-173.6	-44	-87.1	0	0	0	113.6
292	T	38.8	Very low	40.1	Very low	94 Å²	94	110.6 Å²	110.6	58%	0.577	65%	0.653	S	S	*	*			trans	-113	133.2	174.9	160.9	0	0	0	0	109.6	D296	T292-D296 WeakPolarHBondContact OG1-CB 3.26Å
293	T	51.3	Low	39.5	Very low	78 Å²	78	110.7 Å²	110.7	48%	0.479	65%	0.652	S	S	.	*			trans	-89.8	170.7	174.4	60.5	0	0	0	0	111.2	E295 D296	T293-E295 VanDerWaalsContact C-N 3.25Å; T293-E295 PolarHBondContact O-N 2.74Å; T293-D296 PolarHBondContact N-OD2 2.79Å; T293-D296 PolarHBondContact O-N 2.85Å; T293-D296 PolarHBondContact OG1-OD2 2.96Å
294	A	42.3	Very low	40	Very low	77 Å²	77	105.6 Å²	105.6	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-64.1	-32.4	-175.9	0	0	0	0	0	112.2
295	E	49.9	Very low	40.7	Very low	135 Å²	135	109.4 Å²	109.4	63%	0.631	65%	0.647	S	S	*	*	H	α-helix	trans	-67.7	-35.7	174.6	18.3	-72.7	108	0	0	113.1	T293 V297 V298 L299	T293-E295 VanDerWaalsContact C-N 3.25Å; T293-E295 PolarHBondContact O-N 2.74Å; E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 3.36Å; E295-V298 PolarHBondContact O-N 3.25Å; E295-L299 PolarHBondContact O-N 2.58Å
296	D	43.6	Very low	41.5	Very low	76 Å²	76	109.2 Å²	109.2	41%	0.406	65%	0.647	S	S	.	*	H	α-helix	trans	-63.6	-37.7	-178.6	-66.3	-56.1	0	0	0	112.5	T292 T293 V298 L299 A300	T292-D296 WeakPolarHBondContact OG1-CB 3.26Å; T293-D296 PolarHBondContact N-OD2 2.79Å; T293-D296 PolarHBondContact O-N 2.85Å; T293-D296 PolarHBondContact OG1-OD2 2.96Å; D296-V298 VanDerWaalsContact C-N 3.31Å; D296-V298 PolarHBondContact O-N 3.47Å; D296-L299 PolarHBondContact O-N 3.06Å; D296-A300 VanDerWaalsContact O-CB 3.25Å; D296-A300 WeakPolarHBondContact O-CB 3.34Å; D296-A300 PolarHBondContact O-N 3.05Å
297	V	51.6	Low	42.4	Very low	93 Å²	93	109.6 Å²	109.6	56%	0.564	65%	0.653	S	S	*	*	H	α-helix	trans	-65.1	-37.6	178.2	-179.2	0	0	0	0	110.9	E295 S301	E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 3.36Å; V297-S301 VanDerWaalsContact O-CB 3.31Å; V297-S301 WeakPolarHBondContact O-CB 3.39Å; V297-S301 PolarHBondContact O-N 2.7Å
298	V	52	Low	42.7	Very low	107 Å²	107	110.9 Å²	110.9	65%	0.648	65%	0.654	S	S	*	*	H	α-helix	trans	-69.2	-44.2	177	-179.9	0	0	0	0	110.6	E295 D296 S301 A302	E295-V298 PolarHBondContact O-N 3.25Å; D296-V298 VanDerWaalsContact C-N 3.31Å; D296-V298 PolarHBondContact O-N 3.47Å; V298-S301 PolarHBondContact O-N 3.35Å; V298-A302 PolarHBondContact O-N 3.28Å
299	L	44.6	Very low	43.8	Very low	118 Å²	118	114.2 Å²	114.2	62%	0.618	66%	0.663	S	S	*	*	H	α-helix	trans	-71.8	-39.4	-178.1	-166.8	61.8	0	0	0	112.6	E295 D296 S301 A302 V303	E295-L299 PolarHBondContact O-N 2.58Å; D296-L299 PolarHBondContact O-N 3.06Å; L299-S301 VanDerWaalsContact C-N 3.32Å; L299-S301 PolarHBondContact O-N 2.74Å; L299-A302 WeakPolarHBondContact O-CB 3.42Å; L299-A302 PolarHBondContact O-N 2.84Å; L299-V303 WeakPolarHBondContact O-CG2 3.06Å; L299-V303 PolarHBondContact O-N 3.48Å
300	A	45.4	Very low	44.7	Very low	63 Å²	63	112.8 Å²	112.8	52%	0.521	66%	0.658	S	S	.	*	H	α-helix	trans	-62.1	-39.3	173.9	0	0	0	0	0	112.1	D296 A302 V303 A304	D296-A300 VanDerWaalsContact O-CB 3.25Å; D296-A300 WeakPolarHBondContact O-CB 3.34Å; D296-A300 PolarHBondContact O-N 3.05Å; A300-A302 VanDerWaalsContact C-N 3.29Å; A300-A302 PolarHBondContact O-N 3.25Å; A300-V303 PolarHBondContact O-N 3.11Å; A300-A304 PolarHBondContact O-N 2.91Å; A300-A304 VanDerWaalsContact O-N 3.08Å
301	S	44.6	Very low	45.2	Very low	71 Å²	71	117.1 Å²	117.1	50%	0.497	67%	0.666	S	S	.	*	H	α-helix	trans	-64.8	-30.7	175.6	-166.2	0	0	0	0	112.7	V297 V298 L299 H305	V297-S301 VanDerWaalsContact O-CB 3.31Å; V297-S301 WeakPolarHBondContact O-CB 3.39Å; V297-S301 PolarHBondContact O-N 2.7Å; V298-S301 PolarHBondContact O-N 3.35Å; L299-S301 VanDerWaalsContact C-N 3.32Å; L299-S301 PolarHBondContact O-N 2.74Å; S301-H305 PolarHBondContact O-ND1 3.02Å
302	A	48.3	Very low	45.5	Very low	63 Å²	63	117 Å²	117	52%	0.521	66%	0.664	S	S	.	*	H	α-helix	trans	-71.1	-37.9	173	0	0	0	0	0	113	V298 L299 A300	V298-A302 PolarHBondContact O-N 3.28Å; L299-A302 WeakPolarHBondContact O-CB 3.42Å; L299-A302 PolarHBondContact O-N 2.84Å; A300-A302 VanDerWaalsContact C-N 3.29Å; A300-A302 PolarHBondContact O-N 3.25Å
303	V	49.1	Very low	45.6	Very low	107 Å²	107	118 Å²	118	65%	0.648	67%	0.672	S	S	*	*	H	α-helix	trans	-80.4	-31.7	-175	176.8	0	0	0	0	113	L299 A300 H305	L299-V303 WeakPolarHBondContact O-CG2 3.06Å; L299-V303 PolarHBondContact O-N 3.48Å; A300-V303 PolarHBondContact O-N 3.11Å; V303-H305 PolarHBondContact O-N 2.83Å
304	A	41.8	Very low	44.9	Very low	82 Å²	82	122 Å²	122	68%	0.678	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-13.6	-178.9	0	0	0	0	0	115	A300	A300-A304 PolarHBondContact O-N 2.91Å; A300-A304 VanDerWaalsContact O-N 3.08Å
305	H	44	Very low	44.7	Very low	156 Å²	156	127.2 Å²	127.2	72%	0.722	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-3.3	-172.7	-79.3	99.5	0	0	0	116.1	S301 V303	S301-H305 PolarHBondContact O-ND1 3.02Å; V303-H305 PolarHBondContact O-N 2.83Å
306	Q	46.6	Very low	44.2	Very low	173 Å²	173	125.1 Å²	125.1	81%	0.808	70%	0.698	S	S	*	*	S	Bend	trans	-103.1	-6.8	-174.5	-68.5	-161.9	10.1	0	0	116.8
307	L	45.8	Very low	43.9	Very low	159 Å²	159	128.6 Å²	128.6	83%	0.832	72%	0.716	S	S	*	*	S	Bend	trans	-125.6	53.1	-171.1	-70.6	176.1	0	0	0	115.4
308	H	37.5	Very low	43.2	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.806	72%	0.717	S	S	*	*			trans	-146.6	120.3	156.6	-95.8	167.8	0	0	0	112.2	A310	H308-A310 PolarHBondContact O-N 3.12Å
309	P	47.9	Very low	43.1	Very low	143 Å²	143	129.2 Å²	129.2	93%	0.929	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	48.6	-175.6	36.3	-37.7	0	0	0	112.9
310	A	47.3	Very low	43.2	Very low	84 Å²	84	131.3 Å²	131.3	69%	0.694	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	3.2	-169.6	0	0	0	0	0	116.3	H308	H308-A310 PolarHBondContact O-N 3.12Å
311	M	41.6	Very low	43.4	Very low	175 Å²	175	135.6 Å²	135.6	86%	0.862	73%	0.734	S	S	*	*			trans	-135.7	95	167.7	-80	-62	-148.8	0	0	110.8
312	R	42.4	Very low	44.1	Very low	229 Å²	229	137.1 Å²	137.1	86%	0.864	74%	0.737	S	S	*	*			trans	-60.9	135.2	149.6	-90.5	-176.8	172.7	171.2	-0.9	106.6	L314	R312-L314 PolarHBondContact O-N 3.19Å
313	P	39.8	Very low	44.4	Very low	116 Å²	116	137.2 Å²	137.2	75%	0.753	74%	0.744	S	S	*	*			trans	-49.8	136.5	156	-21.3	32.4	0	0	0	107.6	R315	P313-R315 PolarHBondContact O-N 3.42Å
314	L	36.8	Very low	45	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	73%	0.729	S	S	*	*			trans	-63.4	93.6	169.4	-77.6	174.9	0	0	0	107.3	R312 A316	R312-L314 PolarHBondContact O-N 3.19Å; L314-A316 PolarHBondContact O-N 2.91Å
315	R	38.1	Very low	46.3	Very low	188 Å²	188	137.6 Å²	137.6	71%	0.709	74%	0.737	S	S	*	*			trans	-44.7	105.6	161.7	-171	-170.8	-161.1	95.8	-5.5	104.6	P313 L317 Q318	P313-R315 PolarHBondContact O-N 3.42Å; R315-L317 VanDerWaalsContact O-CA 3.3Å; R315-L317 WeakPolarHBondContact O-CA 3.25Å; R315-L317 PolarHBondContact O-N 2.72Å; R315-Q318 VanDerWaalsContact NE-OE1 3.12Å
316	A	38.8	Very low	48	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	71%	0.706	S	S	*	*			trans	-47.5	113	-169.3	0	0	0	0	0	107.5	L314 Q318	L314-A316 PolarHBondContact O-N 2.91Å; A316-Q318 WeakPolarHBondContact O-CA 3.34Å; A316-Q318 PolarHBondContact O-N 3.32Å
317	L	38.4	Very low	49.9	Very low	150 Å²	150	126.7 Å²	126.7	79%	0.785	69%	0.69	S	S	*	*			trans	-45.9	105.5	-150.9	-85.1	172.6	0	0	0	109	R315 P319	R315-L317 VanDerWaalsContact O-CA 3.3Å; R315-L317 WeakPolarHBondContact O-CA 3.25Å; R315-L317 PolarHBondContact O-N 2.72Å; L317-P319 WeakPolarHBondContact O-CA 3.39Å; L317-P319 VanDerWaalsContact O-CD 3.3Å; L317-P319 WeakPolarHBondContact O-CD 3.3Å
318	Q	35.7	Very low	52.1	Low	125 Å²	125	119.7 Å²	119.7	58%	0.584	65%	0.654	S	S	*	*			trans	-60.8	106.5	-166.3	-173.5	166.3	-8.7	0	0	104.8	R315 A316 E320	R315-Q318 VanDerWaalsContact NE-OE1 3.12Å; A316-Q318 WeakPolarHBondContact O-CA 3.34Å; A316-Q318 PolarHBondContact O-N 3.32Å; Q318-E320 WeakPolarHBondContact O-CA 3.16Å; Q318-E320 PolarHBondContact O-N 2.81Å
319	P	50.7	Low	54.8	Low	87 Å²	87	116.7 Å²	116.7	57%	0.565	64%	0.639	S	S	*	*			trans	-60.6	112.2	-153	20.3	-32.7	0	0	0	106.9	L317 D321	L317-P319 WeakPolarHBondContact O-CA 3.39Å; L317-P319 VanDerWaalsContact O-CD 3.3Å; L317-P319 WeakPolarHBondContact O-CD 3.3Å; P319-D321 WeakPolarHBondContact O-CA 3.3Å; P319-D321 PolarHBondContact O-N 2.91Å
320	E	46.8	Very low	57.1	Low	162 Å²	162	110.7 Å²	110.7	76%	0.757	60%	0.599	S	S	*	*			trans	-42.7	106.3	-160.4	-68.8	-76.8	129.5	0	0	108.7	Q318 D322	Q318-E320 WeakPolarHBondContact O-CA 3.16Å; Q318-E320 PolarHBondContact O-N 2.81Å; E320-D322 PolarHBondContact O-N 3.01Å
321	D	49.7	Very low	59.4	Low	153 Å²	153	109.9 Å²	109.9	82%	0.818	59%	0.586	S	S	*	*			trans	-81.2	82.4	-162	-166.6	14.5	0	0	0	107	P319 G323	P319-D321 WeakPolarHBondContact O-CA 3.3Å; P319-D321 PolarHBondContact O-N 2.91Å; D321-G323 PolarHBondContact O-N 2.89Å
322	D	58.5	Low	62.1	Low	104 Å²	104	102.2 Å²	102.2	56%	0.556	55%	0.548	S	S	*	.			trans	-54.6	-3.5	-170.2	-74.1	-42.7	0	0	0	113.6	E320 V324 R461	E320-D322 PolarHBondContact O-N 3.01Å; D322-V324 HydrophobicContact CB-CB 4.08Å; D322-V324 HydrophobicContact CB-CG2 3.91Å; D322-V324 PolarHBondContact O-N 2.91Å; D322-R461 IonicContact OD2-CZ 3.76Å; D322-R461 IonicContact OD2-NE 3.99Å; D322-R461 PolarHBondContact OD2-NE 2.89Å; D322-R461 IonicContact OD2-NH2 2.74Å; D322-R461 PolarHBondContact OD2-NH2 3.09Å
323	G	55.8	Low	64.7	Low	64 Å²	64	93.5 Å²	93.5	66%	0.66	52%	0.517	S	S	*	.	S	Bend	trans	72.3	-0.4	-167.2	0	0	0	0	0	113	D321 V325	D321-G323 PolarHBondContact O-N 2.89Å; G323-V325 PolarHBondContact O-N 3.29Å
324	V	61.3	Low	67.3	Low	57 Å²	57	90.3 Å²	90.3	35%	0.345	51%	0.505	S	S	.	.			trans	-92.5	94.2	-172.3	179.2	0	0	0	0	109.9	D322 D326 D369	D322-V324 HydrophobicContact CB-CB 4.08Å; D322-V324 HydrophobicContact CB-CG2 3.91Å; D322-V324 PolarHBondContact O-N 2.91Å; V324-D326 PolarHBondContact O-N 2.61Å; V324-D369 HydrophobicContact CG1-CB 3.48Å; V324-D369 VanDerWaalsContact CG1-CB 3.48Å
325	V	68.3	Low	70.1	Confident	140 Å²	140	86.8 Å²	86.8	85%	0.848	48%	0.483	S	S	*	.			trans	-74.8	92.2	176	-176.3	0	0	0	0	110.2	G323	G323-V325 PolarHBondContact O-N 3.29Å
326	D	79.5	Confident	72.9	Confident	12 Å²	12	83.2 Å²	83.2	6%	0.064	48%	0.478	C	S	.	.			trans	-71.1	129	169.5	-57.2	-41.2	0	0	0	110.9	V324 P328 D369 Y374 R461 R474	V324-D326 PolarHBondContact O-N 2.61Å; D326-P328 WeakPolarHBondContact O-CD 3.49Å; D326-D369 PolarHBondContact OD1-N 2.8Å; D326-D369 VanDerWaalsContact OD1-N 3.12Å; D326-Y374 PolarHBondContact OD1-OH 3.27Å; D326-Y374 PolarHBondContact OD2-OH 2.89Å; D326-Y374 VanDerWaalsContact OD2-OH 3.06Å; D326-R461 IonicContact OD1-NH1 3.4Å; D326-R461 PolarHBondContact OD1-NH1 3.15Å; D326-R461 IonicContact OD2-CZ 3.15Å; D326-R461 IonicContact OD2-NH1 2.76Å; D326-R461 PolarHBondContact OD2-NH1 3Å; D326-R474 PolarHBondContact O-NH1 3.04Å; D326-R474 PolarHBondContact O-NH2 3.07Å
327	D	88.1	Confident	75.7	Confident	89 Å²	89	80.8 Å²	80.8	48%	0.476	45%	0.452	S	S	.	.			trans	-111.4	64.3	170.4	178	25.7	0	0	0	110.9	K329 G367	D327-K329 PolarHBondContact O-N 3.04Å; D327-K329 WeakPolarHBondContact OD1-CE 3.34Å; D327-K329 IonicContact OD1-NZ 3.64Å; D327-K329 VanDerWaalsContact OD2-CE 3.26Å; D327-K329 WeakPolarHBondContact OD2-CE 3.37Å; D327-K329 IonicContact OD2-NZ 2.58Å; D327-K329 PolarHBondContact OD2-NZ 3.36Å; D327-G367 CarbonylContact C-O 3.56Å; D327-G367 VanDerWaalsContact C-O 3.29Å; D327-G367 PolarHBondContact N-O 2.7Å; D327-G367 VanDerWaalsContact N-O 3.11Å; D327-G367 WeakPolarHBondContact O-CA 3.34Å
328	P	91.7	Very high	78.6	Confident	12 Å²	12	73.7 Å²	73.7	8%	0.078	42%	0.415	C	S	.	.			trans	-68.7	116.5	-171.9	27.1	-34.6	0	0	0	111.8	D326 S366 L368 L459 R474 Y476	D326-P328 WeakPolarHBondContact O-CD 3.49Å; P328-S366 CarbonylContact C-O 3.57Å; P328-S366 WeakPolarHBondContact CA-O 3.35Å; P328-L368 HydrophobicContact CB-CD2 3.7Å; P328-L459 HydrophobicContact CB-CD1 4.47Å; P328-L459 HydrophobicContact CB-CD2 4.48Å; P328-R474 VanDerWaalsContact CG-NH1 3.32Å; P328-Y476 WeakPolarHBondContact CB-OH 3.36Å; P328-Y476 WeakPolarHBondContact CG-OH 3Å; P328-Y476 PolarHBondContact O-OH 2.94Å
329	K	93.3	Very high	81.6	Confident	111 Å²	111	71.8 Å²	71.8	48%	0.483	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.2	175.5	-74.9	155.4	-179.8	160	0	109.2	D327 V365 S366	D327-K329 PolarHBondContact O-N 3.04Å; D327-K329 WeakPolarHBondContact OD1-CE 3.34Å; D327-K329 IonicContact OD1-NZ 3.64Å; D327-K329 VanDerWaalsContact OD2-CE 3.26Å; D327-K329 WeakPolarHBondContact OD2-CE 3.37Å; D327-K329 IonicContact OD2-NZ 2.58Å; D327-K329 PolarHBondContact OD2-NZ 3.36Å; K329-V365 CarbonylContact O-C 3.29Å; K329-V365 WeakPolarHBondContact O-CA 3.21Å; K329-S366 PolarHBondContact N-O 3.18Å; K329-S366 PolarHBondContact O-N 3.3Å
330	V	96.6	Very high	83.8	Confident	17 Å²	17	73.4 Å²	73.4	10%	0.103	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128	-174.6	-176.5	0	0	0	0	108.8	F363 R364 V365 F457 Y476 F478	V330-F363 HydrophobicContact CG1-CB 3.99Å; V330-F363 HydrophobicContact CG1-CD1 3.95Å; V330-F363 HydrophobicContact CG1-CG 4.22Å; V330-R364 WeakPolarHBondContact CA-O 3.37Å; V330-V365 HydrophobicContact CG2-CG1 4.33Å; V330-V365 HydrophobicContact CG2-CG2 4.43Å; V330-F457 HydrophobicContact CB-CE1 4.41Å; V330-F457 HydrophobicContact CG1-CD1 3.77Å; V330-F457 HydrophobicContact CG1-CE1 3.72Å; V330-F457 HydrophobicContact CG2-CD1 4.26Å; V330-F457 HydrophobicContact CG2-CE1 3.79Å; V330-Y476 HydrophobicContact CB-CD1 3.83Å; V330-Y476 HydrophobicContact CB-CD2 4.46Å; V330-Y476 HydrophobicContact CB-CE1 4.05Å; V330-Y476 HydrophobicContact CB-CG 4.06Å; V330-Y476 HydrophobicContact CG2-CD1 3.82Å; V330-Y476 HydrophobicContact CG2-CD2 3.87Å; V330-Y476 HydrophobicContact CG2-CE1 3.64Å; V330-Y476 HydrophobicContact CG2-CE2 3.7Å; V330-Y476 HydrophobicContact CG2-CG 3.94Å; V330-F478 HydrophobicContact CG1-CE2 4.3Å; V330-F478 HydrophobicContact CG1-CZ 4.1Å
331	T	96.4	Very high	86.2	Confident	66 Å²	66	65.7 Å²	65.7	41%	0.405	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.2	-176.2	52.9	0	0	0	0	113.4	E333 F363 R364	T331-E333 PolarHBondContact O-N 3.37Å; T331-F363 WeakPolarHBondContact O-CA 3.37Å; T331-R364 PolarHBondContact N-O 2.86Å; T331-R364 PolarHBondContact O-N 3.19Å; T331-R364 PolarHBondContact OG1-O 2.94Å
332	L	97.4	Very high	88.5	Confident	14 Å²	14	62 Å²	62	7%	0.073	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	94.6	171.7	169.5	174.4	0	0	0	114.3	G334 K335 W338 M361 F363 F478 E480 T481	L332-G334 PolarHBondContact O-N 3.23Å; L332-K335 PolarHBondContact O-N 2.82Å; L332-W338 HydrophobicContact CD2-CG 4.33Å; L332-M361 HydrophobicContact CD1-CE 3.85Å; L332-M361 HydrophobicContact CD1-SD 4.29Å; L332-F363 HydrophobicContact CB-CD1 3.88Å; L332-F363 HydrophobicContact CB-CE1 4.14Å; L332-F363 HydrophobicContact CD1-CD1 4.15Å; L332-F363 HydrophobicContact CD1-CE1 3.67Å; L332-F363 HydrophobicContact CD1-CZ 4.34Å; L332-F478 HydrophobicContact CB-CD1 4.08Å; L332-F478 HydrophobicContact CB-CD2 4.48Å; L332-F478 HydrophobicContact CB-CE1 3.99Å; L332-F478 HydrophobicContact CB-CE2 4.4Å; L332-F478 HydrophobicContact CB-CG 4.33Å; L332-F478 HydrophobicContact CB-CZ 4.16Å; L332-F478 HydrophobicContact CD2-CB 4.31Å; L332-F478 HydrophobicContact CD2-CD1 4.19Å; L332-F478 HydrophobicContact CD2-CG 4.27Å; L332-E480 HydrophobicContact CD2-CG 4.13Å; L332-T481 HydrophobicContact CD1-CG2 3.71Å; L332-T481 HydrophobicContact CD2-CG2 3.81Å; L332-T481 HydrophobicContact CG-CG2 4.45Å
333	E	97.2	Very high	90.4	Very high	47 Å²	47	66.1 Å²	66.1	22%	0.22	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	126.4	174.3	-73	-70.1	85.4	0	0	111.9	T331 K362 R364 V426	T331-E333 PolarHBondContact O-N 3.37Å; E333-K362 HydrophobicContact CB-CB 3.61Å; E333-K362 WeakPolarHBondContact CB-O 3.47Å; E333-K362 HydrophobicContact CG-CB 4.32Å; E333-K362 PolarHBondContact N-O 2.67Å; E333-R364 VanDerWaalsContact CD-NH2 3.32Å; E333-R364 HydrophobicContact CG-CB 4.35Å; E333-R364 IonicContact OE1-CZ 3.28Å; E333-R364 VanDerWaalsContact OE1-CZ 3.26Å; E333-R364 IonicContact OE1-NH1 2.89Å; E333-R364 PolarHBondContact OE1-NH1 3.22Å; E333-R364 IonicContact OE1-NH2 3.44Å; E333-R364 PolarHBondContact OE1-NH2 3.3Å; E333-R364 IonicContact OE2-CZ 3.02Å; E333-R364 IonicContact OE2-NH1 3.26Å; E333-R364 PolarHBondContact OE2-NH1 3.4Å; E333-R364 IonicContact OE2-NH2 2.61Å; E333-R364 PolarHBondContact OE2-NH2 3.15Å; E333-V426 HydrophobicContact CG-CG1 3.95Å; E333-V426 HydrophobicContact CG-CG2 4.15Å; E333-V426 WeakPolarHBondContact OE2-CG2 3.49Å
334	G	94.5	Very high	92.3	Very high	48 Å²	48	65.7 Å²	65.7	50%	0.495	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	28.6	-176	0	0	0	0	0	113.8	L332 D336 L337 W338	L332-G334 PolarHBondContact O-N 3.23Å; G334-D336 VanDerWaalsContact C-N 3.27Å; G334-D336 PolarHBondContact O-N 3.41Å; G334-L337 WeakPolarHBondContact O-CB 3.49Å; G334-L337 PolarHBondContact O-N 2.91Å; G334-W338 PolarHBondContact O-N 3.44Å
335	K	96.1	Very high	94	Very high	86 Å²	86	64.1 Å²	64.1	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-45.3	-45.8	179.4	-173.9	164.8	179.2	-71.8	0	113.6	L332 L337 W338 E339 E480	L332-K335 PolarHBondContact O-N 2.82Å; K335-L337 PolarHBondContact O-N 3.18Å; K335-L337 VanDerWaalsContact O-N 3.14Å; K335-W338 CarbonylContact O-C 3.56Å; K335-W338 WeakPolarHBondContact O-CA 3.12Å; K335-W338 WeakPolarHBondContact O-CB 3.45Å; K335-W338 PolarHBondContact O-N 3.24Å; K335-E339 HydrophobicContact CG-CG 4.45Å; K335-E339 IonicContact NZ-OE1 2.7Å; K335-E339 PolarHBondContact NZ-OE1 3.2Å; K335-E339 PolarHBondContact O-N 3.18Å; K335-E480 WeakPolarHBondContact CD-OE1 3.35Å; K335-E480 WeakPolarHBondContact CE-OE1 3.38Å; K335-E480 HydrophobicContact CG-CG 4.47Å
336	D	97.1	Very high	95.4	Very high	114 Å²	114	57.6 Å²	57.6	61%	0.61	30%	0.297	S	S	*	.	H	α-helix	trans	-60.5	-27.6	180	-33.6	-23.7	0	0	0	113.4	G334 K340	G334-D336 VanDerWaalsContact C-N 3.27Å; G334-D336 PolarHBondContact O-N 3.41Å; D336-K340 VanDerWaalsContact O-CD 3.28Å; D336-K340 WeakPolarHBondContact O-CD 3.45Å; D336-K340 WeakPolarHBondContact O-CG 3.34Å; D336-K340 PolarHBondContact O-N 3.08Å
337	L	97.4	Very high	96.3	Very high	38 Å²	38	57 Å²	57	20%	0.199	29%	0.294	C	S	.	.	H	α-helix	trans	-79.1	-39.7	174.1	-177.6	60.9	0	0	0	111	G334 K335 K340 F341 F358 P359 N501	G334-L337 WeakPolarHBondContact O-CB 3.49Å; G334-L337 PolarHBondContact O-N 2.91Å; K335-L337 PolarHBondContact O-N 3.18Å; K335-L337 VanDerWaalsContact O-N 3.14Å; L337-K340 PolarHBondContact O-N 3.03Å; L337-F341 HydrophobicContact CD1-CD2 4.18Å; L337-F341 HydrophobicContact CD1-CE2 3.79Å; L337-F341 HydrophobicContact CG-CD2 4.2Å; L337-F341 HydrophobicContact CG-CE2 4.01Å; L337-F341 VanDerWaalsContact O-CD2 3.28Å; L337-F341 WeakPolarHBondContact O-CD2 3.35Å; L337-F341 PolarHBondContact O-N 2.88Å; L337-F341 VanDerWaalsContact O-N 3.16Å; L337-F358 HydrophobicContact CD2-CE1 4.48Å; L337-F358 HydrophobicContact CD2-CZ 4.17Å; L337-P359 HydrophobicContact CD2-CB 4.2Å; L337-P359 HydrophobicContact CD2-CG 4.03Å; L337-P359 HydrophobicContact CG-CG 3.92Å; L337-N501 HydrophobicContact CD1-CB 3.97Å; L337-N501 WeakPolarHBondContact CD1-OD1 3.48Å; L337-N501 HydrophobicContact CD2-CB 4.22Å
338	W	98.3	Very high	96.8	Very high	1 Å²	1	53 Å²	53	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-45.8	171.7	-78.7	105.6	0	0	0	111.7	L332 G334 K335 K340 F341 H342 T346 M348 P359 M361 E480 T481	L332-W338 HydrophobicContact CD2-CG 4.33Å; G334-W338 PolarHBondContact O-N 3.44Å; K335-W338 CarbonylContact O-C 3.56Å; K335-W338 WeakPolarHBondContact O-CA 3.12Å; K335-W338 WeakPolarHBondContact O-CB 3.45Å; K335-W338 PolarHBondContact O-N 3.24Å; W338-K340 VanDerWaalsContact C-N 3.33Å; W338-K340 PolarHBondContact O-N 2.95Å; W338-F341 PolarHBondContact O-N 3.32Å; W338-F341 VanDerWaalsContact O-N 3.11Å; W338-H342 WeakPolarHBondContact O-CB 3.45Å; W338-H342 PolarHBondContact O-N 3.09Å; W338-T346 HydrophobicContact CZ3-CG2 4.35Å; W338-M348 HydrophobicContact CH2-CE 3.47Å; W338-M348 VanDerWaalsContact CH2-CE 3.47Å; W338-M348 HydrophobicContact CZ3-CE 3.61Å; W338-P359 HydrophobicContact CD2-CB 4.13Å; W338-P359 HydrophobicContact CD2-CG 4.04Å; W338-P359 HydrophobicContact CE3-CG 4.3Å; W338-P359 HydrophobicContact CG-CG 4.46Å; W338-P359 HydrophobicContact CH2-CB 4.44Å; W338-P359 WeakPolarHBondContact CH2-O 3.32Å; W338-P359 HydrophobicContact CZ2-CB 3.81Å; W338-P359 HydrophobicContact CZ2-CG 4.36Å; W338-P359 VanDerWaalsContact CZ2-O 3.28Å; W338-P359 WeakPolarHBondContact CZ2-O 3.24Å; W338-M361 HydrophobicContact CH2-CG 4.34Å; W338-M361 HydrophobicContact CH2-SD 3.49Å; W338-M361 WeakPolarHBondContact CH2-SD 3.47Å; W338-M361 HydrophobicContact CZ2-CG 4.08Å; W338-M361 HydrophobicContact CZ2-SD 3.28Å; W338-M361 WeakPolarHBondContact CZ2-SD 3.5Å; W338-M361 HydrophobicContact CZ3-SD 4.39Å; W338-E480 HydrophobicContact CB-CB 4.41Å; W338-E480 HydrophobicContact CB-CG 4.05Å; W338-T481 HydrophobicContact CD2-CG2 3.81Å; W338-T481 HydrophobicContact CE3-CG2 3.97Å; W338-T481 HydrophobicContact CG-CG2 4.15Å; W338-T481 HydrophobicContact CZ2-CG2 4.5Å; W338-T481 HydrophobicContact CZ3-CG2 4.35Å
339	E	98.1	Very high	97.1	Very high	86 Å²	86	53.4 Å²	53.4	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-39.3	176.1	-71.1	-179.2	-178.3	0	0	113.1	K335 F341 H342 K343 E480	K335-E339 HydrophobicContact CG-CG 4.45Å; K335-E339 IonicContact NZ-OE1 2.7Å; K335-E339 PolarHBondContact NZ-OE1 3.2Å; K335-E339 PolarHBondContact O-N 3.18Å; E339-F341 VanDerWaalsContact C-N 3.33Å; E339-F341 PolarHBondContact O-N 3.45Å; E339-H342 PolarHBondContact O-N 3.2Å; E339-K343 WeakPolarHBondContact O-CB 3.29Å; E339-K343 PolarHBondContact O-N 2.83Å; E339-E480 HydrophobicContact CG-CB 4.22Å
340	K	97.8	Very high	97.4	Very high	121 Å²	121	48.3 Å²	48.3	53%	0.526	25%	0.252	S	S	.	.	H	α-helix	trans	-62.6	-37.7	174.4	-73.2	163.8	-168.8	171.3	0	112.4	D336 L337 W338 L497	D336-K340 VanDerWaalsContact O-CD 3.28Å; D336-K340 WeakPolarHBondContact O-CD 3.45Å; D336-K340 WeakPolarHBondContact O-CG 3.34Å; D336-K340 PolarHBondContact O-N 3.08Å; L337-K340 PolarHBondContact O-N 3.03Å; W338-K340 VanDerWaalsContact C-N 3.33Å; W338-K340 PolarHBondContact O-N 2.95Å; K340-L497 HydrophobicContact CB-CD2 3.96Å
341	F	98.1	Very high	97.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.7	-45.1	172.2	-81.3	-72	0	0	0	112	L337 W338 E339 K343 L344 G345 T346 F358 P359 I494 L497 K498	L337-F341 HydrophobicContact CD1-CD2 4.18Å; L337-F341 HydrophobicContact CD1-CE2 3.79Å; L337-F341 HydrophobicContact CG-CD2 4.2Å; L337-F341 HydrophobicContact CG-CE2 4.01Å; L337-F341 VanDerWaalsContact O-CD2 3.28Å; L337-F341 WeakPolarHBondContact O-CD2 3.35Å; L337-F341 PolarHBondContact O-N 2.88Å; L337-F341 VanDerWaalsContact O-N 3.16Å; W338-F341 PolarHBondContact O-N 3.32Å; W338-F341 VanDerWaalsContact O-N 3.11Å; E339-F341 VanDerWaalsContact C-N 3.33Å; E339-F341 PolarHBondContact O-N 3.45Å; F341-K343 VanDerWaalsContact C-N 3.35Å; F341-K343 PolarHBondContact O-N 2.91Å; F341-L344 CarbonylContact O-C 3.48Å; F341-L344 PolarHBondContact O-N 2.78Å; F341-G345 CarbonylContact O-C 3.57Å; F341-G345 PolarHBondContact O-N 2.88Å; F341-T346 VanDerWaalsContact C-OG1 3.29Å; F341-T346 HydrophobicContact CB-CG2 4.04Å; F341-T346 PolarHBondContact O-N 3Å; F341-F358 HydrophobicContact CE2-CD1 4.25Å; F341-F358 AromaticContact CE2-CE1 3.89Å; F341-F358 HydrophobicContact CE2-CE1 3.89Å; F341-F358 HydrophobicContact CZ-CD1 4.13Å; F341-F358 AromaticContact CZ-CE1 3.95Å; F341-F358 HydrophobicContact CZ-CE1 3.95Å; F341-P359 HydrophobicContact CD2-CG 3.43Å; F341-P359 VanDerWaalsContact CD2-CG 3.43Å; F341-P359 HydrophobicContact CE2-CG 3.61Å; F341-P359 HydrophobicContact CG-CG 4.46Å; F341-I494 HydrophobicContact CD1-CD1 3.85Å; F341-I494 HydrophobicContact CD1-CG2 4.22Å; F341-I494 HydrophobicContact CE1-CG2 4.16Å; F341-L497 HydrophobicContact CD1-CD2 3.65Å; F341-L497 HydrophobicContact CD1-CG 4.31Å; F341-L497 HydrophobicContact CD2-CD2 3.97Å; F341-L497 HydrophobicContact CE1-CB 3.82Å; F341-L497 HydrophobicContact CE1-CD2 3.64Å; F341-L497 HydrophobicContact CE1-CG 3.77Å; F341-L497 HydrophobicContact CE2-CD2 3.97Å; F341-L497 HydrophobicContact CE2-CG 4.05Å; F341-L497 HydrophobicContact CG-CD2 3.8Å; F341-L497 HydrophobicContact CZ-CB 4Å; F341-L497 HydrophobicContact CZ-CD2 3.8Å; F341-L497 HydrophobicContact CZ-CG 3.61Å; F341-K498 HydrophobicContact CD1-CD 4.46Å; F341-K498 HydrophobicContact CE1-CD 3.52Å; F341-K498 HydrophobicContact CE1-CG 3.86Å; F341-K498 HydrophobicContact CZ-CD 3.71Å; F341-K498 HydrophobicContact CZ-CG 4.19Å
342	H	97.8	Very high	97.4	Very high	74 Å²	74	53.7 Å²	53.7	34%	0.343	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-42.9	-177.8	-171.3	77.2	0	0	0	111.8	W338 E339 L344 G345 T346 K479 E482	W338-H342 WeakPolarHBondContact O-CB 3.45Å; W338-H342 PolarHBondContact O-N 3.09Å; E339-H342 PolarHBondContact O-N 3.2Å; H342-L344 PolarHBondContact O-N 3.34Å; H342-L344 VanDerWaalsContact O-N 3.12Å; H342-G345 PolarHBondContact O-N 2.92Å; H342-T346 WeakPolarHBondContact CA-OG1 3.29Å; H342-T346 PolarHBondContact N-OG1 3.27Å; H342-K479 PolarHBondContact CE1-O 2.89Å; H342-K479 PolarHBondContact ND1-O 2.87Å; H342-E482 IonicContact CE1-OE1 2.9Å
343	K	97.3	Very high	97.4	Very high	191 Å²	191	57.1 Å²	57.1	83%	0.83	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-22	175	-175.1	171.8	-178.9	176	0	114.1	E339 F341	E339-K343 WeakPolarHBondContact O-CB 3.29Å; E339-K343 PolarHBondContact O-N 2.83Å; F341-K343 VanDerWaalsContact C-N 3.35Å; F341-K343 PolarHBondContact O-N 2.91Å
344	L	96.1	Very high	97.4	Very high	56 Å²	56	55.2 Å²	55.2	29%	0.293	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	0.4	177.2	-66.2	176	0	0	0	113.1	F341 H342 N491 K493 I494 L497	F341-L344 CarbonylContact O-C 3.48Å; F341-L344 PolarHBondContact O-N 2.78Å; H342-L344 PolarHBondContact O-N 3.34Å; H342-L344 VanDerWaalsContact O-N 3.12Å; L344-N491 PolarHBondContact O-ND2 2.91Å; L344-K493 HydrophobicContact CD1-CB 4.07Å; L344-K493 HydrophobicContact CD2-CB 4.24Å; L344-K493 HydrophobicContact CD2-CD 4.26Å; L344-I494 HydrophobicContact CB-CD1 3.5Å; L344-I494 HydrophobicContact CB-CG1 4.17Å; L344-I494 HydrophobicContact CD1-CD1 4.46Å; L344-L497 HydrophobicContact CD1-CD2 4.06Å
345	G	96.4	Very high	97.5	Very high	23 Å²	23	58.9 Å²	58.9	24%	0.237	29%	0.289	C	S	.	.			trans	74.4	91.2	-168.2	0	0	0	0	0	111	F341 H342 E347 I494	F341-G345 CarbonylContact O-C 3.57Å; F341-G345 PolarHBondContact O-N 2.88Å; H342-G345 PolarHBondContact O-N 2.92Å; G345-E347 PolarHBondContact O-N 3.22Å; G345-I494 VanDerWaalsContact O-CD1 3.27Å; G345-I494 WeakPolarHBondContact O-CD1 3.37Å
346	T	98.4	Very high	97.6	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.018	29%	0.292	C	S	.	.			trans	-56	127.9	-176	-50.8	0	0	0	0	111.7	W338 F341 H342 M348 E482 F483 I484	W338-T346 HydrophobicContact CZ3-CG2 4.35Å; F341-T346 VanDerWaalsContact C-OG1 3.29Å; F341-T346 HydrophobicContact CB-CG2 4.04Å; F341-T346 PolarHBondContact O-N 3Å; H342-T346 WeakPolarHBondContact CA-OG1 3.29Å; H342-T346 PolarHBondContact N-OG1 3.27Å; T346-M348 HydrophobicContact CG2-CE 4.08Å; T346-E482 VanDerWaalsContact CB-O 3.28Å; T346-E482 WeakPolarHBondContact CB-O 3.47Å; T346-E482 PolarHBondContact OG1-O 2.82Å; T346-F483 HydrophobicContact CG2-CB 3.64Å; T346-F483 CarbonylContact O-C 3.59Å; T346-F483 WeakPolarHBondContact O-CA 3.35Å; T346-F483 WeakPolarHBondContact O-CB 3.45Å; T346-I484 PolarHBondContact O-N 2.92Å
347	E	98.6	Very high	97.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	142	171.9	-55.4	176.9	-170	0	0	111.1	G345 W395 I484 V486 Y489 Q490 N491 I494 K498	G345-E347 PolarHBondContact O-N 3.22Å; E347-W395 HydrophobicContact CG-CZ2 3.96Å; E347-I484 WeakPolarHBondContact CA-O 3.4Å; E347-V486 HydrophobicContact CB-CG2 4.08Å; E347-Y489 HydrophobicContact CB-CD1 4.1Å; E347-Y489 HydrophobicContact CB-CE1 4.49Å; E347-Y489 WeakPolarHBondContact OE2-CA 3.49Å; E347-Y489 WeakPolarHBondContact OE2-CD1 3.44Å; E347-Q490 PolarHBondContact OE1-N 3.11Å; E347-Q490 PolarHBondContact OE2-N 2.91Å; E347-N491 WeakPolarHBondContact OE1-CB 3.07Å; E347-N491 PolarHBondContact OE1-N 2.98Å; E347-I494 HydrophobicContact CB-CG2 4.04Å; E347-I494 HydrophobicContact CG-CG1 4.26Å; E347-I494 HydrophobicContact CG-CG2 4.29Å; E347-K498 WeakPolarHBondContact O-CE 3.48Å; E347-K498 PolarHBondContact O-NZ 2.92Å
348	M	98.6	Very high	97.7	Very high	4 Å²	4	54 Å²	54	2%	0.02	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123	170.6	-65.1	-66.9	-177.3	0	0	110.4	W338 T346 M357 F358 L434 F483 I484 V486	W338-M348 HydrophobicContact CH2-CE 3.47Å; W338-M348 VanDerWaalsContact CH2-CE 3.47Å; W338-M348 HydrophobicContact CZ3-CE 3.61Å; T346-M348 HydrophobicContact CG2-CE 4.08Å; M348-M357 HydrophobicContact CE-CB 4.24Å; M348-M357 HydrophobicContact SD-CB 4.09Å; M348-M357 HydrophobicContact SD-CG 4.41Å; M348-F358 WeakPolarHBondContact CE-O 3.49Å; M348-F358 VanDerWaalsContact SD-O 3.39Å; M348-L434 HydrophobicContact CB-CD1 3.83Å; M348-L434 HydrophobicContact CG-CD1 4.35Å; M348-F483 HydrophobicContact CB-CD2 3.5Å; M348-F483 VanDerWaalsContact CB-CD2 3.5Å; M348-F483 HydrophobicContact CB-CE2 3.68Å; M348-F483 HydrophobicContact CB-CG 4.19Å; M348-F483 HydrophobicContact CB-CZ 4.48Å; M348-F483 HydrophobicContact CG-CB 3.95Å; M348-F483 HydrophobicContact CG-CD1 4.06Å; M348-F483 HydrophobicContact CG-CD2 3.36Å; M348-F483 HydrophobicContact CG-CE1 4.41Å; M348-F483 HydrophobicContact CG-CE2 3.79Å; M348-F483 HydrophobicContact CG-CG 3.52Å; M348-F483 HydrophobicContact CG-CZ 4.29Å; M348-I484 PolarHBondContact N-O 2.76Å; M348-V486 PolarHBondContact O-N 2.91Å
349	V	98.6	Very high	97.6	Very high	22 Å²	22	54.2 Å²	54.2	13%	0.133	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	132	176.2	172.4	0	0	0	0	110.2	T351 R355 V486 Y489	V349-T351 HydrophobicContact CG1-CG2 4.03Å; V349-R355 HydrophobicContact CB-CG 4.26Å; V349-R355 HydrophobicContact CG1-CG 4.23Å; V349-R355 VanDerWaalsContact O-CB 3.24Å; V349-R355 WeakPolarHBondContact O-CB 3.28Å; V349-R355 VanDerWaalsContact O-CG 3.24Å; V349-R355 WeakPolarHBondContact O-CG 3.29Å; V349-V486 CarbonylContact C-O 3.49Å; V349-V486 VanDerWaalsContact CA-O 3.22Å; V349-V486 WeakPolarHBondContact CA-O 3.47Å; V349-V486 HydrophobicContact CG2-CG2 4.22Å; V349-Y489 HydrophobicContact CG2-CD1 3.88Å; V349-Y489 HydrophobicContact CG2-CD2 4.35Å; V349-Y489 HydrophobicContact CG2-CE1 3.51Å; V349-Y489 HydrophobicContact CG2-CE2 4.03Å; V349-Y489 HydrophobicContact CG2-CG 4.27Å
350	I	98.1	Very high	97.6	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.015	26%	0.256	C	S	.	.			trans	-113.9	140	174	67.3	177	0	0	0	110.4	L434 N436 L447 A485 V486	I350-L434 HydrophobicContact CB-CB 4.49Å; I350-L434 HydrophobicContact CG2-CB 3.72Å; I350-L434 HydrophobicContact CG2-CD1 4.33Å; I350-N436 HydrophobicContact CD1-CB 3.69Å; I350-N436 HydrophobicContact CG1-CB 4.03Å; I350-L447 HydrophobicContact CD1-CB 4.48Å; I350-L447 WeakPolarHBondContact CD1-O 3.28Å; I350-L447 HydrophobicContact CG2-CD1 4.36Å; I350-A485 HydrophobicContact CD1-CB 4.27Å; I350-A485 HydrophobicContact CG2-CB 4.01Å; I350-V486 PolarHBondContact N-O 3.34Å
351	T	98.1	Very high	97.5	Very high	39 Å²	39	46.7 Å²	46.7	24%	0.239	23%	0.231	C	C	.	.			trans	-140.4	153.7	-178.3	66.4	0	0	0	0	111.9	V349 S353 G354 R355 T435	V349-T351 HydrophobicContact CG1-CG2 4.03Å; T351-S353 PolarHBondContact O-N 2.84Å; T351-S353 VanDerWaalsContact O-N 3.07Å; T351-G354 PolarHBondContact O-N 3.07Å; T351-G354 PolarHBondContact OG1-N 3.21Å; T351-R355 HydrophobicContact CG2-CB 4.24Å; T351-T435 WeakPolarHBondContact O-CA 3.45Å; T351-T435 WeakPolarHBondContact O-CB 3.21Å; T351-T435 PolarHBondContact O-OG1 2.8Å
352	K	96.4	Very high	97.5	Very high	157 Å²	157	50 Å²	50	68%	0.683	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-34.3	179.9	-174.8	176.6	-178.4	177.3	0	113.7	T435 N436 N437	K352-T435 PolarHBondContact O-OG1 2.89Å; K352-N436 WeakPolarHBondContact CA-OD1 3.23Å; K352-N436 PolarHBondContact N-OD1 3.22Å; K352-N437 HydrophobicContact CG-CB 4.15Å
353	S	96.5	Very high	97.5	Very high	86 Å²	86	46.5 Å²	46.5	60%	0.601	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	3.7	179.9	53.1	0	0	0	0	115	T351 K433 F444	T351-S353 PolarHBondContact O-N 2.84Å; T351-S353 VanDerWaalsContact O-N 3.07Å; S353-K433 PolarHBondContact O-NZ 2.99Å; S353-K433 VanDerWaalsContact O-NZ 3.16Å; S353-F444 WeakPolarHBondContact O-CE2 3.4Å
354	G	96.8	Very high	97.5	Very high	7 Å²	7	42.8 Å²	42.8	7%	0.072	21%	0.21	C	C	.	.			trans	78	119	-179.8	0	0	0	0	0	113.7	T351 K433 L434	T351-G354 PolarHBondContact O-N 3.07Å; T351-G354 PolarHBondContact OG1-N 3.21Å; G354-K433 WeakPolarHBondContact O-CD 3.07Å; G354-K433 VanDerWaalsContact O-CE 3.24Å; G354-K433 WeakPolarHBondContact O-CE 3.03Å; G354-K433 PolarHBondContact O-NZ 3.14Å; G354-L434 WeakPolarHBondContact CA-O 3.36Å
355	R	97.9	Very high	97.5	Very high	125 Å²	125	40.2 Å²	40.2	47%	0.472	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.7	-179.5	-172.3	68	175.6	-172.8	-1.6	111	V349 T351 K433 L434	V349-R355 HydrophobicContact CB-CG 4.26Å; V349-R355 HydrophobicContact CG1-CG 4.23Å; V349-R355 VanDerWaalsContact O-CB 3.24Å; V349-R355 WeakPolarHBondContact O-CB 3.28Å; V349-R355 VanDerWaalsContact O-CG 3.24Å; V349-R355 WeakPolarHBondContact O-CG 3.29Å; T351-R355 HydrophobicContact CG2-CB 4.24Å; R355-K433 CarbonylContact O-C 3.57Å; R355-K433 VanDerWaalsContact O-CA 3.31Å; R355-K433 WeakPolarHBondContact O-CA 3.39Å; R355-L434 PolarHBondContact N-O 3.17Å; R355-L434 PolarHBondContact O-N 2.86Å
356	Q	97.4	Very high	97.5	Very high	94 Å²	94	41.6 Å²	41.6	44%	0.439	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	144	174	-68.5	174.8	43.2	0	0	111	H430 K433	Q356-H430 PolarHBondContact OE1-O 2.76Å; Q356-K433 HydrophobicContact CG-CG 4.37Å
357	M	97.8	Very high	97.3	Very high	12 Å²	12	43.1 Å²	43.1	6%	0.059	22%	0.219	C	C	.	.			trans	-69.2	145.3	174.6	-62.9	-173.9	-63.7	0	0	111.9	M348 P359 M361 I380 L432 L434	M348-M357 HydrophobicContact CE-CB 4.24Å; M348-M357 HydrophobicContact SD-CB 4.09Å; M348-M357 HydrophobicContact SD-CG 4.41Å; M357-P359 CarbonylContact C-O 3.52Å; M357-M361 HydrophobicContact CE-CB 4.09Å; M357-M361 HydrophobicContact CE-CG 3.46Å; M357-M361 VanDerWaalsContact CE-CG 3.46Å; M357-M361 HydrophobicContact SD-CG 4.31Å; M357-I380 HydrophobicContact SD-CD1 4.21Å; M357-L432 HydrophobicContact CE-CB 4.3Å; M357-L432 HydrophobicContact CE-CD1 4.12Å; M357-L432 HydrophobicContact CE-CD2 3.96Å; M357-L432 HydrophobicContact CE-CG 4.36Å; M357-L432 HydrophobicContact SD-CD2 4.34Å; M357-L434 HydrophobicContact CG-CD1 3.74Å; M357-L434 HydrophobicContact CG-CD2 4.27Å; M357-L434 HydrophobicContact CG-CG 3.89Å; M357-L434 HydrophobicContact SD-CD1 4.23Å; M357-L434 HydrophobicContact SD-CD2 4.23Å; M357-L434 HydrophobicContact SD-CG 4.44Å
358	F	98.1	Very high	97.1	Very high	29 Å²	29	43.7 Å²	43.7	13%	0.127	22%	0.222	C	C	.	.	S	Bend	trans	-140.8	123.2	166.3	-172.6	-87	0	0	0	110.5	L337 F341 M348 K498 N501 N502	L337-F358 HydrophobicContact CD2-CE1 4.48Å; L337-F358 HydrophobicContact CD2-CZ 4.17Å; F341-F358 HydrophobicContact CE2-CD1 4.25Å; F341-F358 AromaticContact CE2-CE1 3.89Å; F341-F358 HydrophobicContact CE2-CE1 3.89Å; F341-F358 HydrophobicContact CZ-CD1 4.13Å; F341-F358 AromaticContact CZ-CE1 3.95Å; F341-F358 HydrophobicContact CZ-CE1 3.95Å; M348-F358 WeakPolarHBondContact CE-O 3.49Å; M348-F358 VanDerWaalsContact SD-O 3.39Å; F358-K498 HydrophobicContact CD1-CD 3.84Å; F358-K498 PolarHBondContact O-NZ 3.33Å; F358-N501 HydrophobicContact CE1-CB 3.88Å; F358-N501 HydrophobicContact CZ-CB 3.8Å; F358-N501 WeakPolarHBondContact CZ-O 3.5Å; F358-N502 HydrophobicContact CD1-CB 4.05Å; F358-N502 HydrophobicContact CD2-CB 3.84Å; F358-N502 HydrophobicContact CE1-CB 3.95Å; F358-N502 HydrophobicContact CE2-CB 3.74Å; F358-N502 HydrophobicContact CG-CB 4Å; F358-N502 HydrophobicContact CZ-CB 3.81Å
359	P	97.7	Very high	96.9	Very high	6 Å²	6	45.3 Å²	45.3	4%	0.039	23%	0.231	C	C	.	.	S	Bend	cis	-63	164.8	1.9	-18.3	31.8	0	0	0	113.1	L337 W338 F341 M357	L337-P359 HydrophobicContact CD2-CB 4.2Å; L337-P359 HydrophobicContact CD2-CG 4.03Å; L337-P359 HydrophobicContact CG-CG 3.92Å; W338-P359 HydrophobicContact CD2-CB 4.13Å; W338-P359 HydrophobicContact CD2-CG 4.04Å; W338-P359 HydrophobicContact CE3-CG 4.3Å; W338-P359 HydrophobicContact CG-CG 4.46Å; W338-P359 HydrophobicContact CH2-CB 4.44Å; W338-P359 WeakPolarHBondContact CH2-O 3.32Å; W338-P359 HydrophobicContact CZ2-CB 3.81Å; W338-P359 HydrophobicContact CZ2-CG 4.36Å; W338-P359 VanDerWaalsContact CZ2-O 3.28Å; W338-P359 WeakPolarHBondContact CZ2-O 3.24Å; F341-P359 HydrophobicContact CD2-CG 3.43Å; F341-P359 VanDerWaalsContact CD2-CG 3.43Å; F341-P359 HydrophobicContact CE2-CG 3.61Å; F341-P359 HydrophobicContact CG-CG 4.46Å; M357-P359 CarbonylContact C-O 3.52Å
360	Q	96.4	Very high	96.6	Very high	48 Å²	48	46.1 Å²	46.1	22%	0.224	24%	0.24	C	C	.	.			trans	-81.4	131.8	178.9	-69.4	173.3	-19.4	0	0	109	K362 H430	Q360-K362 HydrophobicContact CB-CD 4.42Å; Q360-K362 HydrophobicContact CB-CG 4.25Å; Q360-K362 PolarHBondContact O-N 3.38Å; Q360-K362 VanDerWaalsContact O-N 3.08Å; Q360-H430 HydrophobicContact CG-CB 4.26Å
361	M	97.3	Very high	96.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.277	C	S	.	.			trans	-66.1	110.2	170.3	-64.5	-63.3	-65.4	0	0	108.4	L332 W338 M357 F363 L378 F429 P455 T481	L332-M361 HydrophobicContact CD1-CE 3.85Å; L332-M361 HydrophobicContact CD1-SD 4.29Å; W338-M361 HydrophobicContact CH2-CG 4.34Å; W338-M361 HydrophobicContact CH2-SD 3.49Å; W338-M361 WeakPolarHBondContact CH2-SD 3.47Å; W338-M361 HydrophobicContact CZ2-CG 4.08Å; W338-M361 HydrophobicContact CZ2-SD 3.28Å; W338-M361 WeakPolarHBondContact CZ2-SD 3.5Å; W338-M361 HydrophobicContact CZ3-SD 4.39Å; M357-M361 HydrophobicContact CE-CB 4.09Å; M357-M361 HydrophobicContact CE-CG 3.46Å; M357-M361 VanDerWaalsContact CE-CG 3.46Å; M357-M361 HydrophobicContact SD-CG 4.31Å; M361-F363 HydrophobicContact CB-CE2 4.19Å; M361-F363 HydrophobicContact CB-CZ 4.22Å; M361-F363 HydrophobicContact CE-CE1 4.02Å; M361-F363 HydrophobicContact CE-CZ 3.53Å; M361-L378 HydrophobicContact CB-CD1 3.81Å; M361-L378 HydrophobicContact CE-CD1 4.24Å; M361-L378 HydrophobicContact CG-CD1 3.94Å; M361-F429 HydrophobicContact CB-CB 4.2Å; M361-F429 PolarHBondContact O-N 3.18Å; M361-P455 HydrophobicContact CE-CB 3.68Å; M361-P455 HydrophobicContact CE-CG 4.27Å; M361-P455 HydrophobicContact SD-CB 4.24Å; M361-P455 HydrophobicContact SD-CG 4.25Å; M361-T481 HydrophobicContact CE-CG2 3.78Å; M361-T481 HydrophobicContact SD-CG2 3.83Å
362	K	97.2	Very high	96.2	Very high	70 Å²	70	53.5 Å²	53.5	30%	0.304	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.1	-177.9	-75.9	177.4	-180	169.5	0	108.9	E333 Q360 V426 V427 S428	E333-K362 HydrophobicContact CB-CB 3.61Å; E333-K362 WeakPolarHBondContact CB-O 3.47Å; E333-K362 HydrophobicContact CG-CB 4.32Å; E333-K362 PolarHBondContact N-O 2.67Å; Q360-K362 HydrophobicContact CB-CD 4.42Å; Q360-K362 HydrophobicContact CB-CG 4.25Å; Q360-K362 PolarHBondContact O-N 3.38Å; Q360-K362 VanDerWaalsContact O-N 3.08Å; K362-V426 HydrophobicContact CB-CG1 3.95Å; K362-V426 HydrophobicContact CD-CG1 4.38Å; K362-V426 HydrophobicContact CG-CG1 4.27Å; K362-V427 CarbonylContact C-O 3.39Å; K362-V427 VanDerWaalsContact CA-O 3.27Å; K362-V427 WeakPolarHBondContact CA-O 3.4Å; K362-S428 WeakPolarHBondContact CE-OG 3.46Å
363	F	97.7	Very high	96.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	140.8	-176.4	-49.5	-81.1	0	0	0	110.5	V330 T331 L332 M361 L378 V427 F429 F457 F478	V330-F363 HydrophobicContact CG1-CB 3.99Å; V330-F363 HydrophobicContact CG1-CD1 3.95Å; V330-F363 HydrophobicContact CG1-CG 4.22Å; T331-F363 WeakPolarHBondContact O-CA 3.37Å; L332-F363 HydrophobicContact CB-CD1 3.88Å; L332-F363 HydrophobicContact CB-CE1 4.14Å; L332-F363 HydrophobicContact CD1-CD1 4.15Å; L332-F363 HydrophobicContact CD1-CE1 3.67Å; L332-F363 HydrophobicContact CD1-CZ 4.34Å; M361-F363 HydrophobicContact CB-CE2 4.19Å; M361-F363 HydrophobicContact CB-CZ 4.22Å; M361-F363 HydrophobicContact CE-CE1 4.02Å; M361-F363 HydrophobicContact CE-CZ 3.53Å; F363-L378 HydrophobicContact CE2-CD1 4.12Å; F363-L378 HydrophobicContact CZ-CD1 4.16Å; F363-V427 PolarHBondContact N-O 3.18Å; F363-V427 PolarHBondContact O-N 3.42Å; F363-F429 AromaticContact CD2-CD2 3.84Å; F363-F429 HydrophobicContact CD2-CD2 3.84Å; F363-F429 AromaticContact CD2-CE2 3.73Å; F363-F429 HydrophobicContact CD2-CE2 3.73Å; F363-F429 AromaticContact CE2-CD2 3.6Å; F363-F429 HydrophobicContact CE2-CD2 3.6Å; F363-F429 AromaticContact CE2-CE2 3.69Å; F363-F429 HydrophobicContact CE2-CE2 3.69Å; F363-F457 HydrophobicContact CD1-CG 4.43Å; F363-F457 AromaticContact CD2-CD2 3.57Å; F363-F457 HydrophobicContact CD2-CD2 3.57Å; F363-F457 AromaticContact CD2-CE2 3.84Å; F363-F457 HydrophobicContact CD2-CE2 3.84Å; F363-F457 HydrophobicContact CD2-CG 4.15Å; F363-F457 HydrophobicContact CE1-CB 3.94Å; F363-F457 HydrophobicContact CE1-CG 4.25Å; F363-F457 HydrophobicContact CE2-CB 4.04Å; F363-F457 AromaticContact CE2-CD2 3.46Å; F363-F457 HydrophobicContact CE2-CD2 3.46Å; F363-F457 VanDerWaalsContact CE2-CD2 3.46Å; F363-F457 HydrophobicContact CE2-CE2 4.18Å; F363-F457 AromaticContact CE2-CG 3.95Å; F363-F457 HydrophobicContact CE2-CG 3.95Å; F363-F457 HydrophobicContact CG-CD2 4.16Å; F363-F457 HydrophobicContact CG-CE2 4.35Å; F363-F457 HydrophobicContact CG-CG 4.37Å; F363-F457 HydrophobicContact CZ-CB 3.63Å; F363-F457 AromaticContact CZ-CD2 3.97Å; F363-F457 HydrophobicContact CZ-CD2 3.97Å; F363-F457 AromaticContact CZ-CG 3.99Å; F363-F457 HydrophobicContact CZ-CG 3.99Å; F363-F478 AromaticContact CD1-CE2 3.88Å; F363-F478 HydrophobicContact CD1-CE2 3.88Å; F363-F478 HydrophobicContact CD1-CZ 4.4Å; F363-F478 AromaticContact CE1-CD2 3.83Å; F363-F478 HydrophobicContact CE1-CD2 3.83Å; F363-F478 AromaticContact CE1-CE2 3.6Å; F363-F478 HydrophobicContact CE1-CE2 3.6Å; F363-F478 HydrophobicContact CE1-CZ 4.49Å
364	R	97.2	Very high	96.1	Very high	113 Å²	113	46.5 Å²	46.5	43%	0.426	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.8	160.1	168.9	153.4	51	-93.1	-8.8	107.9	V330 T331 E333	V330-R364 WeakPolarHBondContact CA-O 3.37Å; T331-R364 PolarHBondContact N-O 2.86Å; T331-R364 PolarHBondContact O-N 3.19Å; T331-R364 PolarHBondContact OG1-O 2.94Å; E333-R364 VanDerWaalsContact CD-NH2 3.32Å; E333-R364 HydrophobicContact CG-CB 4.35Å; E333-R364 IonicContact OE1-CZ 3.28Å; E333-R364 VanDerWaalsContact OE1-CZ 3.26Å; E333-R364 IonicContact OE1-NH1 2.89Å; E333-R364 PolarHBondContact OE1-NH1 3.22Å; E333-R364 IonicContact OE1-NH2 3.44Å; E333-R364 PolarHBondContact OE1-NH2 3.3Å; E333-R364 IonicContact OE2-CZ 3.02Å; E333-R364 IonicContact OE2-NH1 3.26Å; E333-R364 PolarHBondContact OE2-NH1 3.4Å; E333-R364 IonicContact OE2-NH2 2.61Å; E333-R364 PolarHBondContact OE2-NH2 3.15Å
365	V	96.7	Very high	96.1	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.8	-177.4	-172	0	0	0	0	108.3	K329 V330 L368 M423 V427 F457 L459	K329-V365 CarbonylContact O-C 3.29Å; K329-V365 WeakPolarHBondContact O-CA 3.21Å; V330-V365 HydrophobicContact CG2-CG1 4.33Å; V330-V365 HydrophobicContact CG2-CG2 4.43Å; V365-L368 HydrophobicContact CG1-CD1 3.83Å; V365-L368 HydrophobicContact CG1-CD2 4.08Å; V365-L368 HydrophobicContact CG1-CG 3.97Å; V365-M423 WeakPolarHBondContact O-CG 3.43Å; V365-V427 HydrophobicContact CG2-CG2 4.24Å; V365-F457 HydrophobicContact CG2-CZ 4.18Å; V365-L459 HydrophobicContact CG1-CD1 3.87Å
366	S	95.7	Very high	96	Very high	53 Å²	53	40.2 Å²	40.2	37%	0.371	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	164.7	177.4	56	0	0	0	0	110.6	P328 K329	P328-S366 CarbonylContact C-O 3.57Å; P328-S366 WeakPolarHBondContact CA-O 3.35Å; K329-S366 PolarHBondContact N-O 3.18Å; K329-S366 PolarHBondContact O-N 3.3Å
367	G	94.1	Very high	96	Very high	35 Å²	35	35.7 Å²	35.7	36%	0.361	18%	0.183	S	C	.	.	S	Bend	trans	75.3	25.1	177.6	0	0	0	0	0	115.3	D327 M423	D327-G367 CarbonylContact C-O 3.56Å; D327-G367 VanDerWaalsContact C-O 3.29Å; D327-G367 PolarHBondContact N-O 2.7Å; D327-G367 VanDerWaalsContact N-O 3.11Å; D327-G367 WeakPolarHBondContact O-CA 3.34Å; G367-M423 PolarHBondContact N-SD 3.35Å; G367-M423 VanDerWaalsContact N-SD 3.42Å
368	L	94.5	Very high	95.9	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.063	18%	0.18	C	C	.	.			trans	-90.5	148.7	168.2	-50.2	-177	0	0	0	110	P328 V365 A370 Y374 W422 M423 L459	P328-L368 HydrophobicContact CB-CD2 3.7Å; V365-L368 HydrophobicContact CG1-CD1 3.83Å; V365-L368 HydrophobicContact CG1-CD2 4.08Å; V365-L368 HydrophobicContact CG1-CG 3.97Å; L368-A370 PolarHBondContact O-N 2.67Å; L368-Y374 HydrophobicContact CB-CE2 3.86Å; L368-Y374 HydrophobicContact CD1-CD2 4.09Å; L368-Y374 HydrophobicContact CD1-CE2 4.24Å; L368-Y374 HydrophobicContact CD1-CG 4.39Å; L368-Y374 HydrophobicContact CD2-CE1 4.22Å; L368-Y374 HydrophobicContact CG-CE2 4.48Å; L368-W422 HydrophobicContact CD1-CB 3.99Å; L368-M423 HydrophobicContact CB-CE 4.1Å; L368-M423 HydrophobicContact CB-CG 4.42Å; L368-M423 HydrophobicContact CB-SD 3.98Å; L368-M423 HydrophobicContact CD1-CG 4.28Å; L368-M423 HydrophobicContact CG-CG 4.24Å; L368-M423 HydrophobicContact CG-SD 4.24Å; L368-M423 PolarHBondContact N-SD 3.32Å; L368-M423 WeakPolarHBondContact O-CE 3.48Å; L368-L459 HydrophobicContact CD1-CD1 4.21Å; L368-L459 HydrophobicContact CD2-CD1 3.57Å; L368-L459 HydrophobicContact CD2-CD2 4.15Å; L368-L459 HydrophobicContact CD2-CG 4.49Å
369	D	94.3	Very high	95.8	Very high	38 Å²	38	34.1 Å²	34.1	20%	0.203	18%	0.176	C	C	.	.			trans	-58.2	129	159.1	169.1	29.8	0	0	0	111.1	V324 D326 K371 A372 Y374 G419	V324-D369 HydrophobicContact CG1-CB 3.48Å; V324-D369 VanDerWaalsContact CG1-CB 3.48Å; D326-D369 PolarHBondContact OD1-N 2.8Å; D326-D369 VanDerWaalsContact OD1-N 3.12Å; D369-K371 PolarHBondContact O-N 3.02Å; D369-K371 PolarHBondContact OD1-N 3.21Å; D369-A372 HydrophobicContact CB-CB 4.03Å; D369-A372 VanDerWaalsContact OD2-CB 3.25Å; D369-A372 WeakPolarHBondContact OD2-CB 3.25Å; D369-A372 PolarHBondContact OD2-N 3.39Å; D369-Y374 PolarHBondContact N-OH 3.17Å; D369-G419 WeakPolarHBondContact O-CA 3.42Å
370	A	93.5	Very high	95.8	Very high	39 Å²	39	34.2 Å²	34.2	32%	0.322	18%	0.176	S	C	.	.	S	Bend	trans	-58	-33.2	176.9	0	0	0	0	0	112.9	L368 T418 E420	L368-A370 PolarHBondContact O-N 2.67Å; A370-T418 WeakPolarHBondContact O-CB 3.31Å; A370-E420 HydrophobicContact CB-CB 3.97Å; A370-E420 HydrophobicContact CB-CG 4.36Å; A370-E420 PolarHBondContact O-N 3.16Å
371	K	93.1	Very high	95.7	Very high	182 Å²	182	33 Å²	33	79%	0.791	17%	0.172	S	C	*	.	S	Bend	trans	-90.6	-39.1	-172	-62.6	174.6	-176.8	172.4	0	113.4	D369	D369-K371 PolarHBondContact O-N 3.02Å; D369-K371 PolarHBondContact OD1-N 3.21Å
372	A	93.6	Very high	95.7	Very high	14 Å²	14	34.6 Å²	34.6	12%	0.116	19%	0.185	C	C	.	.	S	Bend	trans	-58.1	149.4	176.8	0	0	0	0	0	112.3	D369 Y374 T418 G419	D369-A372 HydrophobicContact CB-CB 4.03Å; D369-A372 VanDerWaalsContact OD2-CB 3.25Å; D369-A372 WeakPolarHBondContact OD2-CB 3.25Å; D369-A372 PolarHBondContact OD2-N 3.39Å; A372-Y374 HydrophobicContact CB-CE2 3.74Å; A372-Y374 WeakPolarHBondContact O-CD2 3.45Å; A372-Y374 WeakPolarHBondContact O-CE2 3.2Å; A372-T418 CarbonylContact O-C 3.56Å; A372-T418 VanDerWaalsContact O-CA 3.32Å; A372-T418 WeakPolarHBondContact O-CA 3.27Å; A372-G419 PolarHBondContact O-N 2.87Å
373	K	94.9	Very high	95.7	Very high	96 Å²	96	33.2 Å²	33.2	42%	0.417	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.5	174	-71.5	-167.3	178.2	-168.2	0	111.1	T417 T418 A462 N463	K373-T417 WeakPolarHBondContact CA-O 3.28Å; K373-T418 HydrophobicContact CG-CG2 4.35Å; K373-A462 CarbonylContact C-O 3.59Å; K373-A462 WeakPolarHBondContact CB-O 3.19Å; K373-A462 CarbonylContact O-C 3.59Å; K373-A462 PolarHBondContact O-N 2.92Å; K373-N463 HydrophobicContact CB-CB 4.33Å; K373-N463 HydrophobicContact CD-CB 4.18Å
374	Y	96.1	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	148.2	177.6	-54.1	-95.2	0	0	0	111.1	D326 L368 D369 A372 T417 W422 L459 V460 R461	D326-Y374 PolarHBondContact OD1-OH 3.27Å; D326-Y374 PolarHBondContact OD2-OH 2.89Å; D326-Y374 VanDerWaalsContact OD2-OH 3.06Å; L368-Y374 HydrophobicContact CB-CE2 3.86Å; L368-Y374 HydrophobicContact CD1-CD2 4.09Å; L368-Y374 HydrophobicContact CD1-CE2 4.24Å; L368-Y374 HydrophobicContact CD1-CG 4.39Å; L368-Y374 HydrophobicContact CD2-CE1 4.22Å; L368-Y374 HydrophobicContact CG-CE2 4.48Å; D369-Y374 PolarHBondContact N-OH 3.17Å; A372-Y374 HydrophobicContact CB-CE2 3.74Å; A372-Y374 WeakPolarHBondContact O-CD2 3.45Å; A372-Y374 WeakPolarHBondContact O-CE2 3.2Å; Y374-T417 PolarHBondContact N-O 2.82Å; Y374-T417 PolarHBondContact O-N 3.37Å; Y374-W422 PolarHBondContact O-NE1 3.27Å; Y374-L459 HydrophobicContact CD1-CD2 3.7Å; Y374-L459 HydrophobicContact CD1-CG 4.3Å; Y374-L459 HydrophobicContact CE1-CD2 4.09Å; Y374-V460 CarbonylContact C-O 3.56Å; Y374-V460 VanDerWaalsContact CA-O 3.24Å; Y374-V460 WeakPolarHBondContact CA-O 3.2Å; Y374-R461 HydrophobicContact CD1-CB 4.02Å; Y374-R461 HydrophobicContact CD1-CG 4.39Å; Y374-R461 HydrophobicContact CE1-CB 3.91Å; Y374-R461 HydrophobicContact CE1-CG 3.97Å; Y374-R461 PolarHBondContact OH-NH1 3.09Å
375	I	96.8	Very high	95.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.7	166.9	-61.7	167.4	0	0	0	107.4	L377 I411 P416 V460 A462 D464 I465 L468	I375-L377 HydrophobicContact CG2-CD2 4.4Å; I375-I411 HydrophobicContact CG2-CG2 3.86Å; I375-P416 HydrophobicContact CD1-CB 4.31Å; I375-P416 HydrophobicContact CG1-CB 3.7Å; I375-V460 PolarHBondContact N-O 3.42Å; I375-V460 PolarHBondContact O-N 3.18Å; I375-A462 HydrophobicContact CD1-CB 3.86Å; I375-A462 HydrophobicContact CG1-CB 4.37Å; I375-D464 WeakPolarHBondContact CD1-O 3.47Å; I375-I465 HydrophobicContact CD1-CB 4.37Å; I375-I465 HydrophobicContact CD1-CG1 3.83Å; I375-L468 HydrophobicContact CB-CD2 4.06Å; I375-L468 HydrophobicContact CD1-CD1 4.35Å; I375-L468 HydrophobicContact CD1-CD2 3.69Å; I375-L468 HydrophobicContact CD1-CG 3.89Å; I375-L468 HydrophobicContact CG1-CD2 4.48Å; I375-L468 HydrophobicContact CG2-CD1 4.23Å; I375-L468 HydrophobicContact CG2-CD2 4Å
376	L	97	Very high	95.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129	174.2	-56.4	-173.1	0	0	0	108.8	H412 S415 W422 V427 F429 F457 H458 L459	L376-H412 HydrophobicContact CB-CB 4.36Å; L376-H412 VanDerWaalsContact O-CB 3.24Å; L376-H412 WeakPolarHBondContact O-CB 3.27Å; L376-H412 PolarHBondContact O-N 3.46Å; L376-S415 PolarHBondContact N-OG 2.81Å; L376-S415 PolarHBondContact O-OG 3.38Å; L376-W422 HydrophobicContact CB-CH2 4.12Å; L376-W422 HydrophobicContact CB-CZ2 4.17Å; L376-W422 HydrophobicContact CD1-CB 4.48Å; L376-W422 HydrophobicContact CD1-CD2 3.46Å; L376-W422 VanDerWaalsContact CD1-CD2 3.46Å; L376-W422 HydrophobicContact CD1-CE3 3.4Å; L376-W422 HydrophobicContact CD1-CG 3.99Å; L376-W422 HydrophobicContact CD1-CH2 4.05Å; L376-W422 HydrophobicContact CD1-CZ2 4.13Å; L376-W422 HydrophobicContact CD1-CZ3 3.71Å; L376-W422 HydrophobicContact CG-CD2 3.9Å; L376-W422 HydrophobicContact CG-CE3 4.17Å; L376-W422 HydrophobicContact CG-CG 4.44Å; L376-W422 HydrophobicContact CG-CH2 4.07Å; L376-W422 HydrophobicContact CG-CZ2 3.82Å; L376-W422 HydrophobicContact CG-CZ3 4.25Å; L376-V427 HydrophobicContact CD1-CB 4.39Å; L376-V427 HydrophobicContact CD1-CG1 3.89Å; L376-V427 HydrophobicContact CD1-CG2 3.74Å; L376-F429 HydrophobicContact CB-CZ 4.44Å; L376-F457 HydrophobicContact CB-CE2 4.08Å; L376-F457 HydrophobicContact CB-CZ 4.28Å; L376-F457 HydrophobicContact CD1-CE2 4.3Å; L376-F457 HydrophobicContact CD1-CZ 3.99Å; L376-F457 HydrophobicContact CD2-CE2 4.48Å; L376-F457 HydrophobicContact CD2-CZ 3.84Å; L376-F457 HydrophobicContact CG-CZ 4.25Å; L376-H458 WeakPolarHBondContact CA-O 3.43Å; L376-L459 HydrophobicContact CD2-CB 3.87Å; L376-L459 HydrophobicContact CD2-CD1 3.62Å; L376-L459 HydrophobicContact CD2-CG 3.59Å
377	L	95.9	Very high	95.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.4	179.9	64.5	87.2	0	0	0	111.2	I375 M409 Y410 I411 H458 L468 F473	I375-L377 HydrophobicContact CG2-CD2 4.4Å; L377-M409 HydrophobicContact CD1-CB 4.19Å; L377-M409 HydrophobicContact CD1-CG 4.16Å; L377-M409 HydrophobicContact CD1-SD 4.12Å; L377-M409 HydrophobicContact CD2-SD 4.4Å; L377-Y410 CarbonylContact C-O 3.57Å; L377-Y410 WeakPolarHBondContact CA-O 3.38Å; L377-Y410 WeakPolarHBondContact CB-O 3.5Å; L377-I411 HydrophobicContact CB-CB 4.47Å; L377-I411 HydrophobicContact CB-CG1 4.15Å; L377-I411 HydrophobicContact CD2-CG1 4.31Å; L377-H458 HydrophobicContact CD1-CB 3.52Å; L377-H458 HydrophobicContact CG-CB 3.83Å; L377-H458 PolarHBondContact N-O 2.83Å; L377-H458 PolarHBondContact O-N 3.01Å; L377-L468 HydrophobicContact CD2-CD1 3.88Å; L377-L468 HydrophobicContact CD2-CD2 4.09Å; L377-F473 HydrophobicContact CD1-CE1 4.33Å; L377-F473 HydrophobicContact CD2-CE1 4.09Å
378	L	97.1	Very high	95.9	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130	178.1	-168.8	152.3	0	0	0	108.7	M361 F363 I380 Y410 F429 L432 P455 R456	M361-L378 HydrophobicContact CB-CD1 3.81Å; M361-L378 HydrophobicContact CE-CD1 4.24Å; M361-L378 HydrophobicContact CG-CD1 3.94Å; F363-L378 HydrophobicContact CE2-CD1 4.12Å; F363-L378 HydrophobicContact CZ-CD1 4.16Å; L378-I380 HydrophobicContact CD2-CD1 4.31Å; L378-I380 HydrophobicContact CD2-CG1 3.72Å; L378-Y410 PolarHBondContact N-O 2.82Å; L378-Y410 PolarHBondContact O-N 2.83Å; L378-F429 HydrophobicContact CB-CD1 3.74Å; L378-F429 HydrophobicContact CB-CE1 3.69Å; L378-F429 HydrophobicContact CB-CG 4.37Å; L378-F429 HydrophobicContact CB-CZ 4.28Å; L378-F429 HydrophobicContact CD1-CB 4.43Å; L378-F429 HydrophobicContact CD1-CD1 4.34Å; L378-F429 HydrophobicContact CD1-CD2 4.43Å; L378-F429 HydrophobicContact CD1-CG 4.14Å; L378-L432 HydrophobicContact CB-CD1 4.24Å; L378-L432 HydrophobicContact CD2-CD1 3.71Å; L378-L432 HydrophobicContact CG-CD1 4.4Å; L378-P455 HydrophobicContact CD2-CB 4.4Å; L378-R456 WeakPolarHBondContact CA-O 3.48Å
379	D	95.4	Very high	96	Very high	7 Å²	7	47.6 Å²	47.6	4%	0.037	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	164.3	164.8	84	-15.9	0	0	0	110.9	M409 R456 H458	D379-M409 HydrophobicContact CB-CG 4.29Å; D379-R456 PolarHBondContact N-O 2.96Å; D379-R456 VanDerWaalsContact N-O 3.07Å; D379-R456 PolarHBondContact O-N 2.97Å; D379-R456 WeakPolarHBondContact OD1-CB 3.19Å; D379-R456 WeakPolarHBondContact OD1-CD 3.36Å; D379-R456 IonicContact OD1-CZ 3.8Å; D379-R456 IonicContact OD1-NE 2.68Å; D379-R456 IonicContact OD1-NH1 3.35Å; D379-R456 PolarHBondContact OD1-NH1 3.19Å; D379-R456 IonicContact OD2-NH1 2.7Å; D379-R456 PolarHBondContact OD2-NH1 2.93Å; D379-H458 WeakPolarHBondContact CB-NE2 3.46Å; D379-H458 IonicContact OD1-CD2 3.9Å; D379-H458 IonicContact OD1-CE1 3.27Å; D379-H458 IonicContact OD1-NE2 3.37Å; D379-H458 PolarHBondContact OD1-NE2 2.81Å; D379-H458 IonicContact OD2-NE2 2.67Å; D379-H458 PolarHBondContact OD2-NE2 3.5Å; D379-H458 VanDerWaalsContact OD2-NE2 3.12Å
380	I	96.8	Very high	96.2	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.041	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.5	178.2	-56.9	-177	0	0	0	105.7	M357 L378 L432 L434 T445 L447 Y453 F483	M357-I380 HydrophobicContact SD-CD1 4.21Å; L378-I380 HydrophobicContact CD2-CD1 4.31Å; L378-I380 HydrophobicContact CD2-CG1 3.72Å; I380-L432 HydrophobicContact CD1-CD2 4.43Å; I380-L434 HydrophobicContact CD1-CD2 3.53Å; I380-T445 HydrophobicContact CB-CG2 4.16Å; I380-T445 HydrophobicContact CD1-CG2 4.16Å; I380-T445 HydrophobicContact CG1-CG2 4.33Å; I380-L447 HydrophobicContact CB-CD2 4.4Å; I380-L447 HydrophobicContact CG2-CD2 3.91Å; I380-Y453 HydrophobicContact CG2-CD1 3.97Å; I380-Y453 HydrophobicContact CG2-CG 4.02Å; I380-F483 HydrophobicContact CD1-CE1 4.35Å; I380-F483 HydrophobicContact CD1-CZ 4.24Å; I380-F483 HydrophobicContact CG2-CE1 4.22Å; I380-F483 HydrophobicContact CG2-CZ 4.1Å
381	V	95.8	Very high	96.3	Very high	23 Å²	23	50.7 Å²	50.7	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	152.5	-179.2	-57	0	0	0	0	109.6	A383 K407 Y453 Q454 R456	V381-A383 PolarHBondContact O-N 3.44Å; V381-K407 HydrophobicContact CG1-CD 4.15Å; V381-Y453 WeakPolarHBondContact O-CA 3.49Å; V381-Y453 WeakPolarHBondContact O-CD1 3.35Å; V381-Q454 HydrophobicContact CG2-CB 4.4Å; V381-Q454 PolarHBondContact N-O 2.85Å; V381-Q454 PolarHBondContact O-N 3.14Å; V381-R456 HydrophobicContact CG2-CG 4.4Å
382	A	96.4	Very high	96.3	Very high	34 Å²	34	48.2 Å²	48.2	28%	0.281	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	136	167.8	0	0	0	0	0	110.3	E404 Y453	A382-E404 HydrophobicContact CB-CG 4.48Å; A382-E404 WeakPolarHBondContact CB-OE1 3.36Å; A382-E404 PolarHBondContact N-OE1 2.98Å; A382-Y453 HydrophobicContact CB-CE1 4.45Å
383	A	96.6	Very high	96.3	Very high	41 Å²	41	52.4 Å²	52.4	34%	0.339	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-26.2	176.2	0	0	0	0	0	111.9	V381 K452 Q454 E482	V381-A383 PolarHBondContact O-N 3.44Å; A383-K452 HydrophobicContact CB-CB 4.18Å; A383-K452 HydrophobicContact CB-CD 4.22Å; A383-K452 HydrophobicContact CB-CG 4.06Å; A383-K452 PolarHBondContact N-O 3.28Å; A383-Q454 HydrophobicContact CB-CB 4.39Å; A383-E482 HydrophobicContact CB-CG 4.43Å
384	D	96.3	Very high	96.4	Very high	36 Å²	36	56.3 Å²	56.3	19%	0.193	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	169.5	178.5	55.2	62.8	0	0	0	110.9	Y386 Y388 K452	D384-Y386 VanDerWaalsContact C-N 3.27Å; D384-Y386 HydrophobicContact CB-CD2 3.9Å; D384-Y386 HydrophobicContact CB-CE2 4.46Å; D384-Y386 PolarHBondContact O-N 3.2Å; D384-Y386 WeakPolarHBondContact OD1-CB 3.46Å; D384-Y386 PolarHBondContact OD1-N 3.09Å; D384-Y388 WeakPolarHBondContact OD1-CE2 3.22Å; D384-Y388 PolarHBondContact OD2-OH 3.36Å; D384-K452 WeakPolarHBondContact OD2-CD 3.42Å
385	D	96.3	Very high	96.4	Very high	120 Å²	120	58.5 Å²	58.5	64%	0.642	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	31	176.7	-71.2	-51	0	0	0	112.8	K400 A401	D385-K400 CarbonylContact O-C 3.58Å; D385-A401 VanDerWaalsContact C-CB 3.42Å; D385-A401 WeakPolarHBondContact O-CB 3.37Å; D385-A401 PolarHBondContact O-N 3.13Å
386	Y	97.5	Very high	96.4	Very high	120 Å²	120	61.8 Å²	61.8	47%	0.471	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.7	-179.7	-59.5	-62	0	0	0	114.1	D384 V397 H451	D384-Y386 VanDerWaalsContact C-N 3.27Å; D384-Y386 HydrophobicContact CB-CD2 3.9Å; D384-Y386 HydrophobicContact CB-CE2 4.46Å; D384-Y386 PolarHBondContact O-N 3.2Å; D384-Y386 WeakPolarHBondContact OD1-CB 3.46Å; D384-Y386 PolarHBondContact OD1-N 3.09Å; Y386-V397 HydrophobicContact CD1-CG1 3.68Å; Y386-V397 HydrophobicContact CD1-CG2 4.28Å; Y386-V397 HydrophobicContact CD2-CG2 4.35Å; Y386-V397 HydrophobicContact CE1-CG1 4.4Å; Y386-V397 HydrophobicContact CG-CG1 4.08Å; Y386-V397 HydrophobicContact CG-CG2 4Å; Y386-H451 PolarHBondContact O-CD2 3Å
387	R	97.8	Very high	96.5	Very high	108 Å²	108	65.1 Å²	65.1	41%	0.408	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133	162.9	-175.9	168.1	165.4	179.3	-8.4	109	A398 G399 K400 D402 H451	R387-A398 WeakPolarHBondContact O-CA 3.42Å; R387-A398 WeakPolarHBondContact O-CB 3.46Å; R387-A398 PolarHBondContact O-N 2.68Å; R387-G399 PolarHBondContact N-O 3.19Å; R387-G399 PolarHBondContact O-N 2.98Å; R387-K400 WeakPolarHBondContact CB-O 3.38Å; R387-D402 IonicContact CZ-OD1 3.45Å; R387-D402 IonicContact CZ-OD2 3.86Å; R387-D402 IonicContact NH1-OD1 2.63Å; R387-D402 PolarHBondContact NH1-OD1 1.84Å; R387-D402 IonicContact NH1-OD2 2.68Å; R387-D402 PolarHBondContact NH1-OD2 3.12Å; R387-H451 WeakPolarHBondContact CB-NE2 3.48Å
388	Y	98.3	Very high	96.5	Very high	33 Å²	33	67.7 Å²	67.7	13%	0.129	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	162.9	-173.8	-76.2	-90.5	0	0	0	113.5	D384 W395 M396 V397 M450 K452 I484	D384-Y388 WeakPolarHBondContact OD1-CE2 3.22Å; D384-Y388 PolarHBondContact OD2-OH 3.36Å; Y388-W395 HydrophobicContact CD1-CE3 4.46Å; Y388-W395 HydrophobicContact CG-CE3 4.48Å; Y388-M396 CarbonylContact C-O 3.52Å; Y388-M396 WeakPolarHBondContact CA-O 3.49Å; Y388-M396 WeakPolarHBondContact CD1-O 3.28Å; Y388-V397 HydrophobicContact CE1-CG2 4.07Å; Y388-M450 WeakPolarHBondContact CB-O 3.34Å; Y388-M450 PolarHBondContact N-O 3.28Å; Y388-M450 WeakPolarHBondContact O-CB 3.22Å; Y388-K452 HydrophobicContact CD2-CB 4.34Å; Y388-K452 HydrophobicContact CE2-CB 3.83Å; Y388-K452 HydrophobicContact CE2-CD 4.25Å; Y388-I484 HydrophobicContact CD1-CD1 4.37Å; Y388-I484 HydrophobicContact CD2-CD1 4.47Å; Y388-I484 HydrophobicContact CG-CD1 4.19Å
389	K	97.6	Very high	96.5	Very high	100 Å²	100	69.2 Å²	69.2	44%	0.435	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148	163.4	61.6	-171.8	174.4	-175.3	0	109.6	M396 A398	K389-M396 HydrophobicContact CG-CB 4.36Å; K389-M396 PolarHBondContact N-O 3.27Å; K389-M396 PolarHBondContact O-N 3.02Å; K389-A398 HydrophobicContact CB-CB 4.05Å; K389-A398 HydrophobicContact CD-CB 3.88Å; K389-A398 HydrophobicContact CG-CB 3.91Å
390	F	97.7	Very high	96.6	Very high	42 Å²	42	77 Å²	77	18%	0.184	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.1	171.1	-166	-107.4	0	0	0	109.2	S393 R394 W395 Q490 N491	F390-S393 VanDerWaalsContact CZ-CA 3.5Å; F390-R394 WeakPolarHBondContact CA-O 3.39Å; F390-R394 VanDerWaalsContact CD2-C 3.5Å; F390-R394 WeakPolarHBondContact CD2-O 3.34Å; F390-W395 HydrophobicContact CB-CD2 4.36Å; F390-W395 HydrophobicContact CB-CE3 4.1Å; F390-W395 HydrophobicContact CB-CH2 4.22Å; F390-W395 HydrophobicContact CB-CZ2 4.42Å; F390-W395 HydrophobicContact CB-CZ3 4.05Å; F390-W395 AromaticContact CD2-CD1 3.88Å; F390-W395 AromaticContact CD2-CD2 3.72Å; F390-W395 HydrophobicContact CD2-CD2 3.72Å; F390-W395 AromaticContact CD2-CE2 3.68Å; F390-W395 HydrophobicContact CD2-CE3 4.29Å; F390-W395 AromaticContact CD2-CG 3.87Å; F390-W395 HydrophobicContact CD2-CG 3.87Å; F390-W395 HydrophobicContact CD2-CZ2 4.25Å; F390-W395 AromaticContact CD2-NE1 3.75Å; F390-W395 HydrophobicContact CE2-CG 4.4Å; F390-W395 AromaticContact CE2-NE1 3.97Å; F390-Q490 HydrophobicContact CB-CB 3.6Å; F390-Q490 HydrophobicContact CB-CG 4.08Å; F390-Q490 HydrophobicContact CD1-CB 3.72Å; F390-Q490 WeakPolarHBondContact CD1-O 3.45Å; F390-Q490 HydrophobicContact CD2-CB 4.37Å; F390-Q490 HydrophobicContact CE1-CB 4.46Å; F390-Q490 VanDerWaalsContact CE1-O 3.25Å; F390-Q490 WeakPolarHBondContact CE1-O 3.33Å; F390-Q490 HydrophobicContact CG-CB 3.66Å; F390-N491 HydrophobicContact CE1-CB 4.22Å; F390-N491 HydrophobicContact CE2-CB 3.95Å; F390-N491 HydrophobicContact CZ-CB 3.59Å
391	H	95.9	Very high	96.5	Very high	100 Å²	100	77.8 Å²	77.8	46%	0.463	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	143.8	-178.9	-174.3	64.4	0	0	0	109.5	S393 R394 M396	H391-S393 PolarHBondContact O-N 2.85Å; H391-R394 PolarHBondContact N-O 2.78Å; H391-R394 PolarHBondContact O-N 2.82Å; H391-M396 HydrophobicContact CB-CE 4.04Å
392	N	93.4	Very high	96.4	Very high	130 Å²	130	79.5 Å²	79.5	70%	0.695	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	47.5	-177.5	-58.9	-15.8	0	0	0	112.8	R394	N392-R394 PolarHBondContact O-N 2.63Å
393	S	94	Very high	96.1	Very high	102 Å²	102	83.3 Å²	83.3	71%	0.713	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	25.9	-177.6	-59.4	0	0	0	0	115.1	F390 H391	F390-S393 VanDerWaalsContact CZ-CA 3.5Å; H391-S393 PolarHBondContact O-N 2.85Å
394	R	95.1	Very high	95.5	Very high	178 Å²	178	85.6 Å²	85.6	67%	0.672	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	141.6	-174.7	-163.9	-178.8	-59.1	-160.5	1.8	111.9	F390 H391 N392	F390-R394 WeakPolarHBondContact CA-O 3.39Å; F390-R394 VanDerWaalsContact CD2-C 3.5Å; F390-R394 WeakPolarHBondContact CD2-O 3.34Å; H391-R394 PolarHBondContact N-O 2.78Å; H391-R394 PolarHBondContact O-N 2.82Å; N392-R394 PolarHBondContact O-N 2.63Å
395	W	97.3	Very high	94.9	Very high	45 Å²	45	86.1 Å²	86.1	17%	0.17	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	129	166.8	-75.8	108.9	0	0	0	110.5	E347 Y388 F390 M450 I484 V486 Q490	E347-W395 HydrophobicContact CG-CZ2 3.96Å; Y388-W395 HydrophobicContact CD1-CE3 4.46Å; Y388-W395 HydrophobicContact CG-CE3 4.48Å; F390-W395 HydrophobicContact CB-CD2 4.36Å; F390-W395 HydrophobicContact CB-CE3 4.1Å; F390-W395 HydrophobicContact CB-CH2 4.22Å; F390-W395 HydrophobicContact CB-CZ2 4.42Å; F390-W395 HydrophobicContact CB-CZ3 4.05Å; F390-W395 AromaticContact CD2-CD1 3.88Å; F390-W395 AromaticContact CD2-CD2 3.72Å; F390-W395 HydrophobicContact CD2-CD2 3.72Å; F390-W395 AromaticContact CD2-CE2 3.68Å; F390-W395 HydrophobicContact CD2-CE3 4.29Å; F390-W395 AromaticContact CD2-CG 3.87Å; F390-W395 HydrophobicContact CD2-CG 3.87Å; F390-W395 HydrophobicContact CD2-CZ2 4.25Å; F390-W395 AromaticContact CD2-NE1 3.75Å; F390-W395 HydrophobicContact CE2-CG 4.4Å; F390-W395 AromaticContact CE2-NE1 3.97Å; W395-M450 HydrophobicContact CH2-CE 3.87Å; W395-M450 HydrophobicContact CZ3-CE 3.71Å; W395-I484 HydrophobicContact CB-CD1 4.5Å; W395-I484 HydrophobicContact CD2-CD1 3.47Å; W395-I484 VanDerWaalsContact CD2-CD1 3.47Å; W395-I484 HydrophobicContact CE3-CD1 3.68Å; W395-I484 HydrophobicContact CG-CD1 3.86Å; W395-I484 HydrophobicContact CH2-CB 4.32Å; W395-I484 HydrophobicContact CH2-CD1 4.28Å; W395-I484 HydrophobicContact CH2-CG2 3.66Å; W395-I484 HydrophobicContact CZ2-CB 4.3Å; W395-I484 HydrophobicContact CZ2-CD1 4.15Å; W395-I484 HydrophobicContact CZ2-CG2 4.14Å; W395-I484 HydrophobicContact CZ3-CD1 4.06Å; W395-I484 HydrophobicContact CZ3-CG2 3.95Å; W395-V486 HydrophobicContact CH2-CG1 3.95Å; W395-V486 HydrophobicContact CZ2-CG1 4.35Å; W395-Q490 HydrophobicContact CH2-CB 4.19Å; W395-Q490 HydrophobicContact CH2-CG 3.75Å; W395-Q490 HydrophobicContact CZ2-CB 4.05Å; W395-Q490 HydrophobicContact CZ2-CG 4.05Å
396	M	96.8	Very high	94.2	Very high	70 Å²	70	85.1 Å²	85.1	35%	0.345	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.4	178.4	-51.8	-163.9	-48.2	0	0	110.1	Y388 K389 H391 A398	Y388-M396 CarbonylContact C-O 3.52Å; Y388-M396 WeakPolarHBondContact CA-O 3.49Å; Y388-M396 WeakPolarHBondContact CD1-O 3.28Å; K389-M396 HydrophobicContact CG-CB 4.36Å; K389-M396 PolarHBondContact N-O 3.27Å; K389-M396 PolarHBondContact O-N 3.02Å; H391-M396 HydrophobicContact CB-CE 4.04Å; M396-A398 PolarHBondContact O-N 3.11Å
397	V	97.9	Very high	93.4	Very high	70 Å²	70	84.8 Å²	84.8	42%	0.424	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	134.6	170.3	177.1	0	0	0	0	109.1	Y386 Y388	Y386-V397 HydrophobicContact CD1-CG1 3.68Å; Y386-V397 HydrophobicContact CD1-CG2 4.28Å; Y386-V397 HydrophobicContact CD2-CG2 4.35Å; Y386-V397 HydrophobicContact CE1-CG1 4.4Å; Y386-V397 HydrophobicContact CG-CG1 4.08Å; Y386-V397 HydrophobicContact CG-CG2 4Å; Y388-V397 HydrophobicContact CE1-CG2 4.07Å
398	A	96.8	Very high	93	Very high	54 Å²	54	83.1 Å²	83.1	45%	0.446	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-26.9	176.4	0	0	0	0	0	112.2	R387 K389 M396	R387-A398 WeakPolarHBondContact O-CA 3.42Å; R387-A398 WeakPolarHBondContact O-CB 3.46Å; R387-A398 PolarHBondContact O-N 2.68Å; K389-A398 HydrophobicContact CB-CB 4.05Å; K389-A398 HydrophobicContact CD-CB 3.88Å; K389-A398 HydrophobicContact CG-CB 3.91Å; M396-A398 PolarHBondContact O-N 3.11Å
399	G	96.9	Very high	92.7	Very high	32 Å²	32	86.2 Å²	86.2	33%	0.33	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	171.9	-166.5	178.3	0	0	0	0	0	111.7	R387	R387-G399 PolarHBondContact N-O 3.19Å; R387-G399 PolarHBondContact O-N 2.98Å
400	K	96.9	Very high	92.6	Very high	172 Å²	172	83.8 Å²	83.8	75%	0.748	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	151.1	169.1	-174.7	175.1	176.8	177	0	110.6	D385 R387	D385-K400 CarbonylContact O-C 3.58Å; R387-K400 WeakPolarHBondContact CB-O 3.38Å
401	A	96.4	Very high	92.5	Very high	23 Å²	23	84.4 Å²	84.4	19%	0.19	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-59.2	144.9	173.1	0	0	0	0	0	113.2	D385 H451	D385-A401 VanDerWaalsContact C-CB 3.42Å; D385-A401 WeakPolarHBondContact O-CB 3.37Å; D385-A401 PolarHBondContact O-N 3.13Å; A401-H451 VanDerWaalsContact CA-NE2 3.33Å; A401-H451 WeakPolarHBondContact CA-NE2 3.4Å
402	D	93	Very high	92.5	Very high	59 Å²	59	80 Å²	80	32%	0.316	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-66.9	145.4	163	-56.3	-26.9	0	0	0	108.6	R387 E404 N448 H451	R387-D402 IonicContact CZ-OD1 3.45Å; R387-D402 IonicContact CZ-OD2 3.86Å; R387-D402 IonicContact NH1-OD1 2.63Å; R387-D402 PolarHBondContact NH1-OD1 1.84Å; R387-D402 IonicContact NH1-OD2 2.68Å; R387-D402 PolarHBondContact NH1-OD2 3.12Å; D402-E404 PolarHBondContact O-N 3.14Å; D402-N448 PolarHBondContact O-ND2 3.41Å; D402-H451 PolarHBondContact N-NE2 2.93Å; D402-H451 IonicContact OD2-CE1 3.73Å; D402-H451 PolarHBondContact OD2-CE1 2.87Å; D402-H451 VanDerWaalsContact OD2-CE1 3.24Å; D402-H451 IonicContact OD2-NE2 3.96Å
403	P	90.8	Very high	92.6	Very high	114 Å²	114	77.3 Å²	77.3	74%	0.74	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-50.6	134.7	-173.2	-29.4	35.5	0	0	0	114.6	M405 N448	P403-M405 PolarHBondContact O-N 3.31Å; P403-N448 PolarHBondContact O-ND2 3.12Å
404	E	83.1	Confident	92.7	Very high	89 Å²	89	75.3 Å²	75.3	42%	0.416	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-67.4	126.1	-176	-162.5	-178.4	-157.7	0	0	111.3	A382 D402 K407	A382-E404 HydrophobicContact CB-CG 4.48Å; A382-E404 WeakPolarHBondContact CB-OE1 3.36Å; A382-E404 PolarHBondContact N-OE1 2.98Å; D402-E404 PolarHBondContact O-N 3.14Å; E404-K407 WeakPolarHBondContact OE1-CE 3.22Å; E404-K407 IonicContact OE1-NZ 3.88Å; E404-K407 PolarHBondContact OE1-NZ 2.93Å; E404-K407 VanDerWaalsContact OE1-NZ 3.15Å; E404-K407 WeakPolarHBondContact OE2-CE 3.28Å; E404-K407 IonicContact OE2-NZ 2.82Å; E404-K407 PolarHBondContact OE2-NZ 3.43Å
405	M	83.6	Confident	92.7	Very high	47 Å²	47	67.5 Å²	67.5	23%	0.232	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-71.2	153.9	-179.7	-64.7	-59.3	-54.9	0	0	111.6	P403 K407 I438 I446 N448	P403-M405 PolarHBondContact O-N 3.31Å; M405-K407 PolarHBondContact O-N 2.67Å; M405-K407 VanDerWaalsContact O-N 3.14Å; M405-I438 HydrophobicContact CE-CB 3.58Å; M405-I438 HydrophobicContact CE-CG2 3.5Å; M405-I438 HydrophobicContact SD-CG2 3.82Å; M405-I446 HydrophobicContact CB-CB 4.37Å; M405-I446 HydrophobicContact CB-CG2 4.02Å; M405-I446 HydrophobicContact CE-CG2 4.4Å; M405-I446 HydrophobicContact CG-CG2 3.88Å; M405-N448 WeakPolarHBondContact CG-OD1 3.24Å
406	P	82.3	Confident	92.6	Very high	99 Å²	99	67.3 Å²	67.3	64%	0.643	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-54.7	120.4	-178.4	-28	36.8	0	0	0	112.8	R408	P406-R408 PolarHBondContact O-N 3.07Å
407	K	81	Confident	92.5	Very high	114 Å²	114	65.1 Å²	65.1	50%	0.496	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-61.7	118.9	-174.9	-76.2	168.6	177	153.8	0	111.2	V381 E404 M405	V381-K407 HydrophobicContact CG1-CD 4.15Å; E404-K407 WeakPolarHBondContact OE1-CE 3.22Å; E404-K407 IonicContact OE1-NZ 3.88Å; E404-K407 PolarHBondContact OE1-NZ 2.93Å; E404-K407 VanDerWaalsContact OE1-NZ 3.15Å; E404-K407 WeakPolarHBondContact OE2-CE 3.28Å; E404-K407 IonicContact OE2-NZ 2.82Å; E404-K407 PolarHBondContact OE2-NZ 3.43Å; M405-K407 PolarHBondContact O-N 2.67Å; M405-K407 VanDerWaalsContact O-N 3.14Å
408	R	88.4	Confident	92.5	Very high	73 Å²	73	63.4 Å²	63.4	28%	0.275	35%	0.349	S	S	.	.			trans	-103.5	113.1	176.9	-73.3	176.6	172.3	-167	-5.1	110.1	P406 D440 F444	P406-R408 PolarHBondContact O-N 3.07Å; R408-D440 PolarHBondContact NH1-O 3.24Å; R408-D440 IonicContact NH1-OD2 3.2Å; R408-D440 PolarHBondContact NH1-OD2 2.89Å; R408-D440 PolarHBondContact NH2-O 3.03Å; R408-F444 WeakPolarHBondContact CD-O 3.41Å; R408-F444 PolarHBondContact NH1-O 3.32Å
409	M	91.9	Very high	92.4	Very high	98 Å²	98	60.8 Å²	60.8	48%	0.483	33%	0.328	S	S	.	.			trans	-74	123.7	170.2	-66.9	-179.9	-178.4	0	0	109.9	L377 D379 F473	L377-M409 HydrophobicContact CD1-CB 4.19Å; L377-M409 HydrophobicContact CD1-CG 4.16Å; L377-M409 HydrophobicContact CD1-SD 4.12Å; L377-M409 HydrophobicContact CD2-SD 4.4Å; D379-M409 HydrophobicContact CB-CG 4.29Å; M409-F473 HydrophobicContact CE-CE1 4.16Å; M409-F473 HydrophobicContact CE-CZ 4.39Å; M409-F473 HydrophobicContact SD-CE1 4.2Å; M409-F473 HydrophobicContact SD-CZ 4.49Å
410	Y	95.3	Very high	92.3	Very high	48 Å²	48	64.1 Å²	64.1	19%	0.188	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	108.5	171.3	-178.7	-85.3	0	0	0	109.6	L377 L378 F429 K431 L432	L377-Y410 CarbonylContact C-O 3.57Å; L377-Y410 WeakPolarHBondContact CA-O 3.38Å; L377-Y410 WeakPolarHBondContact CB-O 3.5Å; L378-Y410 PolarHBondContact N-O 2.82Å; L378-Y410 PolarHBondContact O-N 2.83Å; Y410-F429 AromaticContact CD1-CD1 3.63Å; Y410-F429 HydrophobicContact CD1-CD1 3.63Å; Y410-F429 HydrophobicContact CD1-CE1 4.04Å; Y410-F429 AromaticContact CE1-CD1 3.89Å; Y410-F429 HydrophobicContact CE1-CD1 3.89Å; Y410-F429 HydrophobicContact CE1-CE1 4.43Å; Y410-K431 VanDerWaalsContact OH-CB 3.27Å; Y410-K431 WeakPolarHBondContact OH-CB 3.08Å; Y410-L432 HydrophobicContact CD1-CB 4.23Å; Y410-L432 HydrophobicContact CD1-CD1 3.95Å; Y410-L432 HydrophobicContact CD1-CG 4.22Å; Y410-L432 HydrophobicContact CD2-CB 4.22Å; Y410-L432 HydrophobicContact CD2-CD1 4.44Å; Y410-L432 HydrophobicContact CD2-CG 3.97Å; Y410-L432 HydrophobicContact CE1-CB 4.33Å; Y410-L432 HydrophobicContact CE2-CB 4.34Å; Y410-L432 HydrophobicContact CG-CB 4.17Å; Y410-L432 HydrophobicContact CG-CD1 3.75Å; Y410-L432 HydrophobicContact CG-CG 3.78Å
411	I	96.1	Very high	92.3	Very high	55 Å²	55	60.4 Å²	60.4	28%	0.282	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	132.4	174.8	-58.9	172.1	0	0	0	109.1	I375 L377 I465 L468	I375-I411 HydrophobicContact CG2-CG2 3.86Å; L377-I411 HydrophobicContact CB-CB 4.47Å; L377-I411 HydrophobicContact CB-CG1 4.15Å; L377-I411 HydrophobicContact CD2-CG1 4.31Å; I411-I465 HydrophobicContact CD1-CG2 3.8Å; I411-L468 HydrophobicContact CD1-CD1 3.65Å; I411-L468 HydrophobicContact CG1-CD1 4.27Å
412	H	96.6	Very high	92.3	Very high	9 Å²	9	59.4 Å²	59.4	4%	0.042	31%	0.312	C	S	.	.			trans	-65.2	130.5	175.5	-170.1	-81.1	0	0	0	109.6	L376 D414 S415 W422 S428 F429	L376-H412 HydrophobicContact CB-CB 4.36Å; L376-H412 VanDerWaalsContact O-CB 3.24Å; L376-H412 WeakPolarHBondContact O-CB 3.27Å; L376-H412 PolarHBondContact O-N 3.46Å; H412-D414 VanDerWaalsContact CE1-CG 3.45Å; H412-D414 IonicContact CE1-OD1 1.84Å; H412-D414 PolarHBondContact CE1-OD1 3.21Å; H412-D414 IonicContact CE1-OD2 3.12Å; H412-D414 PolarHBondContact ND1-N 2.96Å; H412-D414 IonicContact ND1-OD1 3.7Å; H412-D414 PolarHBondContact ND1-OD1 3.12Å; H412-D414 PolarHBondContact O-N 3.39Å; H412-D414 VanDerWaalsContact O-N 3.1Å; H412-S415 VanDerWaalsContact O-CB 3.22Å; H412-S415 WeakPolarHBondContact O-CB 3.49Å; H412-S415 PolarHBondContact O-N 2.92Å; H412-S415 PolarHBondContact O-OG 3.3Å; H412-W422 HydrophobicContact CB-CH2 4.07Å; H412-W422 AromaticContact CE1-CZ3 3.96Å; H412-W422 AromaticContact CG-CH2 3.94Å; H412-W422 AromaticContact ND1-CH2 3.49Å; H412-W422 WeakPolarHBondContact ND1-CH2 3.19Å; H412-W422 AromaticContact ND1-CZ3 3.55Å; H412-S428 PolarHBondContact NE2-N 3.25Å; H412-F429 HydrophobicContact CB-CE1 3.9Å; H412-F429 HydrophobicContact CB-CZ 3.94Å
413	P	94.9	Very high	92.5	Very high	73 Å²	73	59.5 Å²	59.5	47%	0.474	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.9	-168.7	22.3	-34.4	0	0	0	114.4	S415 K431	P413-S415 PolarHBondContact O-N 3.32Å; P413-K431 HydrophobicContact CG-CD 4.47Å
414	D	95.1	Very high	92.7	Very high	59 Å²	59	60 Å²	60	32%	0.316	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-0.5	175.1	-53	33	0	0	0	113.2	H412 T417 W422 K425	H412-D414 VanDerWaalsContact CE1-CG 3.45Å; H412-D414 IonicContact CE1-OD1 1.84Å; H412-D414 PolarHBondContact CE1-OD1 3.21Å; H412-D414 IonicContact CE1-OD2 3.12Å; H412-D414 PolarHBondContact ND1-N 2.96Å; H412-D414 IonicContact ND1-OD1 3.7Å; H412-D414 PolarHBondContact ND1-OD1 3.12Å; H412-D414 PolarHBondContact O-N 3.39Å; H412-D414 VanDerWaalsContact O-N 3.1Å; D414-T417 WeakPolarHBondContact O-CB 3.16Å; D414-T417 PolarHBondContact O-OG1 2.86Å; D414-W422 HydrophobicContact CB-CH2 3.8Å; D414-W422 HydrophobicContact CB-CZ3 4.03Å; D414-K425 IonicContact OD2-NZ 2.85Å; D414-K425 PolarHBondContact OD2-NZ 3.41Å
415	S	95.1	Very high	93.3	Very high	15 Å²	15	60.8 Å²	60.8	11%	0.105	31%	0.306	C	S	.	.			trans	-87.2	147.5	-178.5	-50.6	0	0	0	0	113	L376 H412 P413 W422	L376-S415 PolarHBondContact N-OG 2.81Å; L376-S415 PolarHBondContact O-OG 3.38Å; H412-S415 VanDerWaalsContact O-CB 3.22Å; H412-S415 WeakPolarHBondContact O-CB 3.49Å; H412-S415 PolarHBondContact O-N 2.92Å; H412-S415 PolarHBondContact O-OG 3.3Å; P413-S415 PolarHBondContact O-N 3.32Å; S415-W422 WeakPolarHBondContact OG-CZ2 3.49Å
416	P	95.2	Very high	93.9	Very high	40 Å²	40	61 Å²	61	26%	0.26	31%	0.309	S	S	.	.	S	Bend	cis	-82.5	132.5	-6.2	31.5	-32.3	0	0	0	112.4	I375	I375-P416 HydrophobicContact CD1-CB 4.31Å; I375-P416 HydrophobicContact CG1-CB 3.7Å
417	T	96	Very high	94.6	Very high	24 Å²	24	56.3 Å²	56.3	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157	-174.3	-90.2	0	0	0	0	111	K373 Y374 D414 Q421 W422	K373-T417 WeakPolarHBondContact CA-O 3.28Å; Y374-T417 PolarHBondContact N-O 2.82Å; Y374-T417 PolarHBondContact O-N 3.37Å; D414-T417 WeakPolarHBondContact O-CB 3.16Å; D414-T417 PolarHBondContact O-OG1 2.86Å; T417-Q421 HydrophobicContact CG2-CB 3.47Å; T417-Q421 VanDerWaalsContact CG2-CB 3.47Å; T417-W422 HydrophobicContact CG2-CD2 3.99Å; T417-W422 HydrophobicContact CG2-CG 4.14Å; T417-W422 HydrophobicContact CG2-CZ2 4.39Å; T417-W422 PolarHBondContact O-NE1 2.94Å; T417-W422 VanDerWaalsContact O-NE1 3.11Å
418	T	96.1	Very high	95.4	Very high	34 Å²	34	52 Å²	52	21%	0.209	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	151.6	-178.7	59.3	0	0	0	0	112.3	A370 A372 K373 E420 Q421 W422	A370-T418 WeakPolarHBondContact O-CB 3.31Å; A372-T418 CarbonylContact O-C 3.56Å; A372-T418 VanDerWaalsContact O-CA 3.32Å; A372-T418 WeakPolarHBondContact O-CA 3.27Å; K373-T418 HydrophobicContact CG-CG2 4.35Å; T418-E420 PolarHBondContact O-N 3.37Å; T418-Q421 PolarHBondContact O-N 3.47Å; T418-W422 PolarHBondContact O-N 3.32Å; T418-W422 VanDerWaalsContact O-N 3.15Å
419	G	95.3	Very high	95.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-34.6	178.5	0	0	0	0	0	112.8	D369 A372 W422 M423	D369-G419 WeakPolarHBondContact O-CA 3.42Å; A372-G419 PolarHBondContact O-N 2.87Å; G419-W422 PolarHBondContact O-N 3.11Å; G419-M423 VanDerWaalsContact O-CG 3.29Å; G419-M423 WeakPolarHBondContact O-CG 3.42Å; G419-M423 PolarHBondContact O-N 3.08Å
420	E	96.1	Very high	95.9	Very high	102 Å²	102	47.4 Å²	47.4	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-57.7	-53	175.2	-161.8	-161.9	141.3	0	0	111.8	A370 T418 W422 M423 Q424	A370-E420 HydrophobicContact CB-CB 3.97Å; A370-E420 HydrophobicContact CB-CG 4.36Å; A370-E420 PolarHBondContact O-N 3.16Å; T418-E420 PolarHBondContact O-N 3.37Å; E420-W422 VanDerWaalsContact C-N 3.26Å; E420-W422 PolarHBondContact O-N 3.32Å; E420-M423 PolarHBondContact O-N 2.95Å; E420-Q424 VanDerWaalsContact O-CG 3.29Å; E420-Q424 WeakPolarHBondContact O-CG 3.36Å; E420-Q424 PolarHBondContact O-N 3.2Å; E420-Q424 PolarHBondContact OE1-NE2 3.45Å
421	Q	96.6	Very high	95.9	Very high	94 Å²	94	51 Å²	51	44%	0.439	26%	0.26	S	S	.	.	H	α-helix	trans	-66.9	-25.3	-178.9	-72.7	-179.5	7	0	0	113.1	T417 T418	T417-Q421 HydrophobicContact CG2-CB 3.47Å; T417-Q421 VanDerWaalsContact CG2-CB 3.47Å; T418-Q421 PolarHBondContact O-N 3.47Å
422	W	96.5	Very high	95.9	Very high	1 Å²	1	48.4 Å²	48.4	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-74.1	-32.9	170.1	-71.4	126.7	0	0	0	113.3	L368 Y374 L376 H412 D414 S415 T417 T418 G419 E420 V427	L368-W422 HydrophobicContact CD1-CB 3.99Å; Y374-W422 PolarHBondContact O-NE1 3.27Å; L376-W422 HydrophobicContact CB-CH2 4.12Å; L376-W422 HydrophobicContact CB-CZ2 4.17Å; L376-W422 HydrophobicContact CD1-CB 4.48Å; L376-W422 HydrophobicContact CD1-CD2 3.46Å; L376-W422 VanDerWaalsContact CD1-CD2 3.46Å; L376-W422 HydrophobicContact CD1-CE3 3.4Å; L376-W422 HydrophobicContact CD1-CG 3.99Å; L376-W422 HydrophobicContact CD1-CH2 4.05Å; L376-W422 HydrophobicContact CD1-CZ2 4.13Å; L376-W422 HydrophobicContact CD1-CZ3 3.71Å; L376-W422 HydrophobicContact CG-CD2 3.9Å; L376-W422 HydrophobicContact CG-CE3 4.17Å; L376-W422 HydrophobicContact CG-CG 4.44Å; L376-W422 HydrophobicContact CG-CH2 4.07Å; L376-W422 HydrophobicContact CG-CZ2 3.82Å; L376-W422 HydrophobicContact CG-CZ3 4.25Å; H412-W422 HydrophobicContact CB-CH2 4.07Å; H412-W422 AromaticContact CE1-CZ3 3.96Å; H412-W422 AromaticContact CG-CH2 3.94Å; H412-W422 AromaticContact ND1-CH2 3.49Å; H412-W422 WeakPolarHBondContact ND1-CH2 3.19Å; H412-W422 AromaticContact ND1-CZ3 3.55Å; D414-W422 HydrophobicContact CB-CH2 3.8Å; D414-W422 HydrophobicContact CB-CZ3 4.03Å; S415-W422 WeakPolarHBondContact OG-CZ2 3.49Å; T417-W422 HydrophobicContact CG2-CD2 3.99Å; T417-W422 HydrophobicContact CG2-CG 4.14Å; T417-W422 HydrophobicContact CG2-CZ2 4.39Å; T417-W422 PolarHBondContact O-NE1 2.94Å; T417-W422 VanDerWaalsContact O-NE1 3.11Å; T418-W422 PolarHBondContact O-N 3.32Å; T418-W422 VanDerWaalsContact O-N 3.15Å; G419-W422 PolarHBondContact O-N 3.11Å; E420-W422 VanDerWaalsContact C-N 3.26Å; E420-W422 PolarHBondContact O-N 3.32Å; W422-V427 HydrophobicContact CE3-CG1 4.46Å; W422-V427 HydrophobicContact CE3-CG2 3.85Å; W422-V427 HydrophobicContact CZ3-CG1 4.08Å; W422-V427 HydrophobicContact CZ3-CG2 4.27Å
423	M	96.6	Very high	96	Very high	62 Å²	62	51 Å²	51	31%	0.305	26%	0.258	S	S	.	.	H	α-helix	trans	-82.2	-26.1	177.7	-65.5	-174.3	-68	0	0	112.9	V365 G367 L368 G419 E420 K425	V365-M423 WeakPolarHBondContact O-CG 3.43Å; G367-M423 PolarHBondContact N-SD 3.35Å; G367-M423 VanDerWaalsContact N-SD 3.42Å; L368-M423 HydrophobicContact CB-CE 4.1Å; L368-M423 HydrophobicContact CB-CG 4.42Å; L368-M423 HydrophobicContact CB-SD 3.98Å; L368-M423 HydrophobicContact CD1-CG 4.28Å; L368-M423 HydrophobicContact CG-CG 4.24Å; L368-M423 HydrophobicContact CG-SD 4.24Å; L368-M423 PolarHBondContact N-SD 3.32Å; L368-M423 WeakPolarHBondContact O-CE 3.48Å; G419-M423 VanDerWaalsContact O-CG 3.29Å; G419-M423 WeakPolarHBondContact O-CG 3.42Å; G419-M423 PolarHBondContact O-N 3.08Å; E420-M423 PolarHBondContact O-N 2.95Å; M423-K425 PolarHBondContact O-N 3.49Å
424	Q	96.1	Very high	96.1	Very high	124 Å²	124	47.5 Å²	47.5	58%	0.579	24%	0.235	S	C	*	.	S	Bend	trans	-60.6	-23.4	178.7	-79.6	170.2	8.2	0	0	114.4	E420	E420-Q424 VanDerWaalsContact O-CG 3.29Å; E420-Q424 WeakPolarHBondContact O-CG 3.36Å; E420-Q424 PolarHBondContact O-N 3.2Å; E420-Q424 PolarHBondContact OE1-NE2 3.45Å
425	K	94.8	Very high	96.2	Very high	106 Å²	106	44.7 Å²	44.7	46%	0.461	22%	0.22	S	C	.	.	S	Bend	trans	-148.1	161.4	-172.7	70.2	-172	-176.8	-174.6	0	113.2	D414 M423 V427	D414-K425 IonicContact OD2-NZ 2.85Å; D414-K425 PolarHBondContact OD2-NZ 3.41Å; M423-K425 PolarHBondContact O-N 3.49Å; K425-V427 PolarHBondContact O-N 2.57Å
426	V	96.8	Very high	96.2	Very high	51 Å²	51	47.4 Å²	47.4	31%	0.309	23%	0.233	S	C	.	.			trans	-68.1	124.6	170.2	171.1	0	0	0	0	110.4	E333 K362	E333-V426 HydrophobicContact CG-CG1 3.95Å; E333-V426 HydrophobicContact CG-CG2 4.15Å; E333-V426 WeakPolarHBondContact OE2-CG2 3.49Å; K362-V426 HydrophobicContact CB-CG1 3.95Å; K362-V426 HydrophobicContact CD-CG1 4.38Å; K362-V426 HydrophobicContact CG-CG1 4.27Å
427	V	97.3	Very high	96.2	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.1	173.6	-172.9	0	0	0	0	108.6	K362 F363 V365 L376 W422 K425 F429	K362-V427 CarbonylContact C-O 3.39Å; K362-V427 VanDerWaalsContact CA-O 3.27Å; K362-V427 WeakPolarHBondContact CA-O 3.4Å; F363-V427 PolarHBondContact N-O 3.18Å; F363-V427 PolarHBondContact O-N 3.42Å; V365-V427 HydrophobicContact CG2-CG2 4.24Å; L376-V427 HydrophobicContact CD1-CB 4.39Å; L376-V427 HydrophobicContact CD1-CG1 3.89Å; L376-V427 HydrophobicContact CD1-CG2 3.74Å; W422-V427 HydrophobicContact CE3-CG1 4.46Å; W422-V427 HydrophobicContact CE3-CG2 3.85Å; W422-V427 HydrophobicContact CZ3-CG1 4.08Å; W422-V427 HydrophobicContact CZ3-CG2 4.27Å; K425-V427 PolarHBondContact O-N 2.57Å; V427-F429 HydrophobicContact CG1-CD2 4.34Å; V427-F429 HydrophobicContact CG1-CE2 3.67Å; V427-F429 HydrophobicContact CG1-CZ 4.32Å
428	S	96.9	Very high	96	Very high	23 Å²	23	51.5 Å²	51.5	16%	0.161	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	103.9	-165.6	179.5	0	0	0	0	112.6	K362 H412 H430	K362-S428 WeakPolarHBondContact CE-OG 3.46Å; H412-S428 PolarHBondContact NE2-N 3.25Å; S428-H430 PolarHBondContact O-N 3.15Å; S428-H430 PolarHBondContact O-ND1 2.68Å; S428-H430 PolarHBondContact OG-ND1 3Å
429	F	97	Very high	95.7	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.009	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-79.3	25.8	-179.6	-69.3	-97.6	0	0	0	113.3	M361 F363 L376 L378 Y410 H412 V427 K431 L432 F457	M361-F429 HydrophobicContact CB-CB 4.2Å; M361-F429 PolarHBondContact O-N 3.18Å; F363-F429 AromaticContact CD2-CD2 3.84Å; F363-F429 HydrophobicContact CD2-CD2 3.84Å; F363-F429 AromaticContact CD2-CE2 3.73Å; F363-F429 HydrophobicContact CD2-CE2 3.73Å; F363-F429 AromaticContact CE2-CD2 3.6Å; F363-F429 HydrophobicContact CE2-CD2 3.6Å; F363-F429 AromaticContact CE2-CE2 3.69Å; F363-F429 HydrophobicContact CE2-CE2 3.69Å; L376-F429 HydrophobicContact CB-CZ 4.44Å; L378-F429 HydrophobicContact CB-CD1 3.74Å; L378-F429 HydrophobicContact CB-CE1 3.69Å; L378-F429 HydrophobicContact CB-CG 4.37Å; L378-F429 HydrophobicContact CB-CZ 4.28Å; L378-F429 HydrophobicContact CD1-CB 4.43Å; L378-F429 HydrophobicContact CD1-CD1 4.34Å; L378-F429 HydrophobicContact CD1-CD2 4.43Å; L378-F429 HydrophobicContact CD1-CG 4.14Å; Y410-F429 AromaticContact CD1-CD1 3.63Å; Y410-F429 HydrophobicContact CD1-CD1 3.63Å; Y410-F429 HydrophobicContact CD1-CE1 4.04Å; Y410-F429 AromaticContact CE1-CD1 3.89Å; Y410-F429 HydrophobicContact CE1-CD1 3.89Å; Y410-F429 HydrophobicContact CE1-CE1 4.43Å; H412-F429 HydrophobicContact CB-CE1 3.9Å; H412-F429 HydrophobicContact CB-CZ 3.94Å; V427-F429 HydrophobicContact CG1-CD2 4.34Å; V427-F429 HydrophobicContact CG1-CE2 3.67Å; V427-F429 HydrophobicContact CG1-CZ 4.32Å; F429-K431 PolarHBondContact O-N 3.4Å; F429-K431 VanDerWaalsContact O-N 3.12Å; F429-L432 WeakPolarHBondContact O-CB 2.87Å; F429-L432 PolarHBondContact O-N 2.63Å; F429-F457 AromaticContact CE2-CD2 3.81Å; F429-F457 HydrophobicContact CE2-CD2 3.81Å; F429-F457 AromaticContact CE2-CE2 3.72Å; F429-F457 HydrophobicContact CE2-CE2 3.72Å; F429-F457 AromaticContact CZ-CD2 4Å; F429-F457 HydrophobicContact CZ-CD2 4Å; F429-F457 AromaticContact CZ-CE2 3.9Å; F429-F457 HydrophobicContact CZ-CE2 3.9Å
430	H	94.4	Very high	95.5	Very high	73 Å²	73	54 Å²	54	34%	0.338	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-55.4	-27.4	-179.7	68.1	-69.2	0	0	0	115	Q356 Q360 S428 L432	Q356-H430 PolarHBondContact OE1-O 2.76Å; Q360-H430 HydrophobicContact CG-CB 4.26Å; S428-H430 PolarHBondContact O-N 3.15Å; S428-H430 PolarHBondContact O-ND1 2.68Å; S428-H430 PolarHBondContact OG-ND1 3Å; H430-L432 VanDerWaalsContact C-N 3.32Å
431	K	95.2	Very high	95.3	Very high	124 Å²	124	58.7 Å²	58.7	54%	0.539	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-79.4	-10.4	177.1	-72.6	174.9	-176.9	175.7	0	113.7	Y410 P413 F429	Y410-K431 VanDerWaalsContact OH-CB 3.27Å; Y410-K431 WeakPolarHBondContact OH-CB 3.08Å; P413-K431 HydrophobicContact CG-CD 4.47Å; F429-K431 PolarHBondContact O-N 3.4Å; F429-K431 VanDerWaalsContact O-N 3.12Å
432	L	96.3	Very high	95	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.298	C	S	.	.			trans	-66.7	132.5	177.1	-164.9	161.9	0	0	0	109.9	M357 L378 I380 Y410 F429 H430 L434	M357-L432 HydrophobicContact CE-CB 4.3Å; M357-L432 HydrophobicContact CE-CD1 4.12Å; M357-L432 HydrophobicContact CE-CD2 3.96Å; M357-L432 HydrophobicContact CE-CG 4.36Å; M357-L432 HydrophobicContact SD-CD2 4.34Å; L378-L432 HydrophobicContact CB-CD1 4.24Å; L378-L432 HydrophobicContact CD2-CD1 3.71Å; L378-L432 HydrophobicContact CG-CD1 4.4Å; I380-L432 HydrophobicContact CD1-CD2 4.43Å; Y410-L432 HydrophobicContact CD1-CB 4.23Å; Y410-L432 HydrophobicContact CD1-CD1 3.95Å; Y410-L432 HydrophobicContact CD1-CG 4.22Å; Y410-L432 HydrophobicContact CD2-CB 4.22Å; Y410-L432 HydrophobicContact CD2-CD1 4.44Å; Y410-L432 HydrophobicContact CD2-CG 3.97Å; Y410-L432 HydrophobicContact CE1-CB 4.33Å; Y410-L432 HydrophobicContact CE2-CB 4.34Å; Y410-L432 HydrophobicContact CG-CB 4.17Å; Y410-L432 HydrophobicContact CG-CD1 3.75Å; Y410-L432 HydrophobicContact CG-CG 3.78Å; F429-L432 WeakPolarHBondContact O-CB 2.87Å; F429-L432 PolarHBondContact O-N 2.63Å; H430-L432 VanDerWaalsContact C-N 3.32Å; L432-L434 HydrophobicContact CD2-CD2 3.59Å
433	K	96.8	Very high	94.7	Very high	63 Å²	63	62.7 Å²	62.7	27%	0.274	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.5	-180	-79.3	176.1	158.8	-157.3	0	111.7	S353 G354 R355 Q356 F444 T445	S353-K433 PolarHBondContact O-NZ 2.99Å; S353-K433 VanDerWaalsContact O-NZ 3.16Å; G354-K433 WeakPolarHBondContact O-CD 3.07Å; G354-K433 VanDerWaalsContact O-CE 3.24Å; G354-K433 WeakPolarHBondContact O-CE 3.03Å; G354-K433 PolarHBondContact O-NZ 3.14Å; R355-K433 CarbonylContact O-C 3.57Å; R355-K433 VanDerWaalsContact O-CA 3.31Å; R355-K433 WeakPolarHBondContact O-CA 3.39Å; Q356-K433 HydrophobicContact CG-CG 4.37Å; K433-F444 HydrophobicContact CB-CB 4.32Å; K433-F444 HydrophobicContact CB-CD1 3.75Å; K433-F444 HydrophobicContact CB-CD2 4.41Å; K433-F444 HydrophobicContact CB-CE1 4.18Å; K433-F444 HydrophobicContact CB-CG 3.9Å; K433-F444 HydrophobicContact CD-CD1 4Å; K433-F444 HydrophobicContact CD-CD2 4.42Å; K433-F444 HydrophobicContact CD-CE1 3.54Å; K433-F444 HydrophobicContact CD-CE2 4Å; K433-F444 HydrophobicContact CD-CG 4.44Å; K433-F444 HydrophobicContact CD-CZ 3.55Å; K433-F444 HydrophobicContact CG-CD1 4.5Å; K433-F444 HydrophobicContact CG-CE1 4.45Å; K433-T445 PolarHBondContact O-N 3.1Å
434	L	97.3	Very high	94.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.2	174.9	-50	-176.4	0	0	0	110.5	M348 I350 G354 R355 M357 I380 L432 T445 L447 F483	M348-L434 HydrophobicContact CB-CD1 3.83Å; M348-L434 HydrophobicContact CG-CD1 4.35Å; I350-L434 HydrophobicContact CB-CB 4.49Å; I350-L434 HydrophobicContact CG2-CB 3.72Å; I350-L434 HydrophobicContact CG2-CD1 4.33Å; G354-L434 WeakPolarHBondContact CA-O 3.36Å; R355-L434 PolarHBondContact N-O 3.17Å; R355-L434 PolarHBondContact O-N 2.86Å; M357-L434 HydrophobicContact CG-CD1 3.74Å; M357-L434 HydrophobicContact CG-CD2 4.27Å; M357-L434 HydrophobicContact CG-CG 3.89Å; M357-L434 HydrophobicContact SD-CD1 4.23Å; M357-L434 HydrophobicContact SD-CD2 4.23Å; M357-L434 HydrophobicContact SD-CG 4.44Å; I380-L434 HydrophobicContact CD1-CD2 3.53Å; L432-L434 HydrophobicContact CD2-CD2 3.59Å; L434-T445 WeakPolarHBondContact CA-O 3.45Å; L434-L447 HydrophobicContact CB-CD1 4.29Å; L434-L447 HydrophobicContact CD1-CD1 3.9Å; L434-L447 HydrophobicContact CD2-CD1 3.98Å; L434-L447 HydrophobicContact CG-CD1 4.27Å; L434-F483 HydrophobicContact CD1-CE2 4.07Å; L434-F483 HydrophobicContact CD1-CZ 3.94Å
435	T	97.1	Very high	94.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151.2	-179.2	-172.7	0	0	0	0	112.2	T351 K352 N437 D440 F444 T445 I446 L447	T351-T435 WeakPolarHBondContact O-CA 3.45Å; T351-T435 WeakPolarHBondContact O-CB 3.21Å; T351-T435 PolarHBondContact O-OG1 2.8Å; K352-T435 PolarHBondContact O-OG1 2.89Å; T435-N437 WeakPolarHBondContact OG1-CB 3.42Å; T435-N437 PolarHBondContact OG1-N 2.92Å; T435-D440 HydrophobicContact CG2-CB 4.05Å; T435-F444 HydrophobicContact CG2-CB 3.8Å; T435-T445 PolarHBondContact N-O 2.91Å; T435-I446 HydrophobicContact CG2-CB 4.42Å; T435-I446 HydrophobicContact CG2-CG1 3.85Å; T435-I446 WeakPolarHBondContact O-CA 3.28Å; T435-L447 PolarHBondContact O-N 2.97Å
436	N	95.9	Very high	94.6	Very high	71 Å²	71	51.6 Å²	51.6	38%	0.38	27%	0.268	S	S	.	.			trans	-93.6	1.5	165.8	67.7	-31.1	0	0	0	112.7	I350 K352 I438	I350-N436 HydrophobicContact CD1-CB 3.69Å; I350-N436 HydrophobicContact CG1-CB 4.03Å; K352-N436 WeakPolarHBondContact CA-OD1 3.23Å; K352-N436 PolarHBondContact N-OD1 3.22Å; N436-I438 PolarHBondContact O-N 3.42Å
437	N	94.7	Very high	94.6	Very high	37 Å²	37	49.4 Å²	49.4	20%	0.198	25%	0.254	C	S	.	.			trans	-84.6	100.4	-177.2	-174.8	31.1	0	0	0	111.4	K352 T435 S439 D440	K352-N437 HydrophobicContact CG-CB 4.15Å; T435-N437 WeakPolarHBondContact OG1-CB 3.42Å; T435-N437 PolarHBondContact OG1-N 2.92Å; N437-S439 PolarHBondContact O-N 3.47Å; N437-S439 VanDerWaalsContact O-N 3.14Å; N437-S439 PolarHBondContact OD1-OG 3.28Å; N437-D440 HydrophobicContact CB-CB 4.31Å; N437-D440 WeakPolarHBondContact ND2-CA 3.27Å; N437-D440 PolarHBondContact ND2-N 2.86Å; N437-D440 VanDerWaalsContact O-CB 3.3Å; N437-D440 WeakPolarHBondContact O-CB 3.38Å; N437-D440 PolarHBondContact O-N 3.11Å
438	I	91.6	Very high	94.6	Very high	113 Å²	113	50.4 Å²	50.4	58%	0.579	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.8	179.9	65.4	172.2	0	0	0	114	M405 N436 I446	M405-I438 HydrophobicContact CE-CB 3.58Å; M405-I438 HydrophobicContact CE-CG2 3.5Å; M405-I438 HydrophobicContact SD-CG2 3.82Å; N436-I438 PolarHBondContact O-N 3.42Å; I438-I446 HydrophobicContact CG2-CG2 4.3Å; I438-I446 WeakPolarHBondContact O-CD1 3.5Å
439	S	90.7	Very high	94.6	Very high	84 Å²	84	50.7 Å²	50.7	59%	0.587	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	23.9	178.4	61.8	0	0	0	0	113.3	N437 K441	N437-S439 PolarHBondContact O-N 3.47Å; N437-S439 VanDerWaalsContact O-N 3.14Å; N437-S439 PolarHBondContact OD1-OG 3.28Å; S439-K441 PolarHBondContact O-N 2.99Å
440	D	91.7	Very high	94.7	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.021	27%	0.269	C	S	.	.			trans	-59.8	126.9	177.6	174.1	66.2	0	0	0	112.6	R408 T435 N437 H442 G443 F444	R408-D440 PolarHBondContact NH1-O 3.24Å; R408-D440 IonicContact NH1-OD2 3.2Å; R408-D440 PolarHBondContact NH1-OD2 2.89Å; R408-D440 PolarHBondContact NH2-O 3.03Å; T435-D440 HydrophobicContact CG2-CB 4.05Å; N437-D440 HydrophobicContact CB-CB 4.31Å; N437-D440 WeakPolarHBondContact ND2-CA 3.27Å; N437-D440 PolarHBondContact ND2-N 2.86Å; N437-D440 VanDerWaalsContact O-CB 3.3Å; N437-D440 WeakPolarHBondContact O-CB 3.38Å; N437-D440 PolarHBondContact O-N 3.11Å; D440-H442 IonicContact OD1-CE1 3.82Å; D440-H442 IonicContact OD1-CG 3.54Å; D440-H442 PolarHBondContact OD1-N 3.2Å; D440-H442 IonicContact OD1-ND1 2.74Å; D440-H442 PolarHBondContact OD1-ND1 2.87Å; D440-H442 PolarHBondContact OD2-N 2.92Å; D440-G443 PolarHBondContact OD2-N 3.01Å; D440-F444 PolarHBondContact OD2-N 3.24Å
441	K	91.1	Very high	94.8	Very high	199 Å²	199	49 Å²	49	87%	0.865	25%	0.254	S	S	*	.	S	Bend	trans	-94.4	-6.7	178.9	-60	-173.5	179.7	-175.6	0	114.1	S439	S439-K441 PolarHBondContact O-N 2.99Å
442	H	89.5	Confident	95	Very high	137 Å²	137	45.3 Å²	45.3	63%	0.634	24%	0.238	S	C	*	.	S	Bend	trans	-88.7	-4.6	-174.6	-50.1	95.4	0	0	0	113.7	D440 F444	D440-H442 IonicContact OD1-CE1 3.82Å; D440-H442 IonicContact OD1-CG 3.54Å; D440-H442 PolarHBondContact OD1-N 3.2Å; D440-H442 IonicContact OD1-ND1 2.74Å; D440-H442 PolarHBondContact OD1-ND1 2.87Å; D440-H442 PolarHBondContact OD2-N 2.92Å; H442-F444 VanDerWaalsContact C-N 3.35Å; H442-F444 HydrophobicContact CB-CD1 3.93Å; H442-F444 HydrophobicContact CB-CD2 3.96Å; H442-F444 HydrophobicContact CB-CE1 3.59Å; H442-F444 HydrophobicContact CB-CE2 3.64Å; H442-F444 HydrophobicContact CB-CG 4.1Å; H442-F444 HydrophobicContact CB-CZ 3.43Å; H442-F444 VanDerWaalsContact CB-CZ 3.43Å; H442-F444 AromaticContact CG-CE2 3.77Å; H442-F444 AromaticContact CG-CZ 3.79Å; H442-F444 AromaticContact ND1-CE2 3.73Å
443	G	90.3	Very high	95.1	Very high	43 Å²	43	45.7 Å²	45.7	44%	0.443	24%	0.24	S	C	.	.			trans	78.6	15.5	-176	0	0	0	0	0	113.9	D440	D440-G443 PolarHBondContact OD2-N 3.01Å
444	F	95	Very high	95.1	Very high	38 Å²	38	43.7 Å²	43.7	17%	0.167	23%	0.231	C	C	.	.			trans	-65.4	150.5	176.1	-58.3	-26	0	0	0	110.9	S353 R408 K433 T435 D440 H442 I446	S353-F444 WeakPolarHBondContact O-CE2 3.4Å; R408-F444 WeakPolarHBondContact CD-O 3.41Å; R408-F444 PolarHBondContact NH1-O 3.32Å; K433-F444 HydrophobicContact CB-CB 4.32Å; K433-F444 HydrophobicContact CB-CD1 3.75Å; K433-F444 HydrophobicContact CB-CD2 4.41Å; K433-F444 HydrophobicContact CB-CE1 4.18Å; K433-F444 HydrophobicContact CB-CG 3.9Å; K433-F444 HydrophobicContact CD-CD1 4Å; K433-F444 HydrophobicContact CD-CD2 4.42Å; K433-F444 HydrophobicContact CD-CE1 3.54Å; K433-F444 HydrophobicContact CD-CE2 4Å; K433-F444 HydrophobicContact CD-CG 4.44Å; K433-F444 HydrophobicContact CD-CZ 3.55Å; K433-F444 HydrophobicContact CG-CD1 4.5Å; K433-F444 HydrophobicContact CG-CE1 4.45Å; T435-F444 HydrophobicContact CG2-CB 3.8Å; D440-F444 PolarHBondContact OD2-N 3.24Å; H442-F444 VanDerWaalsContact C-N 3.35Å; H442-F444 HydrophobicContact CB-CD1 3.93Å; H442-F444 HydrophobicContact CB-CD2 3.96Å; H442-F444 HydrophobicContact CB-CE1 3.59Å; H442-F444 HydrophobicContact CB-CE2 3.64Å; H442-F444 HydrophobicContact CB-CG 4.1Å; H442-F444 HydrophobicContact CB-CZ 3.43Å; H442-F444 VanDerWaalsContact CB-CZ 3.43Å; H442-F444 AromaticContact CG-CE2 3.77Å; H442-F444 AromaticContact CG-CZ 3.79Å; H442-F444 AromaticContact ND1-CE2 3.73Å; F444-I446 PolarHBondContact O-N 2.98Å
445	T	95.4	Very high	95.1	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	115.9	179.2	-49.4	0	0	0	0	109.2	I380 K433 L434 T435 L447	I380-T445 HydrophobicContact CB-CG2 4.16Å; I380-T445 HydrophobicContact CD1-CG2 4.16Å; I380-T445 HydrophobicContact CG1-CG2 4.33Å; K433-T445 PolarHBondContact O-N 3.1Å; L434-T445 WeakPolarHBondContact CA-O 3.45Å; T435-T445 PolarHBondContact N-O 2.91Å; T445-L447 HydrophobicContact CG2-CD2 4.13Å; T445-L447 HydrophobicContact CG2-CG 4.49Å
446	I	95.9	Very high	95.2	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.077	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.2	-179.2	-57	165.5	0	0	0	108.1	M405 T435 I438 F444	M405-I446 HydrophobicContact CB-CB 4.37Å; M405-I446 HydrophobicContact CB-CG2 4.02Å; M405-I446 HydrophobicContact CE-CG2 4.4Å; M405-I446 HydrophobicContact CG-CG2 3.88Å; T435-I446 HydrophobicContact CG2-CB 4.42Å; T435-I446 HydrophobicContact CG2-CG1 3.85Å; T435-I446 WeakPolarHBondContact O-CA 3.28Å; I438-I446 HydrophobicContact CG2-CG2 4.3Å; I438-I446 WeakPolarHBondContact O-CD1 3.5Å; F444-I446 PolarHBondContact O-N 2.98Å
447	L	96.9	Very high	95.2	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	23%	0.226	C	C	.	.			trans	-130.8	146.6	177.5	-57.6	178.5	0	0	0	110.5	I350 I380 L434 T435 T445 Y453 F483 A485	I350-L447 HydrophobicContact CD1-CB 4.48Å; I350-L447 WeakPolarHBondContact CD1-O 3.28Å; I350-L447 HydrophobicContact CG2-CD1 4.36Å; I380-L447 HydrophobicContact CB-CD2 4.4Å; I380-L447 HydrophobicContact CG2-CD2 3.91Å; L434-L447 HydrophobicContact CB-CD1 4.29Å; L434-L447 HydrophobicContact CD1-CD1 3.9Å; L434-L447 HydrophobicContact CD2-CD1 3.98Å; L434-L447 HydrophobicContact CG-CD1 4.27Å; T435-L447 PolarHBondContact O-N 2.97Å; T445-L447 HydrophobicContact CG2-CD2 4.13Å; T445-L447 HydrophobicContact CG2-CG 4.49Å; L447-Y453 HydrophobicContact CB-CD2 4.5Å; L447-Y453 HydrophobicContact CB-CE2 3.85Å; L447-Y453 HydrophobicContact CD1-CD2 4.14Å; L447-Y453 HydrophobicContact CD1-CE2 4.31Å; L447-Y453 HydrophobicContact CD1-CG 4.48Å; L447-Y453 HydrophobicContact CD2-CD1 3.79Å; L447-Y453 HydrophobicContact CD2-CD2 4.23Å; L447-Y453 HydrophobicContact CD2-CE1 3.67Å; L447-Y453 HydrophobicContact CD2-CE2 4.07Å; L447-Y453 HydrophobicContact CD2-CG 4.09Å; L447-Y453 HydrophobicContact CG-CE2 4.3Å; L447-F483 HydrophobicContact CD1-CE2 3.85Å; L447-F483 HydrophobicContact CD1-CZ 3.74Å; L447-A485 HydrophobicContact CB-CB 4.17Å; L447-A485 HydrophobicContact CD1-CB 4.12Å
448	N	96.9	Very high	95.3	Very high	23 Å²	23	42.1 Å²	42.1	12%	0.123	22%	0.218	C	C	.	.			trans	-79.9	134.5	171.2	-63.8	-18.4	0	0	0	108.7	D402 P403 M405 H451 Y453	D402-N448 PolarHBondContact O-ND2 3.41Å; P403-N448 PolarHBondContact O-ND2 3.12Å; M405-N448 WeakPolarHBondContact CG-OD1 3.24Å; N448-H451 HydrophobicContact CB-CB 4.47Å; N448-H451 WeakPolarHBondContact CB-ND1 3.42Å; N448-Y453 PolarHBondContact N-OH 2.91Å
449	S	97.5	Very high	95.5	Very high	29 Å²	29	36.8 Å²	36.8	20%	0.203	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	150.1	176.5	-166.9	0	0	0	0	110.6	H451 T487	S449-H451 VanDerWaalsContact C-N 3.27Å; S449-H451 PolarHBondContact O-CE1 2.8Å; S449-H451 PolarHBondContact O-N 3.25Å; S449-H451 PolarHBondContact O-ND1 3Å; S449-T487 PolarHBondContact OG-N 2.82Å
450	M	97.9	Very high	95.8	Very high	32 Å²	32	32.8 Å²	32.8	16%	0.158	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	26.7	-178.2	-42.2	-54.7	-77.4	0	0	114.5	Y388 W395 A485 V486 Q490	Y388-M450 WeakPolarHBondContact CB-O 3.34Å; Y388-M450 PolarHBondContact N-O 3.28Å; Y388-M450 WeakPolarHBondContact O-CB 3.22Å; W395-M450 HydrophobicContact CH2-CE 3.87Å; W395-M450 HydrophobicContact CZ3-CE 3.71Å; M450-A485 WeakPolarHBondContact CA-O 3.35Å; M450-A485 PolarHBondContact N-O 2.87Å; M450-V486 HydrophobicContact SD-CG1 4.11Å; M450-Q490 HydrophobicContact CE-CG 4.18Å
451	H	98.1	Very high	95.9	Very high	7 Å²	7	35.4 Å²	35.4	3%	0.032	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.8	174.8	-66.3	78.1	0	0	0	110.8	Y386 R387 A401 D402 N448 S449 Y453 I484 A485	Y386-H451 PolarHBondContact O-CD2 3Å; R387-H451 WeakPolarHBondContact CB-NE2 3.48Å; A401-H451 VanDerWaalsContact CA-NE2 3.33Å; A401-H451 WeakPolarHBondContact CA-NE2 3.4Å; D402-H451 PolarHBondContact N-NE2 2.93Å; D402-H451 IonicContact OD2-CE1 3.73Å; D402-H451 PolarHBondContact OD2-CE1 2.87Å; D402-H451 VanDerWaalsContact OD2-CE1 3.24Å; D402-H451 IonicContact OD2-NE2 3.96Å; N448-H451 HydrophobicContact CB-CB 4.47Å; N448-H451 WeakPolarHBondContact CB-ND1 3.42Å; S449-H451 VanDerWaalsContact C-N 3.27Å; S449-H451 PolarHBondContact O-CE1 2.8Å; S449-H451 PolarHBondContact O-N 3.25Å; S449-H451 PolarHBondContact O-ND1 3Å; H451-Y453 HydrophobicContact CB-CE2 3.65Å; H451-Y453 VanDerWaalsContact O-CD2 3.27Å; H451-Y453 WeakPolarHBondContact O-CD2 3.41Å; H451-Y453 WeakPolarHBondContact O-CE2 3.48Å; H451-I484 WeakPolarHBondContact O-CA 3.39Å; H451-A485 PolarHBondContact O-N 3.43Å
452	K	98.1	Very high	95.9	Very high	46 Å²	46	26.4 Å²	26.4	20%	0.2	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138.4	-175	-155.1	-174.7	-162	-143.8	0	110.9	A383 D384 Y388 E482 F483 I484	A383-K452 HydrophobicContact CB-CB 4.18Å; A383-K452 HydrophobicContact CB-CD 4.22Å; A383-K452 HydrophobicContact CB-CG 4.06Å; A383-K452 PolarHBondContact N-O 3.28Å; D384-K452 WeakPolarHBondContact OD2-CD 3.42Å; Y388-K452 HydrophobicContact CD2-CB 4.34Å; Y388-K452 HydrophobicContact CE2-CB 3.83Å; Y388-K452 HydrophobicContact CE2-CD 4.25Å; K452-E482 HydrophobicContact CD-CG 4.46Å; K452-E482 WeakPolarHBondContact CE-OE1 3.47Å; K452-E482 VanDerWaalsContact CE-OE2 3.27Å; K452-E482 WeakPolarHBondContact CE-OE2 3.33Å; K452-E482 HydrophobicContact CG-CG 4.22Å; K452-E482 IonicContact NZ-OE1 3.78Å; K452-E482 PolarHBondContact NZ-OE1 2.76Å; K452-E482 IonicContact NZ-OE2 3.84Å; K452-E482 PolarHBondContact NZ-OE2 3.44Å; K452-F483 WeakPolarHBondContact CA-O 3.44Å; K452-I484 HydrophobicContact CB-CG1 4.19Å; K452-I484 HydrophobicContact CG-CG1 3.9Å
453	Y	98.1	Very high	96	Very high	8 Å²	8	24.2 Å²	24.2	3%	0.031	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.3	-168.4	-70.1	-71.3	0	0	0	112.6	I380 V381 A382 L447 N448 H451 E482 F483 A485	I380-Y453 HydrophobicContact CG2-CD1 3.97Å; I380-Y453 HydrophobicContact CG2-CG 4.02Å; V381-Y453 WeakPolarHBondContact O-CA 3.49Å; V381-Y453 WeakPolarHBondContact O-CD1 3.35Å; A382-Y453 HydrophobicContact CB-CE1 4.45Å; L447-Y453 HydrophobicContact CB-CD2 4.5Å; L447-Y453 HydrophobicContact CB-CE2 3.85Å; L447-Y453 HydrophobicContact CD1-CD2 4.14Å; L447-Y453 HydrophobicContact CD1-CE2 4.31Å; L447-Y453 HydrophobicContact CD1-CG 4.48Å; L447-Y453 HydrophobicContact CD2-CD1 3.79Å; L447-Y453 HydrophobicContact CD2-CD2 4.23Å; L447-Y453 HydrophobicContact CD2-CE1 3.67Å; L447-Y453 HydrophobicContact CD2-CE2 4.07Å; L447-Y453 HydrophobicContact CD2-CG 4.09Å; L447-Y453 HydrophobicContact CG-CE2 4.3Å; N448-Y453 PolarHBondContact N-OH 2.91Å; H451-Y453 HydrophobicContact CB-CE2 3.65Å; H451-Y453 VanDerWaalsContact O-CD2 3.27Å; H451-Y453 WeakPolarHBondContact O-CD2 3.41Å; H451-Y453 WeakPolarHBondContact O-CE2 3.48Å; Y453-E482 WeakPolarHBondContact O-CA 3.41Å; Y453-F483 HydrophobicContact CD2-CE2 4.18Å; Y453-F483 HydrophobicContact CG-CZ 4.43Å; Y453-F483 PolarHBondContact N-O 3.38Å; Y453-F483 PolarHBondContact O-N 2.73Å; Y453-A485 HydrophobicContact CD2-CB 3.82Å; Y453-A485 HydrophobicContact CE2-CB 3.72Å
454	Q	97.9	Very high	96.1	Very high	22 Å²	22	25.1 Å²	25.1	10%	0.103	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.9	175	176.6	62.7	77.6	0	0	109.5	V381 A383 R456 V477 F478 T481	V381-Q454 HydrophobicContact CG2-CB 4.4Å; V381-Q454 PolarHBondContact N-O 2.85Å; V381-Q454 PolarHBondContact O-N 3.14Å; A383-Q454 HydrophobicContact CB-CB 4.39Å; Q454-R456 HydrophobicContact CG-CG 4.47Å; Q454-V477 HydrophobicContact CG-CG1 3.48Å; Q454-V477 VanDerWaalsContact CG-CG1 3.48Å; Q454-F478 PolarHBondContact NE2-O 3.24Å; Q454-T481 PolarHBondContact NE2-OG1 2.88Å
455	P	97.7	Very high	95.8	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.013	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	139.4	164.6	-22.3	33.4	0	0	0	111.3	M361 L378 T481 F483	M361-P455 HydrophobicContact CE-CB 3.68Å; M361-P455 HydrophobicContact CE-CG 4.27Å; M361-P455 HydrophobicContact SD-CB 4.24Å; M361-P455 HydrophobicContact SD-CG 4.25Å; L378-P455 HydrophobicContact CD2-CB 4.4Å; P455-T481 VanDerWaalsContact CD-O 3.23Å; P455-T481 WeakPolarHBondContact CD-O 3.27Å; P455-T481 WeakPolarHBondContact CG-O 3.41Å; P455-F483 HydrophobicContact CG-CD1 4.12Å; P455-F483 HydrophobicContact CG-CE1 3.92Å
456	R	97.4	Very high	95.5	Very high	65 Å²	65	32.8 Å²	32.8	25%	0.245	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.4	171.7	-53	157.3	60.4	-133.9	12.2	108.6	L378 D379 V381 Q454 H458 T475 V477	L378-R456 WeakPolarHBondContact CA-O 3.48Å; D379-R456 PolarHBondContact N-O 2.96Å; D379-R456 VanDerWaalsContact N-O 3.07Å; D379-R456 PolarHBondContact O-N 2.97Å; D379-R456 WeakPolarHBondContact OD1-CB 3.19Å; D379-R456 WeakPolarHBondContact OD1-CD 3.36Å; D379-R456 IonicContact OD1-CZ 3.8Å; D379-R456 IonicContact OD1-NE 2.68Å; D379-R456 IonicContact OD1-NH1 3.35Å; D379-R456 PolarHBondContact OD1-NH1 3.19Å; D379-R456 IonicContact OD2-NH1 2.7Å; D379-R456 PolarHBondContact OD2-NH1 2.93Å; V381-R456 HydrophobicContact CG2-CG 4.4Å; Q454-R456 HydrophobicContact CG-CG 4.47Å; R456-H458 WeakPolarHBondContact CB-NE2 3.39Å; R456-H458 PolarHBondContact NH1-CE1 2.95Å; R456-H458 PolarHBondContact NH1-NE2 3.09Å; R456-H458 PolarHBondContact NH2-CE1 3.22Å; R456-H458 PolarHBondContact O-CD2 3.24Å; R456-H458 VanDerWaalsContact O-CD2 3.24Å; R456-H458 PolarHBondContact O-NE2 2.75Å; R456-T475 HydrophobicContact CB-CG2 4.05Å; R456-V477 HydrophobicContact CB-CG2 4.39Å; R456-V477 HydrophobicContact CG-CG1 4.47Å; R456-V477 HydrophobicContact CG-CG2 4.01Å
457	F	97.8	Very high	95.1	Very high	1 Å²	1	37 Å²	37	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.4	175.9	171	-98.6	0	0	0	109.5	V330 F363 V365 L376 F429 L459 T475 Y476	V330-F457 HydrophobicContact CB-CE1 4.41Å; V330-F457 HydrophobicContact CG1-CD1 3.77Å; V330-F457 HydrophobicContact CG1-CE1 3.72Å; V330-F457 HydrophobicContact CG2-CD1 4.26Å; V330-F457 HydrophobicContact CG2-CE1 3.79Å; F363-F457 HydrophobicContact CD1-CG 4.43Å; F363-F457 AromaticContact CD2-CD2 3.57Å; F363-F457 HydrophobicContact CD2-CD2 3.57Å; F363-F457 AromaticContact CD2-CE2 3.84Å; F363-F457 HydrophobicContact CD2-CE2 3.84Å; F363-F457 HydrophobicContact CD2-CG 4.15Å; F363-F457 HydrophobicContact CE1-CB 3.94Å; F363-F457 HydrophobicContact CE1-CG 4.25Å; F363-F457 HydrophobicContact CE2-CB 4.04Å; F363-F457 AromaticContact CE2-CD2 3.46Å; F363-F457 HydrophobicContact CE2-CD2 3.46Å; F363-F457 VanDerWaalsContact CE2-CD2 3.46Å; F363-F457 HydrophobicContact CE2-CE2 4.18Å; F363-F457 AromaticContact CE2-CG 3.95Å; F363-F457 HydrophobicContact CE2-CG 3.95Å; F363-F457 HydrophobicContact CG-CD2 4.16Å; F363-F457 HydrophobicContact CG-CE2 4.35Å; F363-F457 HydrophobicContact CG-CG 4.37Å; F363-F457 HydrophobicContact CZ-CB 3.63Å; F363-F457 AromaticContact CZ-CD2 3.97Å; F363-F457 HydrophobicContact CZ-CD2 3.97Å; F363-F457 AromaticContact CZ-CG 3.99Å; F363-F457 HydrophobicContact CZ-CG 3.99Å; V365-F457 HydrophobicContact CG2-CZ 4.18Å; L376-F457 HydrophobicContact CB-CE2 4.08Å; L376-F457 HydrophobicContact CB-CZ 4.28Å; L376-F457 HydrophobicContact CD1-CE2 4.3Å; L376-F457 HydrophobicContact CD1-CZ 3.99Å; L376-F457 HydrophobicContact CD2-CE2 4.48Å; L376-F457 HydrophobicContact CD2-CZ 3.84Å; L376-F457 HydrophobicContact CG-CZ 4.25Å; F429-F457 AromaticContact CE2-CD2 3.81Å; F429-F457 HydrophobicContact CE2-CD2 3.81Å; F429-F457 AromaticContact CE2-CE2 3.72Å; F429-F457 HydrophobicContact CE2-CE2 3.72Å; F429-F457 AromaticContact CZ-CD2 4Å; F429-F457 HydrophobicContact CZ-CD2 4Å; F429-F457 AromaticContact CZ-CE2 3.9Å; F429-F457 HydrophobicContact CZ-CE2 3.9Å; F457-L459 HydrophobicContact CE1-CB 4.29Å; F457-T475 CarbonylContact O-C 3.45Å; F457-T475 WeakPolarHBondContact O-CA 3.27Å; F457-Y476 AromaticContact CD1-CD2 3.7Å; F457-Y476 HydrophobicContact CD1-CD2 3.7Å; F457-Y476 HydrophobicContact CD1-CG 4.22Å; F457-Y476 HydrophobicContact CE1-CD2 4.15Å; F457-Y476 PolarHBondContact N-O 3.5Å; F457-Y476 PolarHBondContact O-N 3.28Å
458	H	96.8	Very high	94.6	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.028	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.7	-175.1	-61.4	-92.3	0	0	0	110.4	L376 L377 D379 R456 F473 T475	L376-H458 WeakPolarHBondContact CA-O 3.43Å; L377-H458 HydrophobicContact CD1-CB 3.52Å; L377-H458 HydrophobicContact CG-CB 3.83Å; L377-H458 PolarHBondContact N-O 2.83Å; L377-H458 PolarHBondContact O-N 3.01Å; D379-H458 WeakPolarHBondContact CB-NE2 3.46Å; D379-H458 IonicContact OD1-CD2 3.9Å; D379-H458 IonicContact OD1-CE1 3.27Å; D379-H458 IonicContact OD1-NE2 3.37Å; D379-H458 PolarHBondContact OD1-NE2 2.81Å; D379-H458 IonicContact OD2-NE2 2.67Å; D379-H458 PolarHBondContact OD2-NE2 3.5Å; D379-H458 VanDerWaalsContact OD2-NE2 3.12Å; R456-H458 WeakPolarHBondContact CB-NE2 3.39Å; R456-H458 PolarHBondContact NH1-CE1 2.95Å; R456-H458 PolarHBondContact NH1-NE2 3.09Å; R456-H458 PolarHBondContact NH2-CE1 3.22Å; R456-H458 PolarHBondContact O-CD2 3.24Å; R456-H458 VanDerWaalsContact O-CD2 3.24Å; R456-H458 PolarHBondContact O-NE2 2.75Å; H458-F473 HydrophobicContact CB-CD1 4.13Å; H458-F473 AromaticContact ND1-CD1 3.77Å; H458-T475 VanDerWaalsContact CE1-CG2 3.44Å; H458-T475 WeakPolarHBondContact CE1-CG2 3.46Å; H458-T475 PolarHBondContact CE1-OG1 3.02Å; H458-T475 PolarHBondContact ND1-OG1 3.2Å
459	L	95.8	Very high	94.2	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.5	173.4	-175.7	145.4	0	0	0	108.7	P328 V365 L368 Y374 L376 F457 R474 Y476	P328-L459 HydrophobicContact CB-CD1 4.47Å; P328-L459 HydrophobicContact CB-CD2 4.48Å; V365-L459 HydrophobicContact CG1-CD1 3.87Å; L368-L459 HydrophobicContact CD1-CD1 4.21Å; L368-L459 HydrophobicContact CD2-CD1 3.57Å; L368-L459 HydrophobicContact CD2-CD2 4.15Å; L368-L459 HydrophobicContact CD2-CG 4.49Å; Y374-L459 HydrophobicContact CD1-CD2 3.7Å; Y374-L459 HydrophobicContact CD1-CG 4.3Å; Y374-L459 HydrophobicContact CE1-CD2 4.09Å; L376-L459 HydrophobicContact CD2-CB 3.87Å; L376-L459 HydrophobicContact CD2-CD1 3.62Å; L376-L459 HydrophobicContact CD2-CG 3.59Å; F457-L459 HydrophobicContact CE1-CB 4.29Å; L459-R474 HydrophobicContact CB-CB 4.49Å; L459-R474 PolarHBondContact N-O 2.8Å; L459-R474 WeakPolarHBondContact O-CB 3.47Å; L459-R474 PolarHBondContact O-N 3.02Å; L459-Y476 HydrophobicContact CB-CE2 4.14Å
460	V	95.6	Very high	93.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.4	-174.4	-171.5	0	0	0	0	109	Y374 I375 A462 L468 S471 F473	Y374-V460 CarbonylContact C-O 3.56Å; Y374-V460 VanDerWaalsContact CA-O 3.24Å; Y374-V460 WeakPolarHBondContact CA-O 3.2Å; I375-V460 PolarHBondContact N-O 3.42Å; I375-V460 PolarHBondContact O-N 3.18Å; V460-A462 HydrophobicContact CG1-CB 4.17Å; V460-A462 PolarHBondContact O-N 2.89Å; V460-L468 HydrophobicContact CB-CD2 3.96Å; V460-L468 HydrophobicContact CG1-CD2 3.82Å; V460-L468 HydrophobicContact CG2-CD2 4.02Å; V460-S471 VanDerWaalsContact CG1-OG 3.29Å; V460-S471 WeakPolarHBondContact CG1-OG 3.18Å; V460-F473 HydrophobicContact CG2-CD1 3.7Å; V460-F473 HydrophobicContact CG2-CE1 3.96Å; V460-F473 HydrophobicContact CG2-CG 4.01Å; V460-F473 HydrophobicContact CG2-CZ 4.47Å
461	R	93.6	Very high	93.3	Very high	59 Å²	59	49.5 Å²	49.5	22%	0.223	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	104.4	173.7	-172.1	177.7	175.4	113.3	-2.3	107.7	D322 D326 Y374 S471	D322-R461 IonicContact OD2-CZ 3.76Å; D322-R461 IonicContact OD2-NE 3.99Å; D322-R461 PolarHBondContact OD2-NE 2.89Å; D322-R461 IonicContact OD2-NH2 2.74Å; D322-R461 PolarHBondContact OD2-NH2 3.09Å; D326-R461 IonicContact OD1-NH1 3.4Å; D326-R461 PolarHBondContact OD1-NH1 3.15Å; D326-R461 IonicContact OD2-CZ 3.15Å; D326-R461 IonicContact OD2-NH1 2.76Å; D326-R461 PolarHBondContact OD2-NH1 3Å; Y374-R461 HydrophobicContact CD1-CB 4.02Å; Y374-R461 HydrophobicContact CD1-CG 4.39Å; Y374-R461 HydrophobicContact CE1-CB 3.91Å; Y374-R461 HydrophobicContact CE1-CG 3.97Å; Y374-R461 PolarHBondContact OH-NH1 3.09Å; R461-S471 PolarHBondContact O-OG 2.9Å
462	A	92.5	Very high	92.9	Very high	9 Å²	9	53.1 Å²	53.1	7%	0.074	26%	0.263	C	S	.	.			trans	-161.5	135.8	-172.8	0	0	0	0	0	111.1	K373 I375 V460	K373-A462 CarbonylContact C-O 3.59Å; K373-A462 WeakPolarHBondContact CB-O 3.19Å; K373-A462 CarbonylContact O-C 3.59Å; K373-A462 PolarHBondContact O-N 2.92Å; I375-A462 HydrophobicContact CD1-CB 3.86Å; I375-A462 HydrophobicContact CG1-CB 4.37Å; V460-A462 HydrophobicContact CG1-CB 4.17Å; V460-A462 PolarHBondContact O-N 2.89Å
463	N	91.6	Very high	92.6	Very high	92 Å²	92	54.3 Å²	54.3	49%	0.492	27%	0.268	S	S	.	.	S	Bend	trans	-87.4	-8.9	176.9	72.2	-41.8	0	0	0	114.3	K373 K467	K373-N463 HydrophobicContact CB-CB 4.33Å; K373-N463 HydrophobicContact CD-CB 4.18Å; N463-K467 WeakPolarHBondContact OD1-CD 3.43Å; N463-K467 WeakPolarHBondContact OD1-CE 3.35Å; N463-K467 PolarHBondContact OD1-NZ 3.27Å
464	D	91	Very high	92.4	Very high	62 Å²	62	58.9 Å²	58.9	33%	0.332	29%	0.286	S	S	.	.			trans	-151.6	142.7	-174.8	-178.6	6.4	0	0	0	110.6	I375 L466 K467	I375-D464 WeakPolarHBondContact CD1-O 3.47Å; D464-L466 VanDerWaalsContact C-N 3.29Å; D464-L466 PolarHBondContact O-N 2.83Å; D464-L466 PolarHBondContact OD1-N 3.13Å; D464-L466 VanDerWaalsContact OD1-N 3.11Å; D464-K467 HydrophobicContact CB-CG 4.45Å; D464-K467 PolarHBondContact O-N 3.33Å
465	I	90	Very high	92.4	Very high	68 Å²	68	60.5 Å²	60.5	35%	0.349	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-65.3	-32.1	177.8	-68.1	169.4	0	0	0	111.2	I375 I411 K467 L468	I375-I465 HydrophobicContact CD1-CB 4.37Å; I375-I465 HydrophobicContact CD1-CG1 3.83Å; I411-I465 HydrophobicContact CD1-CG2 3.8Å; I465-K467 PolarHBondContact O-N 2.73Å; I465-K467 VanDerWaalsContact O-N 3.11Å; I465-L468 HydrophobicContact CG2-CD1 4.03Å; I465-L468 WeakPolarHBondContact O-CB 3.33Å; I465-L468 WeakPolarHBondContact O-CG 3.33Å; I465-L468 PolarHBondContact O-N 2.9Å
466	L	89.5	Confident	92.3	Very high	136 Å²	136	62.6 Å²	62.6	71%	0.712	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-63.3	-17.7	177.4	-59.6	177.8	0	0	0	113.2	D464	D464-L466 VanDerWaalsContact C-N 3.29Å; D464-L466 PolarHBondContact O-N 2.83Å; D464-L466 PolarHBondContact OD1-N 3.13Å; D464-L466 VanDerWaalsContact OD1-N 3.11Å
467	K	86.6	Confident	92.3	Very high	103 Å²	103	63.1 Å²	63.1	45%	0.448	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-87.7	-7.2	175.7	-63.6	-176.3	179.1	179.7	0	114.2	N463 D464 I465 P469 Y470 S471	N463-K467 WeakPolarHBondContact OD1-CD 3.43Å; N463-K467 WeakPolarHBondContact OD1-CE 3.35Å; N463-K467 PolarHBondContact OD1-NZ 3.27Å; D464-K467 HydrophobicContact CB-CG 4.45Å; D464-K467 PolarHBondContact O-N 3.33Å; I465-K467 PolarHBondContact O-N 2.73Å; I465-K467 VanDerWaalsContact O-N 3.11Å; K467-P469 VanDerWaalsContact C-CD 3.44Å; K467-Y470 PolarHBondContact O-N 2.99Å; K467-S471 PolarHBondContact O-N 3.29Å; K467-S471 VanDerWaalsContact O-N 3.09Å
468	L	86.4	Confident	92.3	Very high	14 Å²	14	64.5 Å²	64.5	7%	0.073	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-53.3	-41.4	-179.4	-73.8	178.5	0	0	0	114.1	I375 L377 I411 V460 I465 Y470 S471 F473	I375-L468 HydrophobicContact CB-CD2 4.06Å; I375-L468 HydrophobicContact CD1-CD1 4.35Å; I375-L468 HydrophobicContact CD1-CD2 3.69Å; I375-L468 HydrophobicContact CD1-CG 3.89Å; I375-L468 HydrophobicContact CG1-CD2 4.48Å; I375-L468 HydrophobicContact CG2-CD1 4.23Å; I375-L468 HydrophobicContact CG2-CD2 4Å; L377-L468 HydrophobicContact CD2-CD1 3.88Å; L377-L468 HydrophobicContact CD2-CD2 4.09Å; I411-L468 HydrophobicContact CD1-CD1 3.65Å; I411-L468 HydrophobicContact CG1-CD1 4.27Å; V460-L468 HydrophobicContact CB-CD2 3.96Å; V460-L468 HydrophobicContact CG1-CD2 3.82Å; V460-L468 HydrophobicContact CG2-CD2 4.02Å; I465-L468 HydrophobicContact CG2-CD1 4.03Å; I465-L468 WeakPolarHBondContact O-CB 3.33Å; I465-L468 WeakPolarHBondContact O-CG 3.33Å; I465-L468 PolarHBondContact O-N 2.9Å; L468-Y470 PolarHBondContact O-N 3.17Å; L468-Y470 VanDerWaalsContact O-N 3.09Å; L468-S471 PolarHBondContact O-N 2.87Å; L468-F473 WeakPolarHBondContact O-CE2 3.3Å; L468-F473 WeakPolarHBondContact O-CZ 3.25Å
469	P	87.4	Confident	92.3	Very high	102 Å²	102	72 Å²	72	66%	0.662	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-64.2	-14.4	178.3	-22.7	35.2	0	0	0	115	K467	K467-P469 VanDerWaalsContact C-CD 3.44Å
470	Y	86.7	Confident	92.4	Very high	206 Å²	206	73.2 Å²	73.2	81%	0.808	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-119.8	-2.3	-173.5	-50.9	-73.2	0	0	0	113.4	K467 L468	K467-Y470 PolarHBondContact O-N 2.99Å; L468-Y470 PolarHBondContact O-N 3.17Å; L468-Y470 VanDerWaalsContact O-N 3.09Å
471	S	89.9	Confident	92.5	Very high	30 Å²	30	73.2 Å²	73.2	21%	0.21	36%	0.359	C	S	.	.	S	Bend	trans	-101.5	161.1	-177.9	-171.8	0	0	0	0	112.2	V460 R461 K467 L468 F473	V460-S471 VanDerWaalsContact CG1-OG 3.29Å; V460-S471 WeakPolarHBondContact CG1-OG 3.18Å; R461-S471 PolarHBondContact O-OG 2.9Å; K467-S471 PolarHBondContact O-N 3.29Å; K467-S471 VanDerWaalsContact O-N 3.09Å; L468-S471 PolarHBondContact O-N 2.87Å; S471-F473 VanDerWaalsContact O-CD2 3.28Å; S471-F473 WeakPolarHBondContact O-CD2 3.48Å
472	T	89.6	Confident	92.8	Very high	82 Å²	82	72.4 Å²	72.4	50%	0.503	36%	0.358	S	S	.	.			trans	-83.8	122	-174.3	51.2	0	0	0	0	111.7
473	F	92.9	Very high	93.1	Very high	72 Å²	72	72.2 Å²	72.2	32%	0.316	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	108.4	-179.2	-71.1	-110.5	0	0	0	111.2	L377 M409 H458 V460 L468 S471 T475	L377-F473 HydrophobicContact CD1-CE1 4.33Å; L377-F473 HydrophobicContact CD2-CE1 4.09Å; M409-F473 HydrophobicContact CE-CE1 4.16Å; M409-F473 HydrophobicContact CE-CZ 4.39Å; M409-F473 HydrophobicContact SD-CE1 4.2Å; M409-F473 HydrophobicContact SD-CZ 4.49Å; H458-F473 HydrophobicContact CB-CD1 4.13Å; H458-F473 AromaticContact ND1-CD1 3.77Å; V460-F473 HydrophobicContact CG2-CD1 3.7Å; V460-F473 HydrophobicContact CG2-CE1 3.96Å; V460-F473 HydrophobicContact CG2-CG 4.01Å; V460-F473 HydrophobicContact CG2-CZ 4.47Å; L468-F473 WeakPolarHBondContact O-CE2 3.3Å; L468-F473 WeakPolarHBondContact O-CZ 3.25Å; S471-F473 VanDerWaalsContact O-CD2 3.28Å; S471-F473 WeakPolarHBondContact O-CD2 3.48Å; F473-T475 PolarHBondContact O-N 3.17Å
474	R	94.3	Very high	93.4	Very high	104 Å²	104	68.2 Å²	68.2	39%	0.392	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	106.3	165.6	-61.6	-170.3	-174.1	-149.9	14.8	108.3	D326 P328 L459 Y476	D326-R474 PolarHBondContact O-NH1 3.04Å; D326-R474 PolarHBondContact O-NH2 3.07Å; P328-R474 VanDerWaalsContact CG-NH1 3.32Å; L459-R474 HydrophobicContact CB-CB 4.49Å; L459-R474 PolarHBondContact N-O 2.8Å; L459-R474 WeakPolarHBondContact O-CB 3.47Å; L459-R474 PolarHBondContact O-N 3.02Å; R474-Y476 HydrophobicContact CB-CE2 4.03Å; R474-Y476 WeakPolarHBondContact O-CD2 3.41Å; R474-Y476 WeakPolarHBondContact O-CE2 3.42Å
475	T	96.6	Very high	93.7	Very high	56 Å²	56	65.3 Å²	65.3	34%	0.344	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134	-174.6	-53.7	0	0	0	0	111.6	R456 F457 H458 F473 V477	R456-T475 HydrophobicContact CB-CG2 4.05Å; F457-T475 CarbonylContact O-C 3.45Å; F457-T475 WeakPolarHBondContact O-CA 3.27Å; H458-T475 VanDerWaalsContact CE1-CG2 3.44Å; H458-T475 WeakPolarHBondContact CE1-CG2 3.46Å; H458-T475 PolarHBondContact CE1-OG1 3.02Å; H458-T475 PolarHBondContact ND1-OG1 3.2Å; F473-T475 PolarHBondContact O-N 3.17Å; T475-V477 HydrophobicContact CG2-CG2 4.05Å
476	Y	97.2	Very high	94.1	Very high	46 Å²	46	62 Å²	62	18%	0.18	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.5	176.4	-56.1	-97.6	0	0	0	109.8	P328 V330 F457 L459 R474	P328-Y476 WeakPolarHBondContact CB-OH 3.36Å; P328-Y476 WeakPolarHBondContact CG-OH 3Å; P328-Y476 PolarHBondContact O-OH 2.94Å; V330-Y476 HydrophobicContact CB-CD1 3.83Å; V330-Y476 HydrophobicContact CB-CD2 4.46Å; V330-Y476 HydrophobicContact CB-CE1 4.05Å; V330-Y476 HydrophobicContact CB-CG 4.06Å; V330-Y476 HydrophobicContact CG2-CD1 3.82Å; V330-Y476 HydrophobicContact CG2-CD2 3.87Å; V330-Y476 HydrophobicContact CG2-CE1 3.64Å; V330-Y476 HydrophobicContact CG2-CE2 3.7Å; V330-Y476 HydrophobicContact CG2-CG 3.94Å; F457-Y476 AromaticContact CD1-CD2 3.7Å; F457-Y476 HydrophobicContact CD1-CD2 3.7Å; F457-Y476 HydrophobicContact CD1-CG 4.22Å; F457-Y476 HydrophobicContact CE1-CD2 4.15Å; F457-Y476 PolarHBondContact N-O 3.5Å; F457-Y476 PolarHBondContact O-N 3.28Å; L459-Y476 HydrophobicContact CB-CE2 4.14Å; R474-Y476 HydrophobicContact CB-CE2 4.03Å; R474-Y476 WeakPolarHBondContact O-CD2 3.41Å; R474-Y476 WeakPolarHBondContact O-CE2 3.42Å
477	V	97.4	Very high	94.6	Very high	75 Å²	75	59.5 Å²	59.5	46%	0.455	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.2	-173.2	-168.5	0	0	0	0	109.6	Q454 R456 T475	Q454-V477 HydrophobicContact CG-CG1 3.48Å; Q454-V477 VanDerWaalsContact CG-CG1 3.48Å; R456-V477 HydrophobicContact CB-CG2 4.39Å; R456-V477 HydrophobicContact CG-CG1 4.47Å; R456-V477 HydrophobicContact CG-CG2 4.01Å; T475-V477 HydrophobicContact CG2-CG2 4.05Å
478	F	97.6	Very high	95.1	Very high	31 Å²	31	57.2 Å²	57.2	14%	0.136	29%	0.292	C	S	.	.			trans	-108.2	106.4	-178.2	-64	-86.4	0	0	0	108.3	V330 L332 F363 Q454 E480 T481	V330-F478 HydrophobicContact CG1-CE2 4.3Å; V330-F478 HydrophobicContact CG1-CZ 4.1Å; L332-F478 HydrophobicContact CB-CD1 4.08Å; L332-F478 HydrophobicContact CB-CD2 4.48Å; L332-F478 HydrophobicContact CB-CE1 3.99Å; L332-F478 HydrophobicContact CB-CE2 4.4Å; L332-F478 HydrophobicContact CB-CG 4.33Å; L332-F478 HydrophobicContact CB-CZ 4.16Å; L332-F478 HydrophobicContact CD2-CB 4.31Å; L332-F478 HydrophobicContact CD2-CD1 4.19Å; L332-F478 HydrophobicContact CD2-CG 4.27Å; F363-F478 AromaticContact CD1-CE2 3.88Å; F363-F478 HydrophobicContact CD1-CE2 3.88Å; F363-F478 HydrophobicContact CD1-CZ 4.4Å; F363-F478 AromaticContact CE1-CD2 3.83Å; F363-F478 HydrophobicContact CE1-CD2 3.83Å; F363-F478 AromaticContact CE1-CE2 3.6Å; F363-F478 HydrophobicContact CE1-CE2 3.6Å; F363-F478 HydrophobicContact CE1-CZ 4.49Å; Q454-F478 PolarHBondContact NE2-O 3.24Å; F478-E480 WeakPolarHBondContact CA-OE2 3.49Å; F478-E480 WeakPolarHBondContact CB-OE2 3.48Å; F478-E480 PolarHBondContact O-N 3.41Å; F478-T481 HydrophobicContact CB-CG2 3.73Å; F478-T481 WeakPolarHBondContact O-CB 3.38Å; F478-T481 PolarHBondContact O-N 3.22Å; F478-T481 PolarHBondContact O-OG1 3.44Å
479	K	97.1	Very high	95.7	Very high	163 Å²	163	59.9 Å²	59.9	71%	0.709	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-62.8	-32.6	-173.1	-64.2	-173.2	179.2	-175.6	0	112.2	H342 T481 E482	H342-K479 PolarHBondContact CE1-O 2.89Å; H342-K479 PolarHBondContact ND1-O 2.87Å; K479-T481 PolarHBondContact O-N 3.35Å; K479-T481 VanDerWaalsContact O-N 3.14Å; K479-E482 VanDerWaalsContact O-CB 3.22Å; K479-E482 WeakPolarHBondContact O-CB 3.33Å; K479-E482 PolarHBondContact O-N 2.81Å; K479-E482 VanDerWaalsContact O-N 3.13Å
480	E	97.1	Very high	96.2	Very high	27 Å²	27	58.4 Å²	58.4	13%	0.126	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-62.9	-14.2	173.8	66.7	-88.8	-134.5	0	0	113.8	L332 K335 W338 E339 F478	L332-E480 HydrophobicContact CD2-CG 4.13Å; K335-E480 WeakPolarHBondContact CD-OE1 3.35Å; K335-E480 WeakPolarHBondContact CE-OE1 3.38Å; K335-E480 HydrophobicContact CG-CG 4.47Å; W338-E480 HydrophobicContact CB-CB 4.41Å; W338-E480 HydrophobicContact CB-CG 4.05Å; E339-E480 HydrophobicContact CG-CB 4.22Å; F478-E480 WeakPolarHBondContact CA-OE2 3.49Å; F478-E480 WeakPolarHBondContact CB-OE2 3.48Å; F478-E480 PolarHBondContact O-N 3.41Å
481	T	98.3	Very high	96.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-95.2	-0.8	177.4	71.2	0	0	0	0	113.9	L332 W338 M361 Q454 P455 F478 K479	L332-T481 HydrophobicContact CD1-CG2 3.71Å; L332-T481 HydrophobicContact CD2-CG2 3.81Å; L332-T481 HydrophobicContact CG-CG2 4.45Å; W338-T481 HydrophobicContact CD2-CG2 3.81Å; W338-T481 HydrophobicContact CE3-CG2 3.97Å; W338-T481 HydrophobicContact CG-CG2 4.15Å; W338-T481 HydrophobicContact CZ2-CG2 4.5Å; W338-T481 HydrophobicContact CZ3-CG2 4.35Å; M361-T481 HydrophobicContact CE-CG2 3.78Å; M361-T481 HydrophobicContact SD-CG2 3.83Å; Q454-T481 PolarHBondContact NE2-OG1 2.88Å; P455-T481 VanDerWaalsContact CD-O 3.23Å; P455-T481 WeakPolarHBondContact CD-O 3.27Å; P455-T481 WeakPolarHBondContact CG-O 3.41Å; F478-T481 HydrophobicContact CB-CG2 3.73Å; F478-T481 WeakPolarHBondContact O-CB 3.38Å; F478-T481 PolarHBondContact O-N 3.22Å; F478-T481 PolarHBondContact O-OG1 3.44Å; K479-T481 PolarHBondContact O-N 3.35Å; K479-T481 VanDerWaalsContact O-N 3.14Å
482	E	98.3	Very high	97	Very high	43 Å²	43	55.3 Å²	55.3	20%	0.201	28%	0.276	C	S	.	.			trans	-57.3	138	170.3	-172.2	-166.3	64.3	0	0	111.2	H342 T346 A383 K452 Y453 K479	H342-E482 IonicContact CE1-OE1 2.9Å; T346-E482 VanDerWaalsContact CB-O 3.28Å; T346-E482 WeakPolarHBondContact CB-O 3.47Å; T346-E482 PolarHBondContact OG1-O 2.82Å; A383-E482 HydrophobicContact CB-CG 4.43Å; K452-E482 HydrophobicContact CD-CG 4.46Å; K452-E482 WeakPolarHBondContact CE-OE1 3.47Å; K452-E482 VanDerWaalsContact CE-OE2 3.27Å; K452-E482 WeakPolarHBondContact CE-OE2 3.33Å; K452-E482 HydrophobicContact CG-CG 4.22Å; K452-E482 IonicContact NZ-OE1 3.78Å; K452-E482 PolarHBondContact NZ-OE1 2.76Å; K452-E482 IonicContact NZ-OE2 3.84Å; K452-E482 PolarHBondContact NZ-OE2 3.44Å; Y453-E482 WeakPolarHBondContact O-CA 3.41Å; K479-E482 VanDerWaalsContact O-CB 3.22Å; K479-E482 WeakPolarHBondContact O-CB 3.33Å; K479-E482 PolarHBondContact O-N 2.81Å; K479-E482 VanDerWaalsContact O-N 3.13Å
483	F	98.6	Very high	97.4	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.4	-178.7	71.2	-90.9	0	0	0	113.5	T346 M348 I380 L434 L447 K452 Y453 P455 A485	T346-F483 HydrophobicContact CG2-CB 3.64Å; T346-F483 CarbonylContact O-C 3.59Å; T346-F483 WeakPolarHBondContact O-CA 3.35Å; T346-F483 WeakPolarHBondContact O-CB 3.45Å; M348-F483 HydrophobicContact CB-CD2 3.5Å; M348-F483 VanDerWaalsContact CB-CD2 3.5Å; M348-F483 HydrophobicContact CB-CE2 3.68Å; M348-F483 HydrophobicContact CB-CG 4.19Å; M348-F483 HydrophobicContact CB-CZ 4.48Å; M348-F483 HydrophobicContact CG-CB 3.95Å; M348-F483 HydrophobicContact CG-CD1 4.06Å; M348-F483 HydrophobicContact CG-CD2 3.36Å; M348-F483 HydrophobicContact CG-CE1 4.41Å; M348-F483 HydrophobicContact CG-CE2 3.79Å; M348-F483 HydrophobicContact CG-CG 3.52Å; M348-F483 HydrophobicContact CG-CZ 4.29Å; I380-F483 HydrophobicContact CD1-CE1 4.35Å; I380-F483 HydrophobicContact CD1-CZ 4.24Å; I380-F483 HydrophobicContact CG2-CE1 4.22Å; I380-F483 HydrophobicContact CG2-CZ 4.1Å; L434-F483 HydrophobicContact CD1-CE2 4.07Å; L434-F483 HydrophobicContact CD1-CZ 3.94Å; L447-F483 HydrophobicContact CD1-CE2 3.85Å; L447-F483 HydrophobicContact CD1-CZ 3.74Å; K452-F483 WeakPolarHBondContact CA-O 3.44Å; Y453-F483 HydrophobicContact CD2-CE2 4.18Å; Y453-F483 HydrophobicContact CG-CZ 4.43Å; Y453-F483 PolarHBondContact N-O 3.38Å; Y453-F483 PolarHBondContact O-N 2.73Å; P455-F483 HydrophobicContact CG-CD1 4.12Å; P455-F483 HydrophobicContact CG-CE1 3.92Å; F483-A485 HydrophobicContact CE2-CB 4.14Å
484	I	98.5	Very high	97.6	Very high	9 Å²	9	54.5 Å²	54.5	5%	0.046	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	166.9	-64	172	0	0	0	109.1	T346 E347 M348 Y388 W395 H451 K452 V486	T346-I484 PolarHBondContact O-N 2.92Å; E347-I484 WeakPolarHBondContact CA-O 3.4Å; M348-I484 PolarHBondContact N-O 2.76Å; Y388-I484 HydrophobicContact CD1-CD1 4.37Å; Y388-I484 HydrophobicContact CD2-CD1 4.47Å; Y388-I484 HydrophobicContact CG-CD1 4.19Å; W395-I484 HydrophobicContact CB-CD1 4.5Å; W395-I484 HydrophobicContact CD2-CD1 3.47Å; W395-I484 VanDerWaalsContact CD2-CD1 3.47Å; W395-I484 HydrophobicContact CE3-CD1 3.68Å; W395-I484 HydrophobicContact CG-CD1 3.86Å; W395-I484 HydrophobicContact CH2-CB 4.32Å; W395-I484 HydrophobicContact CH2-CD1 4.28Å; W395-I484 HydrophobicContact CH2-CG2 3.66Å; W395-I484 HydrophobicContact CZ2-CB 4.3Å; W395-I484 HydrophobicContact CZ2-CD1 4.15Å; W395-I484 HydrophobicContact CZ2-CG2 4.14Å; W395-I484 HydrophobicContact CZ3-CD1 4.06Å; W395-I484 HydrophobicContact CZ3-CG2 3.95Å; H451-I484 WeakPolarHBondContact O-CA 3.39Å; K452-I484 HydrophobicContact CB-CG1 4.19Å; K452-I484 HydrophobicContact CG-CG1 3.9Å; I484-V486 HydrophobicContact CG2-CG1 4.15Å
485	A	98.4	Very high	97.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	133.7	175.9	0	0	0	0	0	110.1	I350 L447 M450 H451 Y453 F483	I350-A485 HydrophobicContact CD1-CB 4.27Å; I350-A485 HydrophobicContact CG2-CB 4.01Å; L447-A485 HydrophobicContact CB-CB 4.17Å; L447-A485 HydrophobicContact CD1-CB 4.12Å; M450-A485 WeakPolarHBondContact CA-O 3.35Å; M450-A485 PolarHBondContact N-O 2.87Å; H451-A485 PolarHBondContact O-N 3.43Å; Y453-A485 HydrophobicContact CD2-CB 3.82Å; Y453-A485 HydrophobicContact CE2-CB 3.72Å; F483-A485 HydrophobicContact CE2-CB 4.14Å
486	V	98.7	Very high	97.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.7	-176.4	-60.1	0	0	0	0	111.7	E347 M348 V349 I350 W395 M450 I484 A488 Y489 Q490	E347-V486 HydrophobicContact CB-CG2 4.08Å; M348-V486 PolarHBondContact O-N 2.91Å; V349-V486 CarbonylContact C-O 3.49Å; V349-V486 VanDerWaalsContact CA-O 3.22Å; V349-V486 WeakPolarHBondContact CA-O 3.47Å; V349-V486 HydrophobicContact CG2-CG2 4.22Å; I350-V486 PolarHBondContact N-O 3.34Å; W395-V486 HydrophobicContact CH2-CG1 3.95Å; W395-V486 HydrophobicContact CZ2-CG1 4.35Å; M450-V486 HydrophobicContact SD-CG1 4.11Å; I484-V486 HydrophobicContact CG2-CG1 4.15Å; V486-A488 WeakPolarHBondContact CB-O 3.38Å; V486-A488 WeakPolarHBondContact CG2-O 3.4Å; V486-Y489 HydrophobicContact CG2-CD1 4.49Å; V486-Q490 HydrophobicContact CG1-CG 4.14Å
487	T	98.2	Very high	97.8	Very high	82 Å²	82	53 Å²	53	50%	0.503	26%	0.264	S	S	.	.	S	Bend	trans	-79.4	-29.7	171.4	46.6	0	0	0	0	112.7	S449	S449-T487 PolarHBondContact OG-N 2.82Å
488	A	98.1	Very high	97.8	Very high	55 Å²	55	49.7 Å²	49.7	46%	0.455	24%	0.244	S	C	.	.	S	Bend	trans	-145.2	151.2	171.2	0	0	0	0	0	109.2	V486 Q490	V486-A488 WeakPolarHBondContact CB-O 3.38Å; V486-A488 WeakPolarHBondContact CG2-O 3.4Å; A488-Q490 PolarHBondContact O-NE2 3.22Å
489	Y	98.4	Very high	97.7	Very high	71 Å²	71	49.4 Å²	49.4	28%	0.278	24%	0.243	S	C	.	.			trans	-59	144.5	-179.6	-62.9	-59.1	0	0	0	112	E347 V349 V486 I494 T495 K498	E347-Y489 HydrophobicContact CB-CD1 4.1Å; E347-Y489 HydrophobicContact CB-CE1 4.49Å; E347-Y489 WeakPolarHBondContact OE2-CA 3.49Å; E347-Y489 WeakPolarHBondContact OE2-CD1 3.44Å; V349-Y489 HydrophobicContact CG2-CD1 3.88Å; V349-Y489 HydrophobicContact CG2-CD2 4.35Å; V349-Y489 HydrophobicContact CG2-CE1 3.51Å; V349-Y489 HydrophobicContact CG2-CE2 4.03Å; V349-Y489 HydrophobicContact CG2-CG 4.27Å; V486-Y489 HydrophobicContact CG2-CD1 4.49Å; Y489-I494 HydrophobicContact CD1-CG2 4.2Å; Y489-I494 HydrophobicContact CE1-CG2 4.35Å; Y489-T495 WeakPolarHBondContact CB-OG1 3.39Å; Y489-T495 HydrophobicContact CD2-CG2 4.12Å; Y489-K498 HydrophobicContact CE1-CD 4.27Å; Y489-K498 HydrophobicContact CE1-CG 4Å; Y489-K498 HydrophobicContact CE2-CG 4.32Å; Y489-K498 WeakPolarHBondContact OH-CG 3.24Å
490	Q	98.3	Very high	97.7	Very high	70 Å²	70	45.6 Å²	45.6	33%	0.327	23%	0.231	S	C	.	.			trans	-108.8	-47	-178.2	-54.5	-66	-76.3	0	0	111	E347 F390 W395 M450 V486 A488	E347-Q490 PolarHBondContact OE1-N 3.11Å; E347-Q490 PolarHBondContact OE2-N 2.91Å; F390-Q490 HydrophobicContact CB-CB 3.6Å; F390-Q490 HydrophobicContact CB-CG 4.08Å; F390-Q490 HydrophobicContact CD1-CB 3.72Å; F390-Q490 WeakPolarHBondContact CD1-O 3.45Å; F390-Q490 HydrophobicContact CD2-CB 4.37Å; F390-Q490 HydrophobicContact CE1-CB 4.46Å; F390-Q490 VanDerWaalsContact CE1-O 3.25Å; F390-Q490 WeakPolarHBondContact CE1-O 3.33Å; F390-Q490 HydrophobicContact CG-CB 3.66Å; W395-Q490 HydrophobicContact CH2-CB 4.19Å; W395-Q490 HydrophobicContact CH2-CG 3.75Å; W395-Q490 HydrophobicContact CZ2-CB 4.05Å; W395-Q490 HydrophobicContact CZ2-CG 4.05Å; M450-Q490 HydrophobicContact CE-CG 4.18Å; V486-Q490 HydrophobicContact CG1-CG 4.14Å; A488-Q490 PolarHBondContact O-NE2 3.22Å
491	N	97.4	Very high	97.7	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.08	24%	0.24	C	C	.	.			trans	-87.8	110	175.3	-175.2	-1.9	0	0	0	110.6	L344 E347 F390 K493 I494 T495	L344-N491 PolarHBondContact O-ND2 2.91Å; E347-N491 WeakPolarHBondContact OE1-CB 3.07Å; E347-N491 PolarHBondContact OE1-N 2.98Å; F390-N491 HydrophobicContact CE1-CB 4.22Å; F390-N491 HydrophobicContact CE2-CB 3.95Å; F390-N491 HydrophobicContact CZ-CB 3.59Å; N491-K493 PolarHBondContact O-N 2.82Å; N491-K493 VanDerWaalsContact O-N 3.09Å; N491-K493 WeakPolarHBondContact OD1-CB 3.25Å; N491-K493 PolarHBondContact OD1-N 2.95Å; N491-K493 VanDerWaalsContact OD1-N 3.09Å; N491-I494 HydrophobicContact CB-CB 4.29Å; N491-I494 HydrophobicContact CB-CG1 3.85Å; N491-I494 WeakPolarHBondContact O-CA 3.17Å; N491-I494 VanDerWaalsContact O-CB 3.3Å; N491-I494 WeakPolarHBondContact O-CB 3.38Å; N491-I494 PolarHBondContact O-N 2.89Å; N491-T495 PolarHBondContact O-N 2.89Å
492	E	96.3	Very high	97.6	Very high	156 Å²	156	48.2 Å²	48.2	73%	0.729	25%	0.246	S	C	*	.	H	α-helix	trans	-55.8	-29.7	177.4	-62.1	-175.4	161.5	0	0	113.4	I494 T495 Q496	E492-I494 VanDerWaalsContact C-N 3.28Å; E492-I494 PolarHBondContact O-N 3.34Å; E492-T495 WeakPolarHBondContact O-CA 3.43Å; E492-T495 WeakPolarHBondContact O-CB 3.35Å; E492-T495 PolarHBondContact O-N 2.85Å; E492-T495 VanDerWaalsContact O-N 3.09Å; E492-Q496 PolarHBondContact O-N 3Å
493	K	97.3	Very high	97.4	Very high	137 Å²	137	50.6 Å²	50.6	60%	0.596	27%	0.265	S	S	*	.	H	α-helix	trans	-66.5	-32.1	176	-56	-179.5	-178.3	179.6	0	111.8	L344 N491 L497	L344-K493 HydrophobicContact CD1-CB 4.07Å; L344-K493 HydrophobicContact CD2-CB 4.24Å; L344-K493 HydrophobicContact CD2-CD 4.26Å; N491-K493 PolarHBondContact O-N 2.82Å; N491-K493 VanDerWaalsContact O-N 3.09Å; N491-K493 WeakPolarHBondContact OD1-CB 3.25Å; N491-K493 PolarHBondContact OD1-N 2.95Å; N491-K493 VanDerWaalsContact OD1-N 3.09Å; K493-L497 WeakPolarHBondContact O-CB 3.47Å; K493-L497 PolarHBondContact O-N 3.02Å; K493-L497 VanDerWaalsContact O-N 3.15Å
494	I	97.9	Very high	97.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67.2	-48.6	168.7	-63	-73.8	0	0	0	108.9	F341 L344 G345 E347 Y489 N491 E492 Q496 L497 K498	F341-I494 HydrophobicContact CD1-CD1 3.85Å; F341-I494 HydrophobicContact CD1-CG2 4.22Å; F341-I494 HydrophobicContact CE1-CG2 4.16Å; L344-I494 HydrophobicContact CB-CD1 3.5Å; L344-I494 HydrophobicContact CB-CG1 4.17Å; L344-I494 HydrophobicContact CD1-CD1 4.46Å; G345-I494 VanDerWaalsContact O-CD1 3.27Å; G345-I494 WeakPolarHBondContact O-CD1 3.37Å; E347-I494 HydrophobicContact CB-CG2 4.04Å; E347-I494 HydrophobicContact CG-CG1 4.26Å; E347-I494 HydrophobicContact CG-CG2 4.29Å; Y489-I494 HydrophobicContact CD1-CG2 4.2Å; Y489-I494 HydrophobicContact CE1-CG2 4.35Å; N491-I494 HydrophobicContact CB-CB 4.29Å; N491-I494 HydrophobicContact CB-CG1 3.85Å; N491-I494 WeakPolarHBondContact O-CA 3.17Å; N491-I494 VanDerWaalsContact O-CB 3.3Å; N491-I494 WeakPolarHBondContact O-CB 3.38Å; N491-I494 PolarHBondContact O-N 2.89Å; E492-I494 VanDerWaalsContact C-N 3.28Å; E492-I494 PolarHBondContact O-N 3.34Å; I494-Q496 VanDerWaalsContact C-N 3.35Å; I494-Q496 PolarHBondContact O-N 2.8Å; I494-L497 CarbonylContact O-C 3.59Å; I494-L497 PolarHBondContact O-N 2.93Å; I494-L497 VanDerWaalsContact O-N 3.13Å; I494-K498 HydrophobicContact CG2-CD 4.45Å; I494-K498 HydrophobicContact CG2-CG 4.07Å; I494-K498 VanDerWaalsContact O-CG 3.25Å; I494-K498 WeakPolarHBondContact O-CG 3.24Å; I494-K498 PolarHBondContact O-N 2.84Å
495	T	97.1	Very high	96.9	Very high	38 Å²	38	59 Å²	59	23%	0.233	30%	0.304	C	S	.	.	H	α-helix	trans	-52.5	-48.8	179	-54.6	0	0	0	0	112.4	Y489 N491 E492 K498 I499	Y489-T495 WeakPolarHBondContact CB-OG1 3.39Å; Y489-T495 HydrophobicContact CD2-CG2 4.12Å; N491-T495 PolarHBondContact O-N 2.89Å; E492-T495 WeakPolarHBondContact O-CA 3.43Å; E492-T495 WeakPolarHBondContact O-CB 3.35Å; E492-T495 PolarHBondContact O-N 2.85Å; E492-T495 VanDerWaalsContact O-N 3.09Å; T495-K498 WeakPolarHBondContact O-CB 3.31Å; T495-K498 PolarHBondContact O-N 3.07Å; T495-I499 HydrophobicContact CG2-CD1 4.05Å; T495-I499 WeakPolarHBondContact O-CG1 3.38Å; T495-I499 PolarHBondContact O-N 3.06Å
496	Q	96.8	Very high	96.6	Very high	107 Å²	107	65.2 Å²	65.2	50%	0.5	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-47.2	176.7	-59.7	-59.5	-3.7	0	0	111.5	E492 I494 K498 I499 D500	E492-Q496 PolarHBondContact O-N 3Å; I494-Q496 VanDerWaalsContact C-N 3.35Å; I494-Q496 PolarHBondContact O-N 2.8Å; Q496-K498 PolarHBondContact O-N 3.11Å; Q496-I499 WeakPolarHBondContact O-CA 3.49Å; Q496-I499 WeakPolarHBondContact O-CB 3.22Å; Q496-I499 PolarHBondContact O-N 3.37Å; Q496-D500 VanDerWaalsContact O-CG 3.3Å; Q496-D500 PolarHBondContact O-N 3.4Å
497	L	97.2	Very high	96.3	Very high	30 Å²	30	68 Å²	68	16%	0.157	36%	0.36	C	S	.	.	H	α-helix	trans	-60.3	-31.6	177.4	-167.3	70.1	0	0	0	112.5	K340 F341 L344 K493 I494 N501	K340-L497 HydrophobicContact CB-CD2 3.96Å; F341-L497 HydrophobicContact CD1-CD2 3.65Å; F341-L497 HydrophobicContact CD1-CG 4.31Å; F341-L497 HydrophobicContact CD2-CD2 3.97Å; F341-L497 HydrophobicContact CE1-CB 3.82Å; F341-L497 HydrophobicContact CE1-CD2 3.64Å; F341-L497 HydrophobicContact CE1-CG 3.77Å; F341-L497 HydrophobicContact CE2-CD2 3.97Å; F341-L497 HydrophobicContact CE2-CG 4.05Å; F341-L497 HydrophobicContact CG-CD2 3.8Å; F341-L497 HydrophobicContact CZ-CB 4Å; F341-L497 HydrophobicContact CZ-CD2 3.8Å; F341-L497 HydrophobicContact CZ-CG 3.61Å; L344-L497 HydrophobicContact CD1-CD2 4.06Å; K493-L497 WeakPolarHBondContact O-CB 3.47Å; K493-L497 PolarHBondContact O-N 3.02Å; K493-L497 VanDerWaalsContact O-N 3.15Å; I494-L497 CarbonylContact O-C 3.59Å; I494-L497 PolarHBondContact O-N 2.93Å; I494-L497 VanDerWaalsContact O-N 3.13Å; L497-N501 VanDerWaalsContact CD1-ND2 3.35Å; L497-N501 WeakPolarHBondContact CD1-ND2 3.24Å; L497-N501 WeakPolarHBondContact O-CB 3.36Å; L497-N501 PolarHBondContact O-N 3Å; L497-N501 PolarHBondContact O-ND2 3.14Å
498	K	97.5	Very high	96	Very high	6 Å²	6	71 Å²	71	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-67.4	-45	169.7	-58.9	-74.9	-171.1	-149.3	0	111.1	F341 E347 F358 Y489 I494 T495 Q496 N502	F341-K498 HydrophobicContact CD1-CD 4.46Å; F341-K498 HydrophobicContact CE1-CD 3.52Å; F341-K498 HydrophobicContact CE1-CG 3.86Å; F341-K498 HydrophobicContact CZ-CD 3.71Å; F341-K498 HydrophobicContact CZ-CG 4.19Å; E347-K498 WeakPolarHBondContact O-CE 3.48Å; E347-K498 PolarHBondContact O-NZ 2.92Å; F358-K498 HydrophobicContact CD1-CD 3.84Å; F358-K498 PolarHBondContact O-NZ 3.33Å; Y489-K498 HydrophobicContact CE1-CD 4.27Å; Y489-K498 HydrophobicContact CE1-CG 4Å; Y489-K498 HydrophobicContact CE2-CG 4.32Å; Y489-K498 WeakPolarHBondContact OH-CG 3.24Å; I494-K498 HydrophobicContact CG2-CD 4.45Å; I494-K498 HydrophobicContact CG2-CG 4.07Å; I494-K498 VanDerWaalsContact O-CG 3.25Å; I494-K498 WeakPolarHBondContact O-CG 3.24Å; I494-K498 PolarHBondContact O-N 2.84Å; T495-K498 WeakPolarHBondContact O-CB 3.31Å; T495-K498 PolarHBondContact O-N 3.07Å; Q496-K498 PolarHBondContact O-N 3.11Å; K498-N502 WeakPolarHBondContact O-CB 3.44Å; K498-N502 PolarHBondContact O-N 2.75Å
499	I	96.8	Very high	95.6	Very high	24 Å²	24	72.7 Å²	72.7	12%	0.123	36%	0.361	C	S	.	.	H	α-helix	trans	-60	-49	178.9	-72	165.1	0	0	0	111	T495 Q496 N501 A505 F508 R509	T495-I499 HydrophobicContact CG2-CD1 4.05Å; T495-I499 WeakPolarHBondContact O-CG1 3.38Å; T495-I499 PolarHBondContact O-N 3.06Å; Q496-I499 WeakPolarHBondContact O-CA 3.49Å; Q496-I499 WeakPolarHBondContact O-CB 3.22Å; Q496-I499 PolarHBondContact O-N 3.37Å; I499-N501 PolarHBondContact O-N 3.3Å; I499-A505 HydrophobicContact CG1-CB 4.43Å; I499-F508 HydrophobicContact CD1-CB 4Å; I499-F508 HydrophobicContact CG1-CB 4.02Å; I499-F508 HydrophobicContact CG2-CB 3.92Å; I499-R509 HydrophobicContact CG2-CB 4.34Å; I499-R509 HydrophobicContact CG2-CG 3.56Å; I499-R509 VanDerWaalsContact O-CZ 3.27Å; I499-R509 PolarHBondContact O-NE 3.45Å; I499-R509 PolarHBondContact O-NH2 3.45Å
500	D	96.5	Very high	94.2	Very high	83 Å²	83	75.9 Å²	75.9	44%	0.444	38%	0.383	S	S	.	.	H	α-helix	trans	-67.9	-31.4	-175.8	-63.9	-28	0	0	0	113.9	Q496 R509	Q496-D500 VanDerWaalsContact O-CG 3.3Å; Q496-D500 PolarHBondContact O-N 3.4Å; D500-R509 VanDerWaalsContact C-CZ 3.48Å; D500-R509 VanDerWaalsContact C-NH2 3.27Å; D500-R509 PolarHBondContact O-NH1 3.27Å; D500-R509 PolarHBondContact O-NH2 2.9Å
501	N	96.4	Very high	92.3	Very high	62 Å²	62	77.8 Å²	77.8	33%	0.332	40%	0.399	S	S	.	.	H	α-helix	trans	-106	-26.4	-173.9	-65.9	-91.1	0	0	0	113.4	L337 F358 L497 I499 P503	L337-N501 HydrophobicContact CD1-CB 3.97Å; L337-N501 WeakPolarHBondContact CD1-OD1 3.48Å; L337-N501 HydrophobicContact CD2-CB 4.22Å; F358-N501 HydrophobicContact CE1-CB 3.88Å; F358-N501 HydrophobicContact CZ-CB 3.8Å; F358-N501 WeakPolarHBondContact CZ-O 3.5Å; L497-N501 VanDerWaalsContact CD1-ND2 3.35Å; L497-N501 WeakPolarHBondContact CD1-ND2 3.24Å; L497-N501 WeakPolarHBondContact O-CB 3.36Å; L497-N501 PolarHBondContact O-N 3Å; L497-N501 PolarHBondContact O-ND2 3.14Å; I499-N501 PolarHBondContact O-N 3.3Å; N501-P503 WeakPolarHBondContact O-CD 3.2Å
502	N	96.1	Very high	90.4	Very high	21 Å²	21	80 Å²	80	11%	0.112	43%	0.425	C	S	.	.			trans	-84.3	120.4	-179.6	-171.2	-14.2	0	0	0	111.1	F358 K498 F504 A505 R509	F358-N502 HydrophobicContact CD1-CB 4.05Å; F358-N502 HydrophobicContact CD2-CB 3.84Å; F358-N502 HydrophobicContact CE1-CB 3.95Å; F358-N502 HydrophobicContact CE2-CB 3.74Å; F358-N502 HydrophobicContact CG-CB 4Å; F358-N502 HydrophobicContact CZ-CB 3.81Å; K498-N502 WeakPolarHBondContact O-CB 3.44Å; K498-N502 PolarHBondContact O-N 2.75Å; N502-F504 PolarHBondContact O-N 3.07Å; N502-F504 WeakPolarHBondContact OD1-CB 3.46Å; N502-F504 WeakPolarHBondContact OD1-CD2 3.3Å; N502-F504 PolarHBondContact OD1-N 3.01Å; N502-A505 HydrophobicContact CB-CB 4.07Å; N502-A505 PolarHBondContact O-N 3.05Å; N502-R509 PolarHBondContact O-NH2 2.9Å
503	P	94.8	Very high	88.4	Confident	93 Å²	93	76.4 Å²	76.4	60%	0.604	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-58.3	-35.7	176.7	-25	35.5	0	0	0	113.2	N501 A505 K506	N501-P503 WeakPolarHBondContact O-CD 3.2Å; P503-A505 PolarHBondContact O-N 3.34Å; P503-K506 WeakPolarHBondContact O-CB 3.35Å; P503-K506 PolarHBondContact O-N 2.96Å; P503-K506 VanDerWaalsContact O-N 3.17Å
504	F	93.8	Very high	86.3	Confident	173 Å²	173	72.3 Å²	72.3	76%	0.759	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-71.6	-7.4	178.6	-58.4	-71.1	0	0	0	113.7	N502	N502-F504 PolarHBondContact O-N 3.07Å; N502-F504 WeakPolarHBondContact OD1-CB 3.46Å; N502-F504 WeakPolarHBondContact OD1-CD2 3.3Å; N502-F504 PolarHBondContact OD1-N 3.01Å
505	A	94	Very high	84.2	Confident	15 Å²	15	80.8 Å²	80.8	12%	0.124	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-105.9	5.2	174.5	0	0	0	0	0	113.1	I499 N502 P503 G507 F508	I499-A505 HydrophobicContact CG1-CB 4.43Å; N502-A505 HydrophobicContact CB-CB 4.07Å; N502-A505 PolarHBondContact O-N 3.05Å; P503-A505 PolarHBondContact O-N 3.34Å; A505-G507 PolarHBondContact O-N 3.06Å; A505-G507 VanDerWaalsContact O-N 3.11Å; A505-F508 PolarHBondContact O-N 2.74Å
506	K	91.2	Very high	82.1	Confident	132 Å²	132	89.1 Å²	89.1	57%	0.574	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-51	-40.1	-175.1	-175.1	-179.6	177.2	-176.8	0	113.6	P503 F508 R509	P503-K506 WeakPolarHBondContact O-CB 3.35Å; P503-K506 PolarHBondContact O-N 2.96Å; P503-K506 VanDerWaalsContact O-N 3.17Å; K506-F508 PolarHBondContact O-N 3.39Å; K506-R509 WeakPolarHBondContact O-CB 3.4Å; K506-R509 WeakPolarHBondContact O-CG 3.49Å; K506-R509 PolarHBondContact O-N 3.33Å
507	G	92.6	Very high	80.3	Confident	58 Å²	58	90.8 Å²	90.8	60%	0.598	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-60.9	-16.2	-179.7	0	0	0	0	0	115.5	A505 T511	A505-G507 PolarHBondContact O-N 3.06Å; A505-G507 VanDerWaalsContact O-N 3.11Å; G507-T511 PolarHBondContact O-OG1 3.35Å
508	F	91.4	Very high	78.3	Confident	144 Å²	144	96.4 Å²	96.4	63%	0.632	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-89.6	-15.9	176.9	-63.9	-77.9	0	0	0	113.8	I499 A505 K506	I499-F508 HydrophobicContact CD1-CB 4Å; I499-F508 HydrophobicContact CG1-CB 4.02Å; I499-F508 HydrophobicContact CG2-CB 3.92Å; A505-F508 PolarHBondContact O-N 2.74Å; K506-F508 PolarHBondContact O-N 3.39Å
509	R	90.6	Very high	76.3	Confident	91 Å²	91	101.6 Å²	101.6	34%	0.343	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-62.8	-47.5	-179.6	-63.2	173.7	-165.2	-161.5	2	111.5	I499 D500 N502 K506 T511	I499-R509 HydrophobicContact CG2-CB 4.34Å; I499-R509 HydrophobicContact CG2-CG 3.56Å; I499-R509 VanDerWaalsContact O-CZ 3.27Å; I499-R509 PolarHBondContact O-NE 3.45Å; I499-R509 PolarHBondContact O-NH2 3.45Å; D500-R509 VanDerWaalsContact C-CZ 3.48Å; D500-R509 VanDerWaalsContact C-NH2 3.27Å; D500-R509 PolarHBondContact O-NH1 3.27Å; D500-R509 PolarHBondContact O-NH2 2.9Å; N502-R509 PolarHBondContact O-NH2 2.9Å; K506-R509 WeakPolarHBondContact O-CB 3.4Å; K506-R509 WeakPolarHBondContact O-CG 3.49Å; K506-R509 PolarHBondContact O-N 3.33Å; R509-T511 VanDerWaalsContact C-N 3.29Å; R509-T511 PolarHBondContact O-N 3.07Å
510	D	68.7	Low	74.5	Confident	139 Å²	139	104.2 Å²	104.2	74%	0.743	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-90.2	12.6	-170.8	-50.9	-49.6	0	0	0	113.5
511	T	58.6	Low	72.7	Confident	110 Å²	110	108.2 Å²	108.2	68%	0.675	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-106.3	17.4	176.5	-45.6	0	0	0	0	112.6	G507 R509 A513	G507-T511 PolarHBondContact O-OG1 3.35Å; R509-T511 VanDerWaalsContact C-N 3.29Å; R509-T511 PolarHBondContact O-N 3.07Å; T511-A513 PolarHBondContact O-N 3.33Å
512	G	56.5	Low	71	Confident	60 Å²	60	113.4 Å²	113.4	62%	0.619	59%	0.586	S	S	*	*	S	Bend	trans	-72	114.6	165.3	0	0	0	0	0	111.7	G514	G512-G514 VanDerWaalsContact C-N 3.27Å; G512-G514 PolarHBondContact O-N 3.16Å
513	A	55.5	Low	69.2	Low	81 Å²	81	119.2 Å²	119.2	67%	0.669	61%	0.613	S	S	*	*	S	Bend	trans	56.8	-40.8	167.6	0	0	0	0	0	120.2	T511 K515	T511-A513 PolarHBondContact O-N 3.33Å; A513-K515 PolarHBondContact O-N 3.39Å
514	G	52.5	Low	67.6	Low	51 Å²	51	117.8 Å²	117.8	53%	0.526	61%	0.609	S	S	.	*	S	Bend	trans	-78.7	-16	-151.3	0	0	0	0	0	120.1	G512	G512-G514 VanDerWaalsContact C-N 3.27Å; G512-G514 PolarHBondContact O-N 3.16Å
515	K	53.1	Low	66	Low	179 Å²	179	114.6 Å²	114.6	78%	0.778	60%	0.599	S	S	*	*	S	Bend	trans	-131.3	-29.6	-164.8	-95.6	179.3	177.1	173.4	0	118.4	A513	A513-K515 PolarHBondContact O-N 3.39Å
516	R	53.4	Low	64.5	Low	213 Å²	213	120.7 Å²	120.7	80%	0.804	63%	0.627	S	S	*	*	H	α-helix	trans	-69.5	-39.7	-176.6	-169.2	171	-176.5	152.4	0.8	111.9	K518 N519 C520	R516-K518 VanDerWaalsContact C-N 3.34Å; R516-K518 PolarHBondContact O-N 3.34Å; R516-N519 PolarHBondContact O-N 2.79Å; R516-C520 PolarHBondContact O-N 3.25Å; R516-C520 VanDerWaalsContact O-N 3.14Å
517	E	58.6	Low	62.8	Low	141 Å²	141	118.9 Å²	118.9	66%	0.659	63%	0.631	S	S	*	*	H	α-helix	trans	-57.5	-43.6	178.2	-66	170.8	-172.9	0	0	112.3	N519 C520 Y521	E517-N519 PolarHBondContact O-N 3.32Å; E517-C520 PolarHBondContact O-N 3.39Å; E517-Y521 VanDerWaalsContact O-CB 3.28Å; E517-Y521 WeakPolarHBondContact O-CB 3.36Å; E517-Y521 PolarHBondContact O-N 3.21Å
518	K	55.9	Low	60.8	Low	148 Å²	148	123.2 Å²	123.2	64%	0.643	64%	0.64	S	S	*	*	H	α-helix	trans	-62.1	-30.3	179.7	-71.6	-178.8	176.7	176.3	0	113.1	R516 R522	R516-K518 VanDerWaalsContact C-N 3.34Å; R516-K518 PolarHBondContact O-N 3.34Å; K518-R522 WeakPolarHBondContact O-CB 3.29Å; K518-R522 WeakPolarHBondContact O-CG 3.28Å; K518-R522 PolarHBondContact O-N 3.25Å; K518-R522 VanDerWaalsContact O-N 3.12Å
519	N	55.1	Low	58.9	Low	115 Å²	115	127.8 Å²	127.8	62%	0.615	65%	0.653	S	S	*	*	H	α-helix	trans	-78.9	-42.1	174.2	-76.3	5.9	0	0	0	111.9	R516 E517 Y521 R522 Q523	R516-N519 PolarHBondContact O-N 2.79Å; E517-N519 PolarHBondContact O-N 3.32Å; N519-Y521 VanDerWaalsContact C-N 3.35Å; N519-Y521 PolarHBondContact O-N 3.4Å; N519-R522 PolarHBondContact O-N 3.22Å; N519-Q523 WeakPolarHBondContact O-CB 3.24Å; N519-Q523 PolarHBondContact O-N 3.18Å
520	C	60.1	Low	57.1	Low	79 Å²	79	126.4 Å²	126.4	53%	0.534	67%	0.668	S	S	.	*	H	α-helix	trans	-61.4	-41.8	173.3	-71.7	0	0	0	0	112.2	R516 E517 Q523 A524	R516-C520 PolarHBondContact O-N 3.25Å; R516-C520 VanDerWaalsContact O-N 3.14Å; E517-C520 PolarHBondContact O-N 3.39Å; C520-Q523 PolarHBondContact O-N 3.24Å; C520-A524 WeakPolarHBondContact O-CB 3.46Å; C520-A524 PolarHBondContact O-N 3.18Å
521	Y	57.4	Low	56.3	Low	167 Å²	167	125.8 Å²	125.8	66%	0.655	67%	0.674	S	S	*	*	H	α-helix	trans	-66.9	-42.9	178.5	-165.5	-101	0	0	0	112	E517 N519 Q523 A524 L525	E517-Y521 VanDerWaalsContact O-CB 3.28Å; E517-Y521 WeakPolarHBondContact O-CB 3.36Å; E517-Y521 PolarHBondContact O-N 3.21Å; N519-Y521 VanDerWaalsContact C-N 3.35Å; N519-Y521 PolarHBondContact O-N 3.4Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 3.14Å; Y521-A524 PolarHBondContact O-N 3.48Å; Y521-L525 HydrophobicContact CD1-CD1 3.77Å; Y521-L525 HydrophobicContact CE1-CD1 3.58Å; Y521-L525 HydrophobicContact CE1-CG 4.45Å; Y521-L525 PolarHBondContact O-N 3.26Å
522	R	61.3	Low	55.6	Low	172 Å²	172	128.3 Å²	128.3	65%	0.649	68%	0.684	S	S	*	*	H	α-helix	trans	-61.7	-38.2	171	-80.8	-172.1	66.5	161.9	1.6	112.5	K518 N519 M526	K518-R522 WeakPolarHBondContact O-CB 3.29Å; K518-R522 WeakPolarHBondContact O-CG 3.28Å; K518-R522 PolarHBondContact O-N 3.25Å; K518-R522 VanDerWaalsContact O-N 3.12Å; N519-R522 PolarHBondContact O-N 3.22Å; R522-M526 WeakPolarHBondContact O-CG 3.32Å; R522-M526 PolarHBondContact O-N 3.46Å
523	Q	57.7	Low	54.8	Low	142 Å²	142	130.9 Å²	130.9	66%	0.664	69%	0.692	S	S	*	*	H	α-helix	trans	-71.7	-40.2	-179.6	-165.7	150	15.5	0	0	111.8	N519 C520 Y521 L525 M526 S527	N519-Q523 WeakPolarHBondContact O-CB 3.24Å; N519-Q523 PolarHBondContact O-N 3.18Å; C520-Q523 PolarHBondContact O-N 3.24Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 3.14Å; Q523-L525 PolarHBondContact O-N 3.43Å; Q523-M526 PolarHBondContact O-N 3.48Å; Q523-M526 VanDerWaalsContact O-N 3.14Å; Q523-S527 PolarHBondContact O-N 3.44Å; Q523-S527 VanDerWaalsContact O-N 3.1Å; Q523-S527 PolarHBondContact O-OG 2.92Å
524	A	60.9	Low	54.1	Low	63 Å²	63	134.8 Å²	134.8	52%	0.521	70%	0.702	S	S	.	*	H	α-helix	trans	-59.3	-44.7	172	0	0	0	0	0	112.4	C520 Y521 M526 S527 N528	C520-A524 WeakPolarHBondContact O-CB 3.46Å; C520-A524 PolarHBondContact O-N 3.18Å; Y521-A524 PolarHBondContact O-N 3.48Å; A524-M526 PolarHBondContact O-N 2.99Å; A524-S527 PolarHBondContact O-N 2.9Å; A524-N528 PolarHBondContact O-N 3.49Å
525	L	61.3	Low	53.6	Low	106 Å²	106	142 Å²	142	56%	0.555	72%	0.718	S	S	*	*	H	α-helix	trans	-63.1	-23.2	175.7	-80.7	167.6	0	0	0	114	Y521 Q523	Y521-L525 HydrophobicContact CD1-CD1 3.77Å; Y521-L525 HydrophobicContact CE1-CD1 3.58Å; Y521-L525 HydrophobicContact CE1-CG 4.45Å; Y521-L525 PolarHBondContact O-N 3.26Å; Q523-L525 PolarHBondContact O-N 3.43Å
526	M	61.6	Low	53.1	Low	144 Å²	144	142.1 Å²	142.1	71%	0.709	73%	0.727	S	S	*	*	H	α-helix	trans	-88.4	-26.9	176.9	-70.4	178.3	69.1	0	0	113.1	R522 Q523 A524	R522-M526 WeakPolarHBondContact O-CG 3.32Å; R522-M526 PolarHBondContact O-N 3.46Å; Q523-M526 PolarHBondContact O-N 3.48Å; Q523-M526 VanDerWaalsContact O-N 3.14Å; A524-M526 PolarHBondContact O-N 2.99Å
527	S	55.9	Low	52.1	Low	94 Å²	94	138.8 Å²	138.8	66%	0.657	73%	0.725	S	S	*	*	H	α-helix	trans	-73.1	-26.5	174.8	-68.1	0	0	0	0	113.5	Q523 A524 R529	Q523-S527 PolarHBondContact O-N 3.44Å; Q523-S527 VanDerWaalsContact O-N 3.1Å; Q523-S527 PolarHBondContact O-OG 2.92Å; A524-S527 PolarHBondContact O-N 2.9Å; S527-R529 PolarHBondContact O-N 2.98Å; S527-R529 VanDerWaalsContact O-N 3.1Å
528	N	50.3	Low	51.6	Low	148 Å²	148	137.3 Å²	137.3	79%	0.791	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	29.7	-171.9	-144.2	88.8	0	0	0	114.8	A524	A524-N528 PolarHBondContact O-N 3.49Å
529	R	51.7	Low	50.5	Low	240 Å²	240	136.1 Å²	136.1	91%	0.906	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	13.3	-176.5	-88	-165.5	172.6	-150.8	-1.9	115.2	S527	S527-R529 PolarHBondContact O-N 2.98Å; S527-R529 VanDerWaalsContact O-N 3.1Å
530	G	53.4	Low	49.5	Very low	63 Å²	63	138.9 Å²	138.9	65%	0.649	74%	0.741	S	S	*	*	S	Bend	trans	-148	65.9	-175.7	0	0	0	0	0	114.4
531	S	51.4	Low	48.1	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	75%	0.749	S	S	*	*			trans	-166.2	62.2	168	-75.1	0	0	0	0	112.3
532	D	43.6	Very low	46.8	Very low	164 Å²	164	137.8 Å²	137.8	88%	0.877	75%	0.754	S	S	*	*			trans	-165	99.3	152.9	-140	-18.5	0	0	0	113.2
533	S	39.6	Very low	45.4	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	76%	0.757	S	S	*	*			trans	177.1	66.8	156.7	62.6	0	0	0	0	112.5
534	D	40.5	Very low	44.3	Very low	163 Å²	163	132.5 Å²	132.5	87%	0.872	76%	0.759	S	S	*	*			trans	-133.3	67.7	179.2	-115.1	-34.1	0	0	0	113.4
535	K	43.4	Very low	43.1	Very low	202 Å²	202	140.4 Å²	140.4	88%	0.878	78%	0.776	S	S	*	*			trans	-148.6	103.1	163.4	-71.9	-168.5	-179.6	174.9	0	111.7
536	L	41.4	Very low	41.9	Very low	181 Å²	181	139.4 Å²	139.4	95%	0.948	78%	0.783	S	S	*	*				-175.7	159.2	126.7	-98.4	168.5	0	0	0	111.1
537	N	32.6	Very low	41.1	Very low	143 Å²	143	137.5 Å²	137.5	77%	0.765	78%	0.781	S	S	*	*			trans	-80.7	144.3	-168.5	-161.2	51	0	0	0	112.3
538	P	48.7	Very low	40	Very low	111 Å²	111	140.4 Å²	140.4	72%	0.721	79%	0.788	S	S	*	*			trans	-89.6	141.2	-172.7	34.3	-33.6	0	0	0	113.4
539	T	33.4	Very low	39.3	Very low	122 Å²	122	140.9 Å²	140.9	75%	0.748	79%	0.786	S	S	*	*			trans	-143.1	129.2	167.8	53.4	0	0	0	0	113.4
540	H	33.2	Very low	38.5	Very low	173 Å²	173	136.6 Å²	136.6	80%	0.801	78%	0.78	S	S	*	*			trans	81.5	123.6	145.3	-100	-108.3	0	0	0	122.5
541	V	31.8	Very low	37.3	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.685	78%	0.778	S	S	*	*			trans	49.4	125.7	152.8	-68	0	0	0	0	122.7
542	S	29	Very low	36.6	Very low	111 Å²	111	140 Å²	140	78%	0.776	78%	0.78	S	S	*	*				22	144.7	111.1	-38.2	0	0	0	0	118.6
543	S	33	Very low	36	Very low	101 Å²	101	137 Å²	137	71%	0.706	78%	0.779	S	S	*	*			cis	-171.9	165.1	34.4	-168.8	0	0	0	0	112.6
544	S	34.6	Very low	35.5	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	78%	0.781	S	S	*	*			trans	68.6	145.4	152.7	-67	0	0	0	0	118
545	R	35.7	Very low	35	Very low	229 Å²	229	139.4 Å²	139.4	86%	0.864	78%	0.784	S	S	*	*			cis	-139.1	143.2	-3.9	-95.7	142.4	174.2	179.8	-3.3	106.1
546	A	35.2	Very low	35.2	Very low	85 Å²	85	134.6 Å²	134.6	70%	0.702	77%	0.773	S	S	*	*				73	154.2	51.5	0	0	0	0	0	113.9
547	P	45.9	Very low	35.7	Very low	105 Å²	105	131.2 Å²	131.2	68%	0.682	76%	0.762	S	S	*	*			cis	-139.6	-168.9	-46.9	33.7	-13.4	0	0	0	113.6
548	L	31.6	Very low	35.6	Very low	154 Å²	154	132.3 Å²	132.3	81%	0.806	76%	0.762	S	S	*	*			trans	76.2	164.7	167.7	-41.3	-179	0	0	0	115.6
549	H	34.7	Very low	34.6	Very low	158 Å²	158	133.2 Å²	133.2	73%	0.731	76%	0.76	S	S	*	*			cis	-141.2	168	5	-163.3	78.3	0	0	0	113.3
550	L	35.1	Very low	34.3	Very low	150 Å²	150	135.5 Å²	135.5	79%	0.785	76%	0.762	S	S	*	*			trans	-49.3	145.1	170.7	-162.6	70.7	0	0	0	113.1
551	G	29.7	Very low	35	Very low	59 Å²	59	131.8 Å²	131.8	61%	0.608	75%	0.753	S	S	*	*			trans	-109.3	162.5	175.2	0	0	0	0	0	113.8
552	H	35	Very low	34.8	Very low	200 Å²	200	134.9 Å²	134.9	93%	0.926	76%	0.76	S	S	*	*			trans	-153.5	168.9	163.1	-117.2	61.9	0	0	0	113.4
553	A	32.4	Very low	35	Very low	102 Å²	102	134 Å²	134	84%	0.843	76%	0.76	S	S	*	*			trans	-78.3	159.5	-162.5	0	0	0	0	0	116.6
554	G	28.9	Very low	34.8	Very low	83 Å²	83	133.6 Å²	133.6	86%	0.856	76%	0.762	S	S	*	*			trans	-174	108.8	169.5	0	0	0	0	0	114.6
555	R	30.2	Very low	34.4	Very low	245 Å²	245	136 Å²	136	93%	0.925	77%	0.767	S	S	*	*			trans	-99.1	171.4	163.4	-140.9	-166.7	159.8	-154.1	-3.9	107.1
556	P	47.7	Very low	34.1	Very low	101 Å²	101	132 Å²	132	66%	0.656	76%	0.762	S	S	*	*			cis	-131.2	-142	-0.7	44.4	-23.4	0	0	0	110.7
557	P	50.8	Low	33.8	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	76%	0.761	S	S	*	*			cis	-126	150	-20.6	39.4	-22	0	0	0	113.9
558	H	30.2	Very low	33.1	Very low	165 Å²	165	134.4 Å²	134.4	76%	0.764	76%	0.757	S	S	*	*				83.8	140.1	94.9	-163.7	-131.8	0	0	0	117.4
559	L	27.6	Very low	33.1	Very low	130 Å²	130	133.5 Å²	133.5	68%	0.681	75%	0.749	S	S	*	*			trans	71.7	133.3	176.9	-59.7	163.8	0	0	0	116.7
560	H	28.9	Very low	33	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.787	74%	0.742	S	S	*	*				75.2	147	53.2	-98.1	-142.3	0	0	0	114.6
561	P	47.4	Very low	33	Very low	95 Å²	95	130.2 Å²	130.2	62%	0.617	73%	0.733	S	S	*	*			cis	-142.7	-137.1	-35.6	38.3	-16.3	0	0	0	111.2
562	H	28	Very low	33.5	Very low	179 Å²	179	133.4 Å²	133.4	83%	0.829	74%	0.736	S	S	*	*			trans	78.4	132.9	168.1	-79.7	-74.6	0	0	0	120.3
563	A	33.5	Very low	33.5	Very low	93 Å²	93	130.8 Å²	130.8	77%	0.769	73%	0.729	S	S	*	*			trans	-116.4	146.5	151.2	0	0	0	0	0	108.1
564	A	27.5	Very low	33.8	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	72%	0.723	S	S	*	*			trans	173.8	154.7	136.4	0	0	0	0	0	112.1
565	L	27.4	Very low	34.3	Very low	152 Å²	152	136 Å²	136	80%	0.796	72%	0.715	S	S	*	*			trans	71.6	135.9	162.6	-57.9	-178.6	0	0	0	119.8
566	L	28.8	Very low	34.8	Very low	145 Å²	145	130.7 Å²	130.7	76%	0.759	70%	0.704	S	S	*	*			trans	46.2	137.1	134.1	-53.3	169.7	0	0	0	118.2
567	D	28.8	Very low	34.5	Very low	128 Å²	128	132.8 Å²	132.8	68%	0.684	71%	0.709	S	S	*	*			cis	-164.3	171.1	43.6	-141.5	17.4	0	0	0	108.3
568	N	30.4	Very low	33.8	Very low	111 Å²	111	134.1 Å²	134.1	59%	0.594	71%	0.71	S	S	*	*			cis	-161.7	-168.7	2.6	-156.2	-37.8	0	0	0	108.7
569	Q	32	Very low	34	Very low	136 Å²	136	131.5 Å²	131.5	64%	0.636	71%	0.706	S	S	*	*			trans	102.1	114.1	142.8	-118.2	63.5	75.2	0	0	120.8
570	Q	32.8	Very low	34.1	Very low	129 Å²	129	132 Å²	132	60%	0.603	71%	0.714	S	S	*	*			trans	62.1	146.6	151.7	-59.2	-15	72.2	0	0	121
571	D	35.3	Very low	34.1	Very low	109 Å²	109	127 Å²	127	58%	0.583	71%	0.708	S	S	*	*			cis	-163.4	163.8	-14.7	-104.8	-12.5	0	0	0	112.9
572	D	39.4	Very low	34.3	Very low	126 Å²	126	128.5 Å²	128.5	67%	0.674	72%	0.718	S	S	*	*			trans	61.5	119.9	145.8	-58.1	-10	0	0	0	125.1
573	D	35.1	Very low	35.2	Very low	145 Å²	145	125 Å²	125	78%	0.775	71%	0.712	S	S	*	*				75.4	99.8	123.6	-66.7	0.8	0	0	0	125.9
574	D	38.8	Very low	35	Very low	134 Å²	134	129.2 Å²	129.2	72%	0.717	72%	0.715	S	S	*	*				84.5	125.3	109.8	-125.2	24.9	0	0	0	124.3
575	K	39.3	Very low	35	Very low	160 Å²	160	130 Å²	130	70%	0.696	72%	0.715	S	S	*	*			trans	76.8	111.3	145.1	-75.8	-179.3	176.5	-179.5	0	126.3
576	L	41.3	Very low	35.9	Very low	134 Å²	134	127.8 Å²	127.8	70%	0.702	71%	0.71	S	S	*	*				79.6	115.9	121.1	-62.4	171.4	0	0	0	122.9
577	L	40.5	Very low	35.8	Very low	145 Å²	145	128.7 Å²	128.7	76%	0.759	72%	0.715	S	S	*	*				73.6	97.4	127	-64.2	175.4	0	0	0	122.4
578	D	36.9	Very low	35.9	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	72%	0.722	S	S	*	*				93.9	135.5	98.6	-148.2	30.3	0	0	0	122.7
579	V	33.9	Very low	36.9	Very low	111 Å²	111	130 Å²	130	67%	0.673	73%	0.727	S	S	*	*			trans	73.8	124.5	144.8	135.4	0	0	0	0	123.5
580	V	31.1	Very low	36.8	Very low	141 Å²	141	131 Å²	131	86%	0.855	74%	0.735	S	S	*	*			trans	69	128.7	151.4	171.1	0	0	0	0	121
581	G	28.1	Very low	36.7	Very low	64 Å²	64	129.7 Å²	129.7	66%	0.66	74%	0.74	S	S	*	*			trans	123.6	115.8	135	0	0	0	0	0	118.4
582	P	51.8	Low	36.7	Very low	126 Å²	126	133.1 Å²	133.1	82%	0.818	75%	0.753	S	S	*	*			trans	-81.5	-179.2	150.2	40.6	-36.3	0	0	0	109.3
583	P	46.8	Very low	36.2	Very low	107 Å²	107	132.7 Å²	132.7	70%	0.695	76%	0.759	S	S	*	*			cis	-141.1	-156.4	13.8	33.4	-7.8	0	0	0	114.8
584	Q	29.8	Very low	36.3	Very low	180 Å²	180	132 Å²	132	84%	0.841	76%	0.755	S	S	*	*			trans	107.9	135.1	152.9	-54.2	-170.1	39.4	0	0	119.2
585	S	27.8	Very low	36.3	Very low	109 Å²	109	131.7 Å²	131.7	76%	0.762	75%	0.749	S	S	*	*			trans	-83.3	-169.9	165.2	-31.8	0	0	0	0	109.7
586	P	45	Very low	36.3	Very low	106 Å²	106	131.4 Å²	131.4	69%	0.688	75%	0.751	S	S	*	*			cis	-136.7	-158.7	-3.8	29.9	-4.5	0	0	0	113.9
587	L	27.9	Very low	35.7	Very low	163 Å²	163	131.1 Å²	131.1	85%	0.853	75%	0.747	S	S	*	*			trans	109.6	142.4	152.7	-55.2	-178.4	0	0	0	118.8
588	L	29.9	Very low	35.2	Very low	161 Å²	161	131.9 Å²	131.9	84%	0.843	75%	0.746	S	S	*	*			trans	-115.3	-162.1	179.9	-53	161.1	0	0	0	107
589	P	51.8	Low	35	Very low	106 Å²	106	128.9 Å²	128.9	69%	0.688	74%	0.741	S	S	*	*			cis	-126.3	-146.5	-31.7	21	3.9	0	0	0	110.8
590	L	29.8	Very low	34.9	Very low	157 Å²	157	131.4 Å²	131.4	82%	0.822	75%	0.745	S	S	*	*			trans	88.1	141.4	169.9	-79.3	71.6	0	0	0	116.6
591	S	31.4	Very low	34.9	Very low	101 Å²	101	131 Å²	131	71%	0.706	73%	0.734	S	S	*	*			cis	-159.2	145.4	-9.4	47.2	0	0	0	0	114.8
592	H	34.4	Very low	35	Very low	181 Å²	181	135.8 Å²	135.8	84%	0.838	74%	0.739	S	S	*	*			trans	-1.4	141.7	152.4	-86.5	90.4	0	0	0	121.7
593	S	29.5	Very low	33.8	Very low	117 Å²	117	135.1 Å²	135.1	82%	0.818	74%	0.737	S	S	*	*				169	146.4	122.8	-176.9	0	0	0	0	111.2
594	L	37.2	Very low	33	Very low	130 Å²	130	134.3 Å²	134.3	68%	0.681	74%	0.739	S	S	*	*			cis	-172.8	140.1	-28.4	-173.5	84.3	0	0	0	109
595	Q	38.1	Very low	33	Very low	129 Å²	129	134.2 Å²	134.2	60%	0.603	74%	0.744	S	S	*	*			trans	56.8	170.5	160.3	-100.6	48.8	7.5	0	0	119.2
596	Q	38.3	Very low	33	Very low	154 Å²	154	134 Å²	134	72%	0.72	75%	0.749	S	S	*	*			cis	-145.5	133.8	5.1	-137.5	129.2	27.5	0	0	108.5
597	M	28.7	Very low	32.2	Very low	127 Å²	127	133.3 Å²	133.3	63%	0.626	75%	0.751	S	S	*	*				47.7	142.7	98.6	-54	-158.6	-42.6	0	0	116.7
598	H	31.2	Very low	32.4	Very low	161 Å²	161	136.8 Å²	136.8	75%	0.745	75%	0.753	S	S	*	*			cis	-166.7	158.8	-0.2	-118.4	142.1	0	0	0	111
599	A	32.5	Very low	32.3	Very low	76 Å²	76	138.5 Å²	138.5	63%	0.628	75%	0.754	S	S	*	*			trans	61.7	159.7	154.7	0	0	0	0	0	118.8
600	H	32	Very low	31.2	Very low	164 Å²	164	140.7 Å²	140.7	76%	0.759	76%	0.761	S	S	*	*			cis	-171.1	-177.5	-19.6	-96	-17.4	0	0	0	106.9
601	Q	31.2	Very low	31.1	Very low	133 Å²	133	140 Å²	140	62%	0.621	75%	0.753	S	S	*	*			cis	-162.4	158.5	3.6	-132.5	157.5	-84.7	0	0	110
602	H	31	Very low	30.9	Very low	164 Å²	164	143.6 Å²	143.6	76%	0.759	76%	0.763	S	S	*	*			trans	61.8	160.8	160.9	-60.3	-50.5	0	0	0	119
603	S	26.5	Very low	30.5	Very low	111 Å²	111	139 Å²	139	78%	0.776	76%	0.756	S	S	*	*			cis	-167.3	124	-25.8	172	0	0	0	0	110.2
604	A	29.6	Very low	30.3	Very low	90 Å²	90	137.1 Å²	137.1	74%	0.744	76%	0.756	S	S	*	*			trans	-163.9	153.3	162.4	0	0	0	0	0	112.5
605	L	29.8	Very low	29.7	Very low	179 Å²	179	136.2 Å²	136.2	94%	0.937	77%	0.767	S	S	*	*			trans	62.3	90.3	171.1	-54.5	-175	0	0	0	117.6
606	A	28.1	Very low	29	Very low	105 Å²	105	133.8 Å²	133.8	87%	0.868	78%	0.777	S	S	*	*			trans	-125.4	86	165.6	0	0	0	0	0	111.9
607	A	28.4	Very low	28.4	Very low	90 Å²	90	131.9 Å²	131.9	74%	0.744	79%	0.787	S	S	*	*			trans	-169.4	129.4	163.7	0	0	0	0	0	108.1
608	W	30.5	Very low	28.1	Very low	236 Å²	236	129.3 Å²	129.3	89%	0.894	79%	0.793	S	S	*	*	S	Bend	cis	-128.9	176.3	4.9	-84.3	-27.4	0	0	0	111.8
609	F	28.6	Very low	28	Very low	197 Å²	197	126.3 Å²	126.3	86%	0.864	80%	0.796	S	S	*	*			trans	71.9	77.3	177.7	-72.2	-80.1	0	0	0	116.9
610	N	27.7	Very low	27.7	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	80%	0.798	S	S	*	*			trans	-116.8	163.4	148.2	-86.1	-37.5	0	0	0	108.9
611	H	29.5	Very low	27.5	Very low	143 Å²	143	126.4 Å²	126.4	66%	0.662	80%	0.795	S	S	*	*			cis	-178.2	131.1	-38	-159.1	-87.3	0	0	0	106.3	A613	H611-A613 PolarHBondContact CE1-O 2.94Å
612	L	26.6	Very low	27.2	Very low	175 Å²	175	128.4 Å²	128.4	92%	0.916	80%	0.804	S	S	*	*			trans	-164.1	85.3	150.3	-145.4	67	0	0	0	115.9
613	A	25	Very low	27	Very low	84 Å²	84	125 Å²	125	69%	0.694	80%	0.804	S	S	*	*				-158.7	142.8	128.8	0	0	0	0	0	107.8	H611	H611-A613 PolarHBondContact CE1-O 2.94Å
614	G	25	Very low	26.9	Very low	79 Å²	79	124.6 Å²	124.6	81%	0.814	81%	0.807	S	S	*	*			cis	145.1	53.6	-3.2	0	0	0	0	0	113.4
615	A	25.6	Very low	26.7	Very low	110 Å²	110	124.9 Å²	124.9	91%	0.909	81%	0.809	S	S	*	*			trans	-158.9	149.4	172.6	0	0	0	0	0	111.1
616	G	24	Very low	26.5	Very low	79 Å²	79	121.1 Å²	121.1	81%	0.814	80%	0.804	S	S	*	*			trans	-142.8	167.4	167	0	0	0	0	0	110
617	A	25.9	Very low	26.3	Very low	114 Å²	114	120.9 Å²	120.9	94%	0.942	80%	0.802	S	S	*	*			trans	-161.1	151	171.9	0	0	0	0	0	111.5
618	G	22.5	Very low	26.3	Very low	72 Å²	72	121.4 Å²	121.4	74%	0.742	81%	0.807	S	S	*	*			trans	137.9	73	-175.2	0	0	0	0	0	110
619	A	27.1	Very low	26.2	Very low	98 Å²	98	118 Å²	118	81%	0.81	81%	0.806	S	S	*	*				79.4	127.8	69.3	0	0	0	0	0	112.8
620	S	27.2	Very low	26.2	Very low	97 Å²	97	113.1 Å²	113.1	68%	0.678	80%	0.802	S	S	*	*			cis	-141.7	-115.9	-9.5	29.5	0	0	0	0	111.5
621	E	26.7	Very low	26.2	Very low	146 Å²	146	111.5 Å²	111.5	68%	0.682	80%	0.803	S	S	*	*			cis	-164.6	168.2	-3.3	-165.7	42.2	-95.3	0	0	110.8
622	H	26.7	Very low	26.1	Very low	175 Å²	175	109 Å²	109	81%	0.81	81%	0.806	S	S	*	*			trans	82.1	147.1	163.9	-82.4	-72.3	0	0	0	121.9
623	A	26.2	Very low	26.1	Very low	92 Å²	92	109.4 Å²	109.4	76%	0.76	80%	0.804	S	S	*	*			trans	88.3	78.9	154.5	0	0	0	0	0	120.6
624	A	24.1	Very low	26.1	Very low	103 Å²	103	113 Å²	113	85%	0.851	81%	0.811	S	S	*	*				42.2	148.1	118.6	0	0	0	0	0	123.9
625	A	25.3	Very low	26.3	Very low	95 Å²	95	112.9 Å²	112.9	79%	0.785	80%	0.803	S	S	*	*			trans	85.6	99.1	152.3	0	0	0	0	0	120.8
626	A	24.9	Very low	26.4	Very low	100 Å²	100	113.6 Å²	113.6	83%	0.826	79%	0.79	S	S	*	*				69.8	145.2	128.3	0	0	0	0	0	123.1
627	A	24.9	Very low	26.6	Very low	100 Å²	100	118.9 Å²	118.9	83%	0.826	79%	0.786	S	S	*	*			trans	85.9	140	152.6	0	0	0	0	0	121.5
628	A	28.1	Very low	26.8	Very low	102 Å²	102	123.4 Å²	123.4	84%	0.843	78%	0.779	S	S	*	*			trans	78.1	145.4	151.2	0	0	0	0	0	121.6
629	N	28.5	Very low	27.1	Very low	165 Å²	165	129.7 Å²	129.7	88%	0.882	78%	0.78	S	S	*	*			trans	-84.8	179	178.2	-75	-47.1	0	0	0	112.7
630	A	28.8	Very low	27.2	Very low	94 Å²	94	132.3 Å²	132.3	78%	0.777	78%	0.78	S	S	*	*			trans	82.2	136.8	170.8	0	0	0	0	0	114.8
631	S	26.8	Very low	27.3	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	78%	0.784	S	S	*	*			cis	84.1	137.7	24.9	-161.8	0	0	0	0	114.6
632	A	27.6	Very low	27.5	Very low	89 Å²	89	132.4 Å²	132.4	74%	0.736	78%	0.783	S	S	*	*			trans	64.2	134.9	-160.5	0	0	0	0	0	113.3
633	E	27.1	Very low	27.6	Very low	185 Å²	185	131.5 Å²	131.5	86%	0.864	78%	0.784	S	S	*	*			cis	75.2	111.8	43.4	-72.1	-82.5	118.4	0	0	114.4
634	D	25.6	Very low	27.8	Very low	159 Å²	159	130.9 Å²	130.9	85%	0.85	78%	0.779	S	S	*	*			trans	72	163.2	159.1	-148.8	2.7	0	0	0	119.5
635	A	27.8	Very low	28.2	Very low	77 Å²	77	133.5 Å²	133.5	64%	0.636	78%	0.778	S	S	*	*			trans	76.7	139.1	177	0	0	0	0	0	116.2
636	L	27.8	Very low	28.7	Very low	124 Å²	124	135.9 Å²	135.9	65%	0.649	78%	0.783	S	S	*	*			cis	-162.8	127.6	-0	-150.2	64.3	0	0	0	115.1
637	R	29.4	Very low	29.1	Very low	190 Å²	190	138.3 Å²	138.3	72%	0.717	78%	0.777	S	S	*	*			trans	50.1	139.4	139.7	-70.2	177.8	-176	137.5	0	124.3
638	R	30.1	Very low	29.7	Very low	210 Å²	210	142.7 Å²	142.7	79%	0.792	77%	0.772	S	S	*	*			trans	77.1	155.3	141.5	-74.5	177.2	-60.4	171.7	0.1	118.4
639	R	27.8	Very low	29.8	Very low	203 Å²	203	143.8 Å²	143.8	77%	0.766	76%	0.764	S	S	*	*			cis	-174.5	167.1	-19.9	-174	176.9	-167.1	-175.3	6.9	108.6
640	L	29.6	Very low	30	Very low	154 Å²	154	138.6 Å²	138.6	81%	0.806	75%	0.75	S	S	*	*			trans	94.5	155	167.5	-55	167	0	0	0	115.6
641	Q	29.4	Very low	30.3	Very low	165 Å²	165	139.7 Å²	139.7	77%	0.771	75%	0.751	S	S	*	*				168.5	160.5	-63.4	-179.7	162.7	-5.3	0	0	110.1
642	A	30.6	Very low	30.4	Very low	80 Å²	80	141.3 Å²	141.3	66%	0.661	75%	0.751	S	S	*	*			trans	75.6	151.3	-172.5	0	0	0	0	0	114.7
643	D	28.8	Very low	30.8	Very low	156 Å²	156	141.5 Å²	141.5	83%	0.834	75%	0.747	S	S	*	*			cis	-158.1	139.9	-15.2	-99.1	-16	0	0	0	106.7
644	A	31.7	Very low	31.2	Very low	78 Å²	78	138.1 Å²	138.1	65%	0.645	74%	0.744	S	S	*	*				92.4	93.9	74.5	0	0	0	0	0	116.2
645	D	31.3	Very low	31.5	Very low	158 Å²	158	135.9 Å²	135.9	85%	0.845	74%	0.739	S	S	*	*			trans	67.2	167.3	141.7	-60.7	-45.3	0	0	0	125
646	V	35.8	Very low	31.8	Very low	146 Å²	146	136.7 Å²	136.7	89%	0.885	74%	0.74	S	S	*	*			trans	86.5	136.6	169.8	-179	0	0	0	0	118.1
647	E	33.6	Very low	31.8	Very low	151 Å²	151	138 Å²	138	71%	0.706	74%	0.743	S	S	*	*			cis	-168.4	167.2	-39.5	-150.1	-163.7	-161.1	0	0	109.1
648	R	37.4	Very low	32.1	Very low	191 Å²	191	133.1 Å²	133.1	72%	0.721	74%	0.738	S	S	*	*			trans	68	158.4	158.7	-62	177.3	96.9	107	9.5	118.5
649	D	29.8	Very low	32.3	Very low	125 Å²	125	129.7 Å²	129.7	67%	0.668	74%	0.74	S	S	*	*			cis	-152.6	166.8	-16.9	-107.3	-16.5	0	0	0	105.9
650	G	32.2	Very low	32.5	Very low	56 Å²	56	123.5 Å²	123.5	58%	0.577	74%	0.739	S	S	*	*			cis	151.5	158.6	0.3	0	0	0	0	0	110.7
651	S	36.5	Very low	32.5	Very low	117 Å²	117	119.9 Å²	119.9	82%	0.818	74%	0.739	S	S	*	*			trans	69.5	161.5	162.1	-50	0	0	0	0	117.6
652	D	29.5	Very low	32.8	Very low	153 Å²	153	117.2 Å²	117.2	82%	0.818	74%	0.739	S	S	*	*			cis	-165.4	172.3	-24.5	56.7	-42.5	0	0	0	106.9
653	S	34.9	Very low	33	Very low	94 Å²	94	119.9 Å²	119.9	66%	0.657	75%	0.747	S	S	*	*			cis	-145.7	148.1	13.6	63.7	0	0	0	0	108.6
654	S	35	Very low	33.1	Very low	114 Å²	114	116.4 Å²	116.4	80%	0.797	75%	0.748	S	S	*	*				54.3	134.9	63.7	-160.4	0	0	0	0	113.2
655	C	31.6	Very low	33.1	Very low	112 Å²	112	116.3 Å²	116.3	76%	0.757	76%	0.755	S	S	*	*			cis	-121.2	-172.4	6.2	60.6	0	0	0	0	111.2
656	S	35.9	Very low	33.1	Very low	94 Å²	94	113.2 Å²	113.2	66%	0.657	75%	0.751	S	S	*	*			cis	-143.7	-145.8	5.2	-150.4	0	0	0	0	108.6
657	E	27.9	Very low	32.6	Very low	151 Å²	151	116.3 Å²	116.3	71%	0.706	75%	0.753	S	S	*	*			cis	-155.3	171.2	7.4	-165.5	33	62	0	0	111.5
658	S	34.2	Very low	32.5	Very low	87 Å²	87	120.1 Å²	120.1	61%	0.608	76%	0.761	S	S	*	*			trans	-76.6	174.2	171.1	65.5	0	0	0	0	113.1
659	V	34.5	Very low	32.8	Very low	139 Å²	139	115.7 Å²	115.7	84%	0.842	76%	0.757	S	S	*	*			cis	-138.3	164.6	19.4	-70.8	0	0	0	0	111.4
660	G	32.4	Very low	32.6	Very low	72 Å²	72	115.6 Å²	115.6	74%	0.742	76%	0.761	S	S	*	*			cis	163.4	-26.7	-7.4	0	0	0	0	0	116.3
661	G	28.9	Very low	32.4	Very low	78 Å²	78	117.3 Å²	117.3	80%	0.804	76%	0.764	S	S	*	*			trans	-94.4	107.7	177.4	0	0	0	0	0	111.9
662	S	35.8	Very low	32	Very low	109 Å²	109	118.3 Å²	118.3	76%	0.762	77%	0.766	S	S	*	*				79	128.6	55.6	-158.9	0	0	0	0	111.7
663	T	35.9	Very low	31.9	Very low	136 Å²	136	114.9 Å²	114.9	83%	0.834	77%	0.767	S	S	*	*			cis	-138.6	179.5	35.5	47.6	0	0	0	0	114
664	G	30.6	Very low	31.6	Very low	83 Å²	83	116.1 Å²	116.1	86%	0.856	78%	0.776	S	S	*	*			trans	-86.7	-159.3	-171.9	0	0	0	0	0	117.1
665	G	31.6	Very low	32	Very low	77 Å²	77	116 Å²	116	79%	0.794	77%	0.772	S	S	*	*			cis	169.1	174.7	-4.5	0	0	0	0	0	115
666	A	31.1	Very low	31.7	Very low	93 Å²	93	119.8 Å²	119.8	77%	0.769	78%	0.776	S	S	*	*			trans	75.9	154.3	161	0	0	0	0	0	123.2
667	F	25.9	Very low	31.2	Very low	210 Å²	210	124.4 Å²	124.4	92%	0.921	79%	0.787	S	S	*	*			trans	88.9	147.6	162.4	-76.8	-78.1	0	0	0	124.1
668	R	30.4	Very low	31.4	Very low	231 Å²	231	121.4 Å²	121.4	87%	0.872	79%	0.788	S	S	*	*			trans	-110	-178.1	-178.1	-111.1	-179.9	-178.8	-176.8	0.7	107.9
669	P	43.9	Very low	31.1	Very low	98 Å²	98	124 Å²	124	64%	0.636	80%	0.8	S	S	*	*			cis	-138.3	-169.5	-4.3	29.9	-5.3	0	0	0	115.2
670	T	26.9	Very low	30.8	Very low	124 Å²	124	120.6 Å²	120.6	76%	0.761	79%	0.792	S	S	*	*			trans	65.9	147	144.4	42.9	0	0	0	0	121.5
671	S	28	Very low	30.6	Very low	91 Å²	91	122.2 Å²	122.2	64%	0.636	80%	0.799	S	S	*	*			cis	-175.5	156.7	-24	46.7	0	0	0	0	111.8
672	T	28.2	Very low	30.6	Very low	138 Å²	138	123 Å²	123	85%	0.847	80%	0.797	S	S	*	*			trans	42.3	123.8	146.1	55.7	0	0	0	0	121
673	G	26.2	Very low	30.2	Very low	82 Å²	82	122.3 Å²	122.3	85%	0.845	80%	0.799	S	S	*	*			trans	-175.6	65.4	169.9	0	0	0	0	0	118.6
674	S	28.6	Very low	29.9	Very low	120 Å²	120	120.6 Å²	120.6	84%	0.839	80%	0.798	S	S	*	*			trans	-141.8	150.2	159.1	-79.9	0	0	0	0	108.6
675	P	44.4	Very low	29.9	Very low	112 Å²	112	121 Å²	121	73%	0.727	79%	0.794	S	S	*	*			cis	-129.4	-161.5	-13.1	37.8	-18.2	0	0	0	112.2
676	K	25.7	Very low	29.8	Very low	190 Å²	190	122.1 Å²	122.1	83%	0.826	80%	0.795	S	S	*	*			trans	70.1	124.1	166.8	-64.6	176.4	175.1	-177.8	0	118.5
677	E	24.2	Very low	29.8	Very low	192 Å²	192	122.4 Å²	122.4	90%	0.897	80%	0.798	S	S	*	*				-111.3	145.2	123.1	-79.4	-165.3	105.4	0	0	109.3
678	A	31.5	Very low	30	Very low	87 Å²	87	117.2 Å²	117.2	72%	0.719	79%	0.794	S	S	*	*			trans	-161.8	87	174.8	0	0	0	0	0	110.4
679	V	28.5	Very low	29.8	Very low	143 Å²	143	109.6 Å²	109.6	87%	0.867	79%	0.787	S	S	*	*			trans	-157.6	144.8	174.4	-115.4	0	0	0	0	108.4
680	G	27.7	Very low	29.1	Very low	66 Å²	66	113.5 Å²	113.5	68%	0.68	80%	0.802	S	S	*	*			cis	-114.2	172.9	-14.5	0	0	0	0	0	111.1
681	A	28.5	Very low	29.4	Very low	107 Å²	107	114.9 Å²	114.9	88%	0.884	80%	0.804	S	S	*	*				63.4	136.6	54	0	0	0	0	0	112.7
682	A	29.3	Very low	30	Very low	93 Å²	93	116.3 Å²	116.3	77%	0.769	81%	0.811	S	S	*	*			cis	-142.9	150	9.7	0	0	0	0	0	110.2
683	A	28.2	Very low	30.1	Very low	96 Å²	96	113 Å²	113	79%	0.793	81%	0.805	S	S	*	*				69.6	115.5	81.3	0	0	0	0	0	117.2
684	A	28.7	Very low	30.3	Very low	99 Å²	99	113.3 Å²	113.3	82%	0.818	81%	0.808	S	S	*	*			trans	47	147.4	135.6	0	0	0	0	0	124.2
685	A	30.3	Very low	30.4	Very low	93 Å²	93	111 Å²	111	77%	0.769	80%	0.802	S	S	*	*			trans	68.1	126	158.3	0	0	0	0	0	117.1
686	A	29.8	Very low	29.7	Very low	100 Å²	100	111.8 Å²	111.8	83%	0.826	81%	0.811	S	S	*	*				72.6	139.4	59.9	0	0	0	0	0	113.1
687	A	31.7	Very low	30.1	Very low	99 Å²	99	113.3 Å²	113.3	82%	0.818	81%	0.813	S	S	*	*			cis	-162.2	-164.2	-14.1	0	0	0	0	0	107.2
688	A	29.7	Very low	31	Very low	101 Å²	101	109.9 Å²	109.9	84%	0.835	81%	0.808	S	S	*	*			cis	-161.2	170.5	7.2	0	0	0	0	0	111.2
689	G	25.6	Very low	31.4	Very low	71 Å²	71	110.5 Å²	110.5	73%	0.732	81%	0.806	S	S	*	*			trans	96.7	160.1	164	0	0	0	0	0	115.9
690	L	29.2	Very low	32.3	Very low	180 Å²	180	108.9 Å²	108.9	94%	0.942	80%	0.799	S	S	*	*			cis	-142	161.1	-3.5	-80.7	172.9	0	0	0	110.9
691	N	32.5	Very low	32.4	Very low	152 Å²	152	112.3 Å²	112.3	81%	0.813	80%	0.802	S	S	*	*			trans	-78.9	174.4	167.3	-129.8	1.4	0	0	0	109.7
692	P	42.6	Very low	33.2	Very low	121 Å²	121	114.2 Å²	114.2	79%	0.786	80%	0.796	S	S	*	*			cis	-144.7	171.2	24.8	42.5	-22.9	0	0	0	119.1
693	G	29.7	Very low	33.4	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	80%	0.8	S	S	*	*				122.4	103.8	129.3	0	0	0	0	0	120.2
694	G	30.6	Very low	34	Very low	87 Å²	87	117.2 Å²	117.2	90%	0.897	80%	0.799	S	S	*	*			trans	76.2	154.5	161.7	0	0	0	0	0	116.6
695	G	30	Very low	34.3	Very low	71 Å²	71	115.8 Å²	115.8	73%	0.732	79%	0.794	S	S	*	*			cis	176.5	153.2	-8	0	0	0	0	0	111.9
696	S	29.6	Very low	35	Very low	130 Å²	130	117.1 Å²	117.1	91%	0.909	80%	0.795	S	S	*	*			trans	82	142	175.2	-55	0	0	0	0	119.8
697	Y	34.1	Very low	35.6	Very low	222 Å²	222	118.4 Å²	118.4	87%	0.871	80%	0.795	S	S	*	*			trans	-120.1	177.8	169.6	-101.7	-103.7	0	0	0	107.2
698	P	44.1	Very low	36	Very low	120 Å²	120	121.8 Å²	121.8	78%	0.779	80%	0.797	S	S	*	*			cis	-134.4	-170.4	10.5	37.4	-15.6	0	0	0	116.3
699	S	39.9	Very low	36.4	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	80%	0.796	S	S	*	*			trans	-84	-167.7	172.8	-36.7	0	0	0	0	112
700	P	46.3	Very low	37.3	Very low	110 Å²	110	127.2 Å²	127.2	71%	0.714	80%	0.796	S	S	*	*			cis	-140	165	-1.8	42.1	-24.3	0	0	0	117.9
701	N	31	Very low	37.7	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	79%	0.787	S	S	*	*			trans	175.7	129.7	139.8	-100.2	-72.6	0	0	0	106.2
702	I	43.9	Very low	38.3	Very low	147 Å²	147	122.4 Å²	122.4	75%	0.754	79%	0.786	S	S	*	*				53.5	101.9	67.4	-48.3	173	0	0	0	112.4
703	S	34.4	Very low	38	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	79%	0.791	S	S	*	*			trans	-143.3	125.2	156	-173	0	0	0	0	108.6
704	V	39.5	Very low	38.2	Very low	130 Å²	130	130.5 Å²	130.5	79%	0.788	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-86.9	134.8	177.5	-77.2	0	0	0	0	109.9
705	G	35.1	Very low	38.6	Very low	69 Å²	69	134.4 Å²	134.4	71%	0.711	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71	141.9	175.6	0	0	0	0	0	112
706	P	44.9	Very low	39.1	Very low	121 Å²	121	136.3 Å²	136.3	79%	0.786	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.6	156.8	176.6	28.9	-34.5	0	0	0	112.6
707	P	42.3	Very low	39.3	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.6	149.4	-168.5	31.4	-36.5	0	0	0	114.3
708	I	41.4	Very low	39.2	Very low	170 Å²	170	137.9 Å²	137.9	87%	0.872	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-91.1	132.4	175.9	-56.4	172.5	0	0	0	109.6
709	H	36.7	Very low	38.8	Very low	173 Å²	173	142.9 Å²	142.9	80%	0.801	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-101.7	137.9	-177.8	-135.2	-85	0	0	0	111.5
710	P	46.3	Very low	38.8	Very low	113 Å²	113	143.5 Å²	143.5	73%	0.734	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.7	152.9	175.7	32.1	-34.8	0	0	0	113.1
711	S	37.5	Very low	38.1	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.6	153.4	-175.1	-52.3	0	0	0	0	114.5
712	P	44.5	Very low	38.5	Very low	125 Å²	125	144.4 Å²	144.4	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.7	160.8	-176.8	32.8	-36.6	0	0	0	114.5
713	H	35.3	Very low	37.8	Very low	191 Å²	191	145 Å²	145	88%	0.884	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.2	151.9	-177.1	-60	-80.8	0	0	0	114.1
714	L	35.4	Very low	37.7	Very low	170 Å²	170	149.8 Å²	149.8	89%	0.89	82%	0.815	S	S	*	*			trans	-116.1	131.1	163.8	-73.4	171.3	0	0	0	110.2
715	L	38.3	Very low	37.5	Very low	168 Å²	168	148.4 Å²	148.4	88%	0.88	81%	0.808	S	S	*	*			trans	-143.4	154.5	164	-81.1	-177.3	0	0	0	110
716	P	40.6	Very low	37.5	Very low	111 Å²	111	150.7 Å²	150.7	72%	0.721	81%	0.811	S	S	*	*			trans	-90.6	158.3	-161.6	35.2	-37	0	0	0	115.1
717	Y	34.1	Very low	37.3	Very low	232 Å²	232	150.4 Å²	150.4	91%	0.91	81%	0.809	S	S	*	*			trans	-78.1	140.6	172.2	-71.8	-93	0	0	0	112.9
718	L	31.4	Very low	36.8	Very low	153 Å²	153	152.6 Å²	152.6	80%	0.801	81%	0.808	S	S	*	*			trans	-154.8	116.6	160.1	-102.7	123.3	0	0	0	109.3
719	Y	35.6	Very low	36.5	Very low	225 Å²	225	152.1 Å²	152.1	88%	0.882	81%	0.806	S	S	*	*			trans	-179.2	171.9	140.2	-100.4	-52.5	0	0	0	110.2
720	P	41.3	Very low	36.1	Very low	112 Å²	112	147.1 Å²	147.1	73%	0.727	80%	0.802	S	S	*	*			trans	-111.6	165.6	-130.1	41.1	-30.2	0	0	0	115.3
721	H	30.5	Very low	35.4	Very low	198 Å²	198	149.1 Å²	149.1	92%	0.917	81%	0.806	S	S	*	*			trans	-87.6	147.2	165.8	-63.9	-80.8	0	0	0	111.4
722	G	39.4	Very low	35	Very low	70 Å²	70	152.1 Å²	152.1	72%	0.722	81%	0.812	S	S	*	*			trans	153.7	36.2	162	0	0	0	0	0	120.3
723	L	30	Very low	34.4	Very low	159 Å²	159	154.8 Å²	154.8	83%	0.832	81%	0.814	S	S	*	*	S	Bend	trans	-142.5	121.1	163.7	-77.1	-178	0	0	0	113.5
724	Y	31.1	Very low	34.2	Very low	222 Å²	222	153 Å²	153	87%	0.871	81%	0.811	S	S	*	*			trans	73.6	155.8	159.5	-81.6	-102.6	0	0	0	120.1
725	P	36.8	Very low	34.3	Very low	101 Å²	101	150.4 Å²	150.4	66%	0.656	80%	0.804	S	S	*	*			trans	-113.1	169.3	-147.1	42.4	-36.7	0	0	0	116.1
726	P	34.9	Very low	33.9	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	80%	0.801	S	S	*	*			trans	-83.6	147.1	171	34.3	-34.8	0	0	0	113.4
727	P	38.9	Very low	33.6	Very low	116 Å²	116	146.9 Å²	146.9	75%	0.753	81%	0.808	S	S	*	*			trans	-82.4	177.4	167.9	35.1	-34.8	0	0	0	112.9
728	H	33	Very low	33.5	Very low	171 Å²	171	141 Å²	141	79%	0.792	81%	0.808	S	S	*	*			trans	-107.5	130	-154.5	22.6	-98.1	0	0	0	114.9
729	L	34.9	Very low	33.7	Very low	160 Å²	160	138.9 Å²	138.9	84%	0.838	81%	0.812	S	S	*	*				60.8	119.5	122.8	-146.8	162.3	0	0	0	120.2	L731	L729-L731 HydrophobicContact CD2-CG 4.33Å
730	G	27.6	Very low	33.6	Very low	69 Å²	69	132.3 Å²	132.3	71%	0.711	81%	0.805	S	S	*	*			trans	-164.2	92.7	159	0	0	0	0	0	110.4
731	L	31.6	Very low	33.1	Very low	155 Å²	155	136.3 Å²	136.3	81%	0.812	82%	0.816	S	S	*	*				73.8	95.3	95.5	-83.8	168.1	0	0	0	115.4	L729	L729-L731 HydrophobicContact CD2-CG 4.33Å
732	L	29.1	Very low	33.1	Very low	170 Å²	170	132.1 Å²	132.1	89%	0.89	81%	0.809	S	S	*	*				-172.3	145.1	115.6	-101.5	163.2	0	0	0	112.1
733	H	32.1	Very low	33.1	Very low	181 Å²	181	135.2 Å²	135.2	84%	0.838	82%	0.816	S	S	*	*			trans	-112.9	137.3	167.5	-85	78.9	0	0	0	108.8
734	N	31.9	Very low	33.3	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	82%	0.818	S	S	*	*				-164.5	138.4	124.7	-144.4	21.9	0	0	0	111.1
735	P	37.5	Very low	34	Very low	115 Å²	115	125.6 Å²	125.6	75%	0.747	81%	0.813	S	S	*	*			trans	-97.3	112.3	-179	34.2	-27.8	0	0	0	112.3
736	A	30.4	Very low	34.4	Very low	99 Å²	99	129 Å²	129	82%	0.818	83%	0.825	S	S	*	*			trans	-147.2	30.8	178.5	0	0	0	0	0	114.3
737	A	34.3	Very low	35.1	Very low	106 Å²	106	128.8 Å²	128.8	88%	0.876	82%	0.817	S	S	*	*	S	Bend	trans	-143.4	20.2	-177.3	0	0	0	0	0	114.5
738	A	31.9	Very low	35.5	Very low	108 Å²	108	128.3 Å²	128.3	89%	0.893	81%	0.814	S	S	*	*			trans	-132.5	42	-173	0	0	0	0	0	112.9
739	A	34.1	Very low	36.6	Very low	108 Å²	108	122 Å²	122	89%	0.893	80%	0.795	S	S	*	*			trans	-141.2	39	177	0	0	0	0	0	111.9
740	A	33.6	Very low	37.6	Very low	88 Å²	88	120.1 Å²	120.1	73%	0.727	79%	0.785	S	S	*	*	S	Bend	trans	-139.9	119.9	176.7	0	0	0	0	0	111.2
741	M	32.4	Very low	39	Very low	195 Å²	195	122.6 Å²	122.6	96%	0.961	78%	0.781	S	S	*	*			trans	70.5	140.7	168.2	-58.5	-176	172.5	0	0	117.9
742	S	30.7	Very low	39.9	Very low	111 Å²	111	121.8 Å²	121.8	78%	0.776	77%	0.772	S	S	*	*			trans	-91	154.9	-166.9	-55.4	0	0	0	0	113.4	A744	S742-A744 PolarHBondContact O-N 3.02Å
743	P	37.7	Very low	40.6	Very low	134 Å²	134	118.5 Å²	118.5	87%	0.87	76%	0.755	S	S	*	*			trans	-72.5	126.6	170.8	30.3	-33.9	0	0	0	111.2
744	A	35.1	Very low	41.5	Very low	105 Å²	105	112.6 Å²	112.6	87%	0.868	74%	0.738	S	S	*	*			trans	-113	111.6	170.2	0	0	0	0	0	110.3	S742	S742-A744 PolarHBondContact O-N 3.02Å
745	G	45.4	Very low	42.5	Very low	75 Å²	75	111.3 Å²	111.3	77%	0.773	73%	0.727	S	S	*	*			trans	81.7	67.4	159.3	0	0	0	0	0	118.3
746	L	45.6	Very low	43.7	Very low	172 Å²	172	110.8 Å²	110.8	90%	0.901	72%	0.717	S	S	*	*			trans	-130.4	143.7	151.7	-74.5	178.6	0	0	0	110.6
747	N	49.2	Very low	44.6	Very low	112 Å²	112	108.9 Å²	108.9	60%	0.599	70%	0.701	S	S	*	*			trans	-91.4	128.1	-166.7	-174.7	-37.3	0	0	0	112	G749 L750	N747-G749 PolarHBondContact O-N 3.39Å; N747-G749 VanDerWaalsContact O-N 3.15Å; N747-G749 PolarHBondContact OD1-N 3.5Å; N747-L750 PolarHBondContact O-N 3.01Å
748	P	46.9	Very low	45.6	Very low	106 Å²	106	109 Å²	109	69%	0.688	69%	0.686	S	S	*	*	H	α-helix	trans	-62.6	-21.6	-176.4	25.1	-35.3	0	0	0	114.8	L750 L751	P748-L750 PolarHBondContact O-N 3.32Å; P748-L751 PolarHBondContact O-N 3.44Å
749	G	56.9	Low	46.4	Very low	38 Å²	38	106.6 Å²	106.6	39%	0.392	67%	0.667	S	S	.	*	H	α-helix	trans	-62	-27.6	177.7	0	0	0	0	0	114.1	N747 N753	N747-G749 PolarHBondContact O-N 3.39Å; N747-G749 VanDerWaalsContact O-N 3.15Å; N747-G749 PolarHBondContact OD1-N 3.5Å; G749-N753 PolarHBondContact O-N 3.45Å
750	L	55	Low	47	Very low	122 Å²	122	105.4 Å²	105.4	64%	0.639	66%	0.657	S	S	*	*	H	α-helix	trans	-72.4	-33.3	178	-66.6	175.2	0	0	0	112.3	N747 P748 A754	N747-L750 PolarHBondContact O-N 3.01Å; P748-L750 PolarHBondContact O-N 3.32Å; L750-A754 VanDerWaalsContact O-CB 3.24Å; L750-A754 WeakPolarHBondContact O-CB 3.49Å; L750-A754 PolarHBondContact O-N 3.46Å
751	L	57.8	Low	47.6	Very low	120 Å²	120	108.2 Å²	108.2	63%	0.628	66%	0.655	S	S	*	*	H	α-helix	trans	-68.5	-41.3	178.9	-110.4	162.6	0	0	0	111.8	P748 A754 Q755	P748-L751 PolarHBondContact O-N 3.44Å; L751-A754 PolarHBondContact O-N 3.47Å; L751-Q755 WeakPolarHBondContact O-CG 3.33Å; L751-Q755 PolarHBondContact O-N 3.12Å
752	F	50.2	Low	48.4	Very low	139 Å²	139	104.3 Å²	104.3	61%	0.61	63%	0.634	S	S	*	*	H	α-helix	trans	-66.2	-45.3	176.6	-173.1	-102.5	0	0	0	112	A754 Q755 L756	F752-A754 PolarHBondContact O-N 2.9Å; F752-Q755 PolarHBondContact O-N 3.07Å; F752-L756 WeakPolarHBondContact O-CB 3.46Å; F752-L756 PolarHBondContact O-N 3.48Å
753	N	44.1	Very low	49	Very low	100 Å²	100	105.2 Å²	105.2	54%	0.535	64%	0.638	S	S	.	*	H	α-helix	trans	-66	-35.8	176	-79.4	-18.5	0	0	0	112.6	G749 L756 A757	G749-N753 PolarHBondContact O-N 3.45Å; N753-L756 PolarHBondContact O-N 2.93Å; N753-A757 VanDerWaalsContact O-CB 3.29Å; N753-A757 WeakPolarHBondContact O-CB 3.32Å; N753-A757 PolarHBondContact O-N 3.27Å
754	A	51.2	Low	49.3	Very low	58 Å²	58	103.2 Å²	103.2	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-64.6	-43.2	173.7	0	0	0	0	0	112.1	L750 L751 F752 A757 L758	L750-A754 VanDerWaalsContact O-CB 3.24Å; L750-A754 WeakPolarHBondContact O-CB 3.49Å; L750-A754 PolarHBondContact O-N 3.46Å; L751-A754 PolarHBondContact O-N 3.47Å; F752-A754 PolarHBondContact O-N 2.9Å; A754-A757 PolarHBondContact O-N 3.15Å; A754-L758 VanDerWaalsContact O-CB 3.32Å; A754-L758 WeakPolarHBondContact O-CB 3.37Å; A754-L758 PolarHBondContact O-N 3.33Å
755	Q	52.4	Low	50.1	Low	127 Å²	127	105 Å²	105	59%	0.593	63%	0.627	S	S	*	*	H	α-helix	trans	-65.9	-38.7	175.2	-74.7	-177.1	-47.5	0	0	112.4	L751 F752 L758 A759	L751-Q755 WeakPolarHBondContact O-CG 3.33Å; L751-Q755 PolarHBondContact O-N 3.12Å; F752-Q755 PolarHBondContact O-N 3.07Å; Q755-L758 PolarHBondContact O-N 3.48Å; Q755-A759 WeakPolarHBondContact O-CB 3.35Å; Q755-A759 PolarHBondContact O-N 3.25Å
756	L	62.8	Low	50	Low	104 Å²	104	111 Å²	111	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-67.6	-41.3	176.8	-172.5	61.9	0	0	0	112.1	F752 N753 A759 A760	F752-L756 WeakPolarHBondContact O-CB 3.46Å; F752-L756 PolarHBondContact O-N 3.48Å; N753-L756 PolarHBondContact O-N 2.93Å; L756-A759 PolarHBondContact O-N 3Å; L756-A760 WeakPolarHBondContact O-CB 3.42Å; L756-A760 PolarHBondContact O-N 3.25Å
757	A	48.6	Very low	49.8	Very low	58 Å²	58	105.1 Å²	105.1	48%	0.479	61%	0.613	S	S	.	*	H	α-helix	trans	-64.6	-40	174.8	0	0	0	0	0	112.4	N753 A754 A760	N753-A757 VanDerWaalsContact O-CB 3.29Å; N753-A757 WeakPolarHBondContact O-CB 3.32Å; N753-A757 PolarHBondContact O-N 3.27Å; A754-A757 PolarHBondContact O-N 3.15Å; A757-A760 PolarHBondContact O-N 2.92Å
758	L	56.4	Low	49.3	Very low	108 Å²	108	109.5 Å²	109.5	57%	0.565	63%	0.629	S	S	*	*	H	α-helix	trans	-68.8	-39.1	177.1	-169.1	66.2	0	0	0	111.9	A754 Q755 A760 Q761	A754-L758 VanDerWaalsContact O-CB 3.32Å; A754-L758 WeakPolarHBondContact O-CB 3.37Å; A754-L758 PolarHBondContact O-N 3.33Å; Q755-L758 PolarHBondContact O-N 3.48Å; L758-A760 VanDerWaalsContact C-N 3.33Å; L758-A760 PolarHBondContact O-N 3.25Å; L758-Q761 PolarHBondContact O-N 3.46Å
759	A	49.3	Very low	48.6	Very low	59 Å²	59	108.5 Å²	108.5	49%	0.488	63%	0.63	S	S	.	*	H	α-helix	trans	-64.6	-36.2	174.2	0	0	0	0	0	112.5	Q755 L756 Q761 H762	Q755-A759 WeakPolarHBondContact O-CB 3.35Å; Q755-A759 PolarHBondContact O-N 3.25Å; L756-A759 PolarHBondContact O-N 3Å; A759-Q761 PolarHBondContact O-N 3.1Å; A759-H762 PolarHBondContact O-N 3.4Å
760	A	46.2	Very low	47.7	Very low	83 Å²	83	117.9 Å²	117.9	69%	0.686	66%	0.655	S	S	*	*	H	α-helix	trans	-65.6	-19.4	177.7	0	0	0	0	0	114	L756 A757 L758	L756-A760 WeakPolarHBondContact O-CB 3.42Å; L756-A760 PolarHBondContact O-N 3.25Å; A757-A760 PolarHBondContact O-N 2.92Å; L758-A760 VanDerWaalsContact C-N 3.33Å; L758-A760 PolarHBondContact O-N 3.25Å
761	Q	46.7	Very low	46.7	Very low	146 Å²	146	117.1 Å²	117.1	68%	0.682	67%	0.667	S	S	*	*	H	α-helix	trans	-94.3	-13.4	-179.5	-68.6	-174.2	-19.6	0	0	114.3	L758 A759	L758-Q761 PolarHBondContact O-N 3.46Å; A759-Q761 PolarHBondContact O-N 3.1Å
762	H	47.6	Very low	45.6	Very low	114 Å²	114	115.9 Å²	115.9	53%	0.528	67%	0.674	S	S	.	*			trans	-138.7	76.5	-177.3	-69.5	-74.3	0	0	0	114	A759 A764	A759-H762 PolarHBondContact O-N 3.4Å; H762-A764 PolarHBondContact O-N 3.14Å
763	P	43.4	Very low	44.8	Very low	130 Å²	130	114.3 Å²	114.3	84%	0.844	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	10.3	179.1	31.5	-36.9	0	0	0	115
764	A	45.2	Very low	44	Very low	92 Å²	92	113 Å²	113	76%	0.76	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.2	43.7	-171	0	0	0	0	0	114.2	H762	H762-A764 PolarHBondContact O-N 3.14Å
765	L	50.2	Low	43.1	Very low	142 Å²	142	119.5 Å²	119.5	74%	0.743	72%	0.716	S	S	*	*	S	Bend	trans	-148.9	0.1	168.5	-113.4	170.2	0	0	0	116.4	G767	L765-G767 PolarHBondContact O-N 3.23Å
766	F	44.7	Very low	42.3	Very low	201 Å²	201	119.5 Å²	119.5	88%	0.882	73%	0.725	S	S	*	*			trans	-95.3	70.8	175	-91.8	-81.6	0	0	0	112.7
767	G	40.6	Very low	41.2	Very low	49 Å²	49	120.2 Å²	120.2	51%	0.505	74%	0.736	S	S	.	*	S	Bend	trans	-153.9	143.5	167.4	0	0	0	0	0	109.4	L765	L765-G767 PolarHBondContact O-N 3.23Å
768	H	38.3	Very low	40.3	Very low	204 Å²	204	124 Å²	124	94%	0.944	75%	0.753	S	S	*	*	S	Bend	trans	70.3	52.7	-177.8	-44.6	-74.2	0	0	0	116.8
769	A	33.4	Very low	39.2	Very low	84 Å²	84	123.4 Å²	123.4	69%	0.694	76%	0.757	S	S	*	*			trans	-139.5	17	169.8	0	0	0	0	0	115.9
770	Y	37.3	Very low	38.7	Very low	235 Å²	235	126.7 Å²	126.7	92%	0.922	77%	0.774	S	S	*	*	S	Bend	trans	-137.5	65.7	176.3	-87.6	-78.3	0	0	0	111.5
771	A	34	Very low	38.2	Very low	107 Å²	107	130.1 Å²	130.1	88%	0.884	78%	0.78	S	S	*	*	S	Bend	trans	-149.6	31.6	-179.9	0	0	0	0	0	113.6
772	A	35.7	Very low	37.6	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	79%	0.791	S	S	*	*	S	Bend	trans	-149.4	149.2	172.4	0	0	0	0	0	110
773	A	32.4	Very low	36.7	Very low	106 Å²	106	130.4 Å²	130.4	88%	0.876	80%	0.799	S	S	*	*			trans	55.2	89.8	-177.8	0	0	0	0	0	115.3
774	G	28.1	Very low	36.2	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	80%	0.797	S	S	*	*			trans	-102.6	130.3	169.1	0	0	0	0	0	112.2
775	H	31.8	Very low	35.5	Very low	195 Å²	195	135.8 Å²	135.8	90%	0.903	80%	0.799	S	S	*	*			trans	-144.9	137.2	164	-87.2	-78.8	0	0	0	110.2
776	T	35.3	Very low	34.7	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	79%	0.794	S	S	*	*			trans	-119.9	153	168.3	56.1	0	0	0	0	108.8
777	P	39.8	Very low	34.3	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	79%	0.79	S	S	*	*				-146.3	134.1	110.1	34.2	-16.4	0	0	0	114
778	V	29.4	Very low	33.8	Very low	139 Å²	139	140.2 Å²	140.2	84%	0.842	81%	0.806	S	S	*	*				93.2	139.2	86.5	172.8	0	0	0	0	114.3
779	S	34.7	Very low	33.4	Very low	94 Å²	94	139.2 Å²	139.2	66%	0.657	80%	0.799	S	S	*	*			trans	-86.4	-170.1	-173	-30.3	0	0	0	0	114.5
780	P	38.1	Very low	33.1	Very low	129 Å²	129	140.4 Å²	140.4	84%	0.838	80%	0.802	S	S	*	*			trans	-115.3	162.6	132.9	35	-32.2	0	0	0	113.8
781	L	34.8	Very low	34.2	Very low	154 Å²	154	133.3 Å²	133.3	81%	0.806	79%	0.785	S	S	*	*			trans	-112.5	162	-177.5	-107.8	76.6	0	0	0	112
782	Q	34.2	Very low	33.9	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	78%	0.778	S	S	*	*				159.3	146	123.2	-86.2	179.2	24.5	0	0	109.8
783	G	29.3	Very low	33.5	Very low	67 Å²	67	137.3 Å²	137.3	69%	0.691	77%	0.773	S	S	*	*			cis	-151.3	-171.4	-9.6	0	0	0	0	0	108.3
784	L	31.9	Very low	33.7	Very low	153 Å²	153	139 Å²	139	80%	0.801	77%	0.767	S	S	*	*			cis	-158.9	148.8	22.5	-84	168	0	0	0	111.3
785	K	30.9	Very low	34.1	Very low	183 Å²	183	141.8 Å²	141.8	80%	0.796	77%	0.772	S	S	*	*			trans	63.3	147.7	152.7	-64	170.1	179.8	177.9	0	120
786	S	33.4	Very low	33.9	Very low	92 Å²	92	135.9 Å²	135.9	64%	0.643	76%	0.764	S	S	*	*			cis	-168	125.9	-24	-97.2	0	0	0	0	111.7
787	H	37.3	Very low	33.7	Very low	173 Å²	173	134.9 Å²	134.9	80%	0.801	76%	0.762	S	S	*	*			trans	32.7	130.8	152.7	-48.5	-79.6	0	0	0	122.6
788	R	30	Very low	33.2	Very low	220 Å²	220	137.4 Å²	137.4	83%	0.83	77%	0.768	S	S	*	*				-170.2	131.2	96.2	-101.7	-177.7	-164.4	-129.8	2.3	115
789	F	28.7	Very low	33.1	Very low	182 Å²	182	134 Å²	134	80%	0.798	76%	0.761	S	S	*	*			trans	64.6	171.9	156.4	-69.1	-69.2	0	0	0	121.1
790	S	27.5	Very low	33.2	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	77%	0.771	S	S	*	*			trans	-142.3	175.7	-146	-40.5	0	0	0	0	111.3
791	P	61.9	Low	32.9	Very low	86 Å²	86	133.4 Å²	133.4	56%	0.558	77%	0.766	S	S	*	*			trans	-90.2	176	-163.3	38.6	-38.2	0	0	0	114.9
792	Y	27.4	Very low	32.5	Very low	188 Å²	188	135.4 Å²	135.4	74%	0.737	77%	0.768	S	S	*	*			trans	-179.6	155.6	132.3	-105.2	-65.7	0	0	0	115.9
793	S	27.6	Very low	32.2	Very low	96 Å²	96	133 Å²	133	67%	0.671	76%	0.762	S	S	*	*			trans	83	146	146.1	-65.2	0	0	0	0	124.2
794	L	34.7	Very low	32.3	Very low	142 Å²	142	133.6 Å²	133.6	74%	0.743	76%	0.76	S	S	*	*			trans	-99.1	168.6	165.7	-58.8	169.4	0	0	0	110
795	P	36.5	Very low	32.2	Very low	130 Å²	130	133.1 Å²	133.1	84%	0.844	76%	0.763	S	S	*	*				-150.6	-166.4	95.2	40	-21.3	0	0	0	114.8
796	G	28.3	Very low	32.3	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	76%	0.761	S	S	*	*			trans	-81.6	-147.6	171.4	0	0	0	0	0	113.8
797	S	30.8	Very low	32.5	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	77%	0.768	S	S	*	*			cis	-170.2	170.7	8	-169.9	0	0	0	0	110.2
798	L	29.9	Very low	32.1	Very low	171 Å²	171	126.9 Å²	126.9	90%	0.895	77%	0.765	S	S	*	*			trans	67.5	160	171.2	-43.5	178.2	0	0	0	116.2
799	G	27.9	Very low	32.5	Very low	68 Å²	68	122.2 Å²	122.2	70%	0.701	77%	0.766	S	S	*	*			cis	148.9	134.3	-15.4	0	0	0	0	0	115.5
800	S	36.5	Very low	32.5	Very low	124 Å²	124	121.7 Å²	121.7	87%	0.867	77%	0.772	S	S	*	*			trans	73.1	135.5	163.8	-161.8	0	0	0	0	120.5
801	A	30.8	Very low	32.8	Very low	87 Å²	87	120.2 Å²	120.2	72%	0.719	77%	0.766	S	S	*	*				179.3	126.2	129.5	0	0	0	0	0	114.9
802	F	26.6	Very low	31.2	Very low	195 Å²	195	124.1 Å²	124.1	86%	0.855	78%	0.782	S	S	*	*			trans	39.3	99.9	143.9	-72.5	-87.9	0	0	0	123.8
803	D	28.6	Very low	31.5	Very low	150 Å²	150	125.6 Å²	125.6	80%	0.802	79%	0.786	S	S	*	*				9.6	130	109	-166.8	25.6	0	0	0	120.1
804	A	31.2	Very low	31.6	Very low	78 Å²	78	127.1 Å²	127.1	65%	0.645	80%	0.797	S	S	*	*				157.2	146.8	111.4	0	0	0	0	0	117.9
805	V	29.5	Very low	31.4	Very low	143 Å²	143	123.4 Å²	123.4	87%	0.867	79%	0.794	S	S	*	*			trans	81.1	137.5	154.4	-174.6	0	0	0	0	121
806	T	34.3	Very low	31.2	Very low	125 Å²	125	124.7 Å²	124.7	77%	0.767	79%	0.793	S	S	*	*			trans	-133	146.3	-179.4	-53.9	0	0	0	0	110.8
807	P	35.8	Very low	32.4	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	79%	0.793	S	S	*	*			trans	-95.2	144.8	164.5	35.2	-30.4	0	0	0	112.9
808	G	30.9	Very low	33.5	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	80%	0.796	S	S	*	*			trans	-89.4	-154	173.8	0	0	0	0	0	113.3
809	S	36.7	Very low	33.4	Very low	123 Å²	123	123.3 Å²	123.3	86%	0.86	80%	0.795	S	S	*	*			cis	-162.3	146.8	3.2	-68.1	0	0	0	0	109.7
810	N	28.7	Very low	33.7	Very low	170 Å²	170	124.1 Å²	124.1	91%	0.909	80%	0.803	S	S	*	*			trans	-157.9	159.6	137	-145.4	-6.4	0	0	0	111.1
811	A	35.1	Very low	33.4	Very low	79 Å²	79	122 Å²	122	65%	0.653	80%	0.801	S	S	*	*			trans	-142.1	163.6	-168.1	0	0	0	0	0	113.8
812	N	28	Very low	33.3	Very low	169 Å²	169	122 Å²	122	90%	0.904	81%	0.809	S	S	*	*				-143.6	157.1	126.6	-145.8	-14.9	0	0	0	110.7
813	R	34.1	Very low	33.7	Very low	218 Å²	218	116.8 Å²	116.8	82%	0.823	81%	0.81	S	S	*	*			trans	-123.1	143.3	-163.1	-73.1	179.2	168.6	-167.1	-2.2	114.5
814	S	29.3	Very low	33.7	Very low	128 Å²	128	112.8 Å²	112.8	90%	0.895	81%	0.805	S	S	*	*			trans	-170.2	145.7	130.5	51.3	0	0	0	0	109.7
815	G	29.9	Very low	33.6	Very low	65 Å²	65	117.9 Å²	117.9	67%	0.67	82%	0.82	S	S	*	*			cis	-171.1	111.2	-10.6	0	0	0	0	0	112.6
816	D	31.8	Very low	33.5	Very low	156 Å²	156	115 Å²	115	83%	0.834	82%	0.82	S	S	*	*			trans	61.3	157.8	155.2	-66.9	-60.8	0	0	0	123.4
817	P	55	Low	33.2	Very low	111 Å²	111	113.1 Å²	113.1	72%	0.721	83%	0.825	S	S	*	*			trans	-128.3	-134.4	-160.1	36.3	-10.5	0	0	0	109.5
818	P	52.8	Low	32.8	Very low	124 Å²	124	110.7 Å²	110.7	81%	0.805	82%	0.822	S	S	*	*			cis	-131	-170.4	-19.9	39.2	-19.7	0	0	0	114.4
819	G	29.1	Very low	32.5	Very low	85 Å²	85	113.9 Å²	113.9	88%	0.876	83%	0.827	S	S	*	*			trans	-174.6	50.2	174.3	0	0	0	0	0	115.3
820	G	32.9	Very low	32.1	Very low	85 Å²	85	113.9 Å²	113.9	88%	0.876	82%	0.821	S	S	*	*			trans	-138.4	135.3	-178.2	0	0	0	0	0	114.1
821	G	30.8	Very low	32.3	Very low	79 Å²	79	114.1 Å²	114.1	81%	0.814	82%	0.817	S	S	*	*			trans	163.2	139	-179.5	0	0	0	0	0	107.6
822	G	28.6	Very low	31.8	Very low	87 Å²	87	118.4 Å²	118.4	90%	0.897	83%	0.829	S	S	*	*			cis	99	113	29.7	0	0	0	0	0	107.7
823	G	34	Very low	32.1	Very low	85 Å²	85	113.5 Å²	113.5	88%	0.876	82%	0.818	S	S	*	*			cis	121.4	95.5	10	0	0	0	0	0	109.2
824	G	29.4	Very low	32.7	Very low	67 Å²	67	109.4 Å²	109.4	69%	0.691	82%	0.82	S	S	*	*			trans	-176.9	118.7	-176.4	0	0	0	0	0	116.2
825	L	28.9	Very low	33.1	Very low	184 Å²	184	114.2 Å²	114.2	96%	0.963	82%	0.819	S	S	*	*			trans	60.3	145	133.3	-51.9	178.3	0	0	0	122.1
826	G	27.3	Very low	33.3	Very low	84 Å²	84	116 Å²	116	87%	0.866	82%	0.821	S	S	*	*			trans	100.3	120.2	144.1	0	0	0	0	0	115.5
827	G	27.5	Very low	33.4	Very low	85 Å²	85	116.6 Å²	116.6	88%	0.876	82%	0.823	S	S	*	*			trans	-114.2	175.5	175.1	0	0	0	0	0	113.2
828	G	27.2	Very low	32.3	Very low	70 Å²	70	116.5 Å²	116.5	72%	0.722	83%	0.825	S	S	*	*			trans	119.1	98.8	153.7	0	0	0	0	0	118.2
829	V	26.2	Very low	31.2	Very low	138 Å²	138	115.4 Å²	115.4	84%	0.836	82%	0.82	S	S	*	*			trans	72.6	151.4	137.9	-178.6	0	0	0	0	118.7
830	V	28	Very low	31.5	Very low	122 Å²	122	117.1 Å²	117.1	74%	0.739	82%	0.819	S	S	*	*			trans	51.8	110.1	-179.8	-71.9	0	0	0	0	117.1
831	E	31.3	Very low	32.5	Very low	176 Å²	176	118.5 Å²	118.5	82%	0.822	81%	0.812	S	S	*	*				77.3	108.1	61.1	-171.3	174.1	-159	0	0	114.4
832	N	26.2	Very low	32.5	Very low	168 Å²	168	124.9 Å²	124.9	90%	0.898	81%	0.812	S	S	*	*			trans	-166.1	154.6	146.2	-109.3	-67.7	0	0	0	111.2
833	G	34.3	Very low	33.6	Very low	66 Å²	66	126.3 Å²	126.3	68%	0.68	81%	0.805	S	S	*	*			trans	-96.1	-159.8	176	0	0	0	0	0	113.5
834	P	45.7	Very low	33.5	Very low	132 Å²	132	132.4 Å²	132.4	86%	0.857	80%	0.802	S	S	*	*			cis	-133.3	-165.7	19.6	41.5	-22.7	0	0	0	116.6
835	R	38.2	Very low	34.2	Very low	230 Å²	230	135.6 Å²	135.6	87%	0.868	81%	0.81	S	S	*	*			trans	-73.5	166.4	-167.5	-57.9	170.9	172.3	161.7	-2.4	114.1
836	S	34.6	Very low	34.4	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	80%	0.803	S	S	*	*				-176.3	129.2	77.9	-68.8	0	0	0	0	117.6
837	L	33.9	Very low	34.6	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	80%	0.802	S	S	*	*			trans	63.3	153.3	142.4	-51.3	175.3	0	0	0	119.2
838	S	31.2	Very low	34.9	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	80%	0.8	S	S	*	*			cis	-157.6	177.6	11.6	-156.2	0	0	0	0	115.3
839	S	30	Very low	35.1	Very low	101 Å²	101	139.3 Å²	139.3	71%	0.706	80%	0.8	S	S	*	*			trans	77.4	93.3	150.5	59.8	0	0	0	0	125.2
840	S	34.5	Very low	36.1	Very low	122 Å²	122	138.5 Å²	138.5	85%	0.853	80%	0.797	S	S	*	*				63.1	158.2	104.8	-69.8	0	0	0	0	126
841	P	55.2	Low	37.5	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	80%	0.795	S	S	*	*			trans	-144.3	179.1	-143.1	45.2	-26.2	0	0	0	120.9
842	R	30.6	Very low	37.6	Very low	213 Å²	213	136.2 Å²	136.2	80%	0.804	80%	0.798	S	S	*	*			trans	71.5	175.6	152.5	-101.5	-163.1	174.4	-160.9	2.4	118.2
843	P	50.3	Low	38.1	Very low	118 Å²	118	139.4 Å²	139.4	77%	0.766	80%	0.798	S	S	*	*			cis	-129.4	-167.4	12.1	43.1	-25.4	0	0	0	117.8
844	R	33.4	Very low	38.6	Very low	213 Å²	213	141.6 Å²	141.6	80%	0.804	80%	0.799	S	S	*	*			trans	-107.4	172.7	169.8	-55.1	180	-177.8	171.3	-1.7	110.8
845	P	43.9	Very low	37.9	Very low	133 Å²	133	143 Å²	143	86%	0.864	80%	0.798	S	S	*	*				-145.6	-158.4	92.9	38.1	-19.3	0	0	0	114.7
846	A	33.8	Very low	37.5	Very low	99 Å²	99	136.9 Å²	136.9	82%	0.818	79%	0.791	S	S	*	*			trans	-152.5	169.5	-171.2	0	0	0	0	0	113.4
847	S	29.6	Very low	37.2	Very low	121 Å²	121	140.6 Å²	140.6	85%	0.846	80%	0.799	S	S	*	*			trans	-169.7	-178.2	161.8	52.2	0	0	0	0	114.5
848	H	33.8	Very low	37.3	Very low	177 Å²	177	137.9 Å²	137.9	82%	0.819	79%	0.794	S	S	*	*			trans	-108.9	159	-155.8	-66	-119	0	0	0	116.3
849	S	32.1	Very low	37.9	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	79%	0.793	S	S	*	*				44	162.7	127.8	-59.9	0	0	0	0	124
850	P	47.2	Very low	38	Very low	120 Å²	120	139.6 Å²	139.6	78%	0.779	80%	0.798	S	S	*	*			cis	-135.8	-126.7	-34	42.4	-20.8	0	0	0	113
851	P	58.4	Low	37.9	Very low	105 Å²	105	140 Å²	140	68%	0.682	80%	0.796	S	S	*	*			trans	-129.6	-171.9	-147.2	40	-16	0	0	0	116.8
852	T	32.6	Very low	37.8	Very low	145 Å²	145	139.9 Å²	139.9	89%	0.89	80%	0.795	S	S	*	*			trans	172.6	167.4	131.1	31.6	0	0	0	0	115.7
853	R	36	Very low	38.7	Very low	236 Å²	236	135.7 Å²	135.7	89%	0.891	80%	0.795	S	S	*	*			trans	-98.9	169.8	166.4	-71.4	-176.7	-178.4	-123.2	4.4	108.8
854	P	46.4	Very low	37.8	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	80%	0.796	S	S	*	*				-160.3	166.3	50.7	42	-17.4	0	0	0	122.3
855	I	30.9	Very low	37.7	Very low	162 Å²	162	133 Å²	133	83%	0.831	80%	0.798	S	S	*	*			trans	36.1	125.7	134.7	-49.8	160.7	0	0	0	120.3
856	S	28.2	Very low	37.1	Very low	101 Å²	101	135 Å²	135	71%	0.706	80%	0.798	S	S	*	*				167	152.4	104.5	90.2	0	0	0	0	116.2
857	M	29.4	Very low	37.1	Very low	180 Å²	180	140 Å²	140	89%	0.887	80%	0.801	S	S	*	*			trans	52.9	138.8	151.4	-55.1	-48.1	-179.3	0	0	124.4
858	S	34.8	Very low	37.1	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	80%	0.8	S	S	*	*			trans	-91.3	167.5	154.5	-39.3	0	0	0	0	110
859	P	45.3	Very low	37.7	Very low	114 Å²	114	139 Å²	139	74%	0.74	79%	0.792	S	S	*	*				-158.9	-165.2	79.8	40.1	-17.1	0	0	0	116.9
860	T	31.7	Very low	37.5	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	80%	0.802	S	S	*	*			trans	81.6	126.2	151.1	31	0	0	0	0	123.5
861	T	32.6	Very low	36.8	Very low	130 Å²	130	144 Å²	144	80%	0.798	81%	0.806	S	S	*	*			trans	-100	-175.8	156	32.6	0	0	0	0	110.1
862	P	53.6	Low	35.5	Very low	111 Å²	111	142.9 Å²	142.9	72%	0.721	81%	0.813	S	S	*	*			cis	-118	-156.9	-40	34.3	-14.4	0	0	0	109.8
863	P	48.4	Very low	35.5	Very low	124 Å²	124	139.8 Å²	139.8	81%	0.805	81%	0.81	S	S	*	*				-150.4	-172.4	81.6	39.5	-18.8	0	0	0	115.2
864	S	30.5	Very low	35.3	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	81%	0.81	S	S	*	*			trans	-108.7	148.3	-177.1	-49.9	0	0	0	0	114.3
865	L	31.4	Very low	34.6	Very low	162 Å²	162	131.9 Å²	131.9	85%	0.848	81%	0.811	S	S	*	*			trans	-160.2	121.5	150.9	-88.1	127.4	0	0	0	106.2
866	M	32	Very low	34.6	Very low	176 Å²	176	129.5 Å²	129.5	87%	0.867	82%	0.816	S	S	*	*				66.2	139.3	74.1	-74.2	-159.4	174.4	0	0	116.2
867	K	33	Very low	34.7	Very low	203 Å²	203	128 Å²	128	88%	0.883	82%	0.816	S	S	*	*			trans	76.1	97.3	167.4	-77	-178.7	174.9	176	0	120.5
868	Q	30.1	Very low	34.8	Very low	178 Å²	178	126.7 Å²	126.7	83%	0.832	82%	0.818	S	S	*	*				-48.4	170.8	125.2	-105.8	-175.2	8.6	0	0	112.8
869	P	46.1	Very low	34.6	Very low	100 Å²	100	125.2 Å²	125.2	65%	0.649	81%	0.813	S	S	*	*			cis	-139.6	-164.6	-4.9	35.9	-14	0	0	0	114.8
870	R	29.7	Very low	33.9	Very low	247 Å²	247	128.3 Å²	128.3	93%	0.932	82%	0.817	S	S	*	*			trans	81.9	141.3	154.1	-75.9	176.6	167.3	-176.1	-4.8	120.1
871	G	32.1	Very low	33.7	Very low	84 Å²	84	126.7 Å²	126.7	87%	0.866	81%	0.811	S	S	*	*			trans	97.2	125.7	163.9	0	0	0	0	0	114.7
872	G	30.8	Very low	33.6	Very low	81 Å²	81	127.7 Å²	127.7	84%	0.835	81%	0.807	S	S	*	*			cis	142.8	72.9	-13.7	0	0	0	0	0	115.1
873	G	31.7	Very low	32.6	Very low	80 Å²	80	130.4 Å²	130.4	83%	0.825	81%	0.81	S	S	*	*			trans	77.5	166.8	178	0	0	0	0	0	114.6
874	A	32.4	Very low	31.7	Very low	107 Å²	107	129.8 Å²	129.8	88%	0.884	81%	0.808	S	S	*	*			cis	-161.7	162.3	-13.6	0	0	0	0	0	110.1
875	G	31.1	Very low	32.2	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	81%	0.811	S	S	*	*			trans	88.9	117	-179.1	0	0	0	0	0	112.5
876	A	31.7	Very low	32.2	Very low	112 Å²	112	128.1 Å²	128.1	93%	0.926	81%	0.807	S	S	*	*				79.4	116.4	50.1	0	0	0	0	0	113.1
877	G	30.4	Very low	32.1	Very low	69 Å²	69	128.9 Å²	128.9	71%	0.711	81%	0.808	S	S	*	*			cis	167.9	-169.9	-6.2	0	0	0	0	0	112.7
878	V	30.8	Very low	32.1	Very low	153 Å²	153	127.1 Å²	127.1	93%	0.927	81%	0.808	S	S	*	*			trans	69.9	128.8	159.3	-177.3	0	0	0	0	115.4
879	A	31.2	Very low	32.2	Very low	81 Å²	81	126.9 Å²	126.9	67%	0.669	80%	0.804	S	S	*	*			cis	-151.2	-178.4	12.1	0	0	0	0	0	114.6
880	Q	30.1	Very low	31.6	Very low	180 Å²	180	128.1 Å²	128.1	84%	0.841	82%	0.815	S	S	*	*			trans	73.3	87	149.6	-76.7	175	-28.5	0	0	121.8
881	S	28.6	Very low	31.8	Very low	97 Å²	97	125.6 Å²	125.6	68%	0.678	82%	0.816	S	S	*	*				41.3	126.9	118.2	62.6	0	0	0	0	122.1
882	Q	30	Very low	31.8	Very low	152 Å²	152	128.7 Å²	128.7	71%	0.71	81%	0.808	S	S	*	*				-168.3	151.2	109.5	-98.9	-51.6	-10.4	0	0	113.8
883	H	32.4	Very low	32	Very low	168 Å²	168	133.9 Å²	133.9	78%	0.778	81%	0.807	S	S	*	*			trans	61.7	145.2	164.5	-62.4	-56	0	0	0	123.1
884	S	30.7	Very low	32	Very low	111 Å²	111	139.4 Å²	139.4	78%	0.776	81%	0.814	S	S	*	*			trans	-97.8	174.1	-178.3	-31.3	0	0	0	0	111.7
885	P	40	Very low	31.9	Very low	128 Å²	128	140 Å²	140	83%	0.831	81%	0.807	S	S	*	*				-139	159	63.1	38.2	-21	0	0	0	116.6
886	S	31.2	Very low	31.7	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	81%	0.812	S	S	*	*			trans	-105.8	150.5	168.4	-55.5	0	0	0	0	110.3
887	E	29.5	Very low	31.7	Very low	193 Å²	193	142 Å²	142	90%	0.902	80%	0.8	S	S	*	*			trans	179	74	132.3	-101.5	-177.9	-178.9	0	0	111.9
888	L	33	Very low	31.8	Very low	166 Å²	166	146.6 Å²	146.6	87%	0.869	81%	0.807	S	S	*	*			trans	-145.8	139.3	161.2	-86	-176.8	0	0	0	110.8
889	K	33.6	Very low	31.8	Very low	173 Å²	173	146.8 Å²	146.8	75%	0.752	80%	0.798	S	S	*	*			trans	67.6	114.5	172.8	-54.6	-176.5	177.7	-165.7	0	117.5
890	S	33.6	Very low	31.9	Very low	126 Å²	126	147.9 Å²	147.9	88%	0.881	80%	0.796	S	S	*	*			trans	-156.7	58.7	145.9	-92.1	0	0	0	0	110.5
891	M	32.3	Very low	31.9	Very low	194 Å²	194	146.8 Å²	146.8	96%	0.956	79%	0.791	S	S	*	*			trans	-138.6	36.4	171.1	-81	-166.5	160.6	0	0	111.9
892	E	32.4	Very low	32.2	Very low	149 Å²	149	148.8 Å²	148.8	70%	0.696	79%	0.789	S	S	*	*	S	Bend	trans	-118.9	117.8	163.4	-74.5	-169.1	86.1	0	0	109.5
893	K	35.8	Very low	32	Very low	189 Å²	189	148.7 Å²	148.7	82%	0.822	79%	0.794	S	S	*	*			trans	64	107	166.1	-56.1	174.4	-175.7	174.2	0	118
894	M	31	Very low	31.8	Very low	196 Å²	196	144 Å²	144	97%	0.966	79%	0.79	S	S	*	*				-127.1	111.7	120.5	-82.7	-158.4	-72.9	0	0	109.6
895	V	30.3	Very low	31.7	Very low	121 Å²	121	144.9 Å²	144.9	73%	0.733	80%	0.797	S	S	*	*			trans	-142.7	120.3	166.9	167.4	0	0	0	0	106.1
896	N	28.2	Very low	31.1	Very low	162 Å²	162	142.7 Å²	142.7	87%	0.866	79%	0.79	S	S	*	*			trans	64.8	146.5	175	-57	-2.2	0	0	0	116.5
897	G	30.3	Very low	30.8	Very low	64 Å²	64	142.3 Å²	142.3	66%	0.66	79%	0.793	S	S	*	*			cis	166.3	-156.7	-3.5	0	0	0	0	0	111.8
898	L	33.5	Very low	30.7	Very low	166 Å²	166	138 Å²	138	87%	0.869	79%	0.791	S	S	*	*			trans	72	144.3	171.2	-66	165.1	0	0	0	115.1
899	E	31	Very low	30.4	Very low	157 Å²	157	135 Å²	135	73%	0.734	79%	0.789	S	S	*	*			cis	-163	153	-9	-168.7	169	-171.3	0	0	107.2
900	V	33	Very low	30	Very low	104 Å²	104	131.8 Å²	131.8	63%	0.63	80%	0.795	S	S	*	*				167	121.3	98.8	156.5	0	0	0	0	110.3
901	Q	30.5	Very low	29.6	Very low	157 Å²	157	130.8 Å²	130.8	73%	0.734	80%	0.795	S	S	*	*			trans	55.8	158.7	142.7	-64.3	171.9	4.1	0	0	122.1
902	H	33.4	Very low	29.3	Very low	139 Å²	139	126.7 Å²	126.7	64%	0.644	79%	0.792	S	S	*	*			cis	-149.8	159.1	-0.8	-132	-64.8	0	0	0	112.7
903	N	27.3	Very low	29.2	Very low	149 Å²	149	127.1 Å²	127.1	80%	0.797	80%	0.798	S	S	*	*			trans	69.2	137.4	162.6	-63.6	-12	0	0	0	119.6
904	G	28	Very low	28.8	Very low	69 Å²	69	126 Å²	126	71%	0.711	80%	0.796	S	S	*	*			cis	163	148.6	-12.4	0	0	0	0	0	115.1
905	S	28.5	Very low	28.9	Very low	131 Å²	131	124.1 Å²	124.1	92%	0.916	79%	0.789	S	S	*	*			trans	71	142.1	169	-151.9	0	0	0	0	117.6
906	A	26.1	Very low	28.9	Very low	82 Å²	82	121.8 Å²	121.8	68%	0.678	78%	0.782	S	S	*	*			cis	-165.1	152.5	-27.8	0	0	0	0	0	111.8
907	A	25.8	Very low	28.8	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	78%	0.781	S	S	*	*			trans	66.5	161.7	144.3	0	0	0	0	0	123.1
908	A	27.7	Very low	28.7	Very low	104 Å²	104	128.1 Å²	128.1	86%	0.86	79%	0.789	S	S	*	*			trans	78	89.3	156.6	0	0	0	0	0	120
909	A	26.2	Very low	28.6	Very low	101 Å²	101	124.2 Å²	124.2	84%	0.835	78%	0.781	S	S	*	*	S	Bend	trans	-118.1	148.6	135.1	0	0	0	0	0	108.9
910	A	24.8	Very low	28.5	Very low	106 Å²	106	121 Å²	121	88%	0.876	78%	0.781	S	S	*	*			trans	64.3	85.1	175	0	0	0	0	0	118.6
911	A	25.6	Very low	28.3	Very low	106 Å²	106	124.7 Å²	124.7	88%	0.876	79%	0.791	S	S	*	*			trans	-164.3	106.2	145.3	0	0	0	0	0	112.6
912	A	26.7	Very low	28.4	Very low	108 Å²	108	125.9 Å²	125.9	89%	0.893	80%	0.797	S	S	*	*			trans	-173.7	119.4	154	0	0	0	0	0	109.6
913	L	28.9	Very low	28.3	Very low	157 Å²	157	126.4 Å²	126.4	82%	0.822	80%	0.799	S	S	*	*			trans	-153.2	98.5	-178.7	-157.6	-179.5	0	0	0	110.4
914	Q	29	Very low	28.3	Very low	166 Å²	166	127.3 Å²	127.3	78%	0.776	80%	0.798	S	S	*	*			trans	-154.7	133.7	170.9	-113.7	92.7	47.2	0	0	108.2
915	L	31.7	Very low	28.5	Very low	157 Å²	157	132.9 Å²	132.9	82%	0.822	81%	0.805	S	S	*	*				60.6	134.2	88.4	-65.3	-175.3	0	0	0	113.8
916	A	30.4	Very low	28.7	Very low	72 Å²	72	131.2 Å²	131.2	60%	0.595	79%	0.789	S	S	*	*			cis	-147.3	165.3	2.6	0	0	0	0	0	109.7
917	E	27.7	Very low	28.9	Very low	181 Å²	181	136.5 Å²	136.5	85%	0.846	80%	0.8	S	S	*	*				62.6	131.8	95.9	-156.3	156.3	-145.2	0	0	113
918	E	28	Very low	29.1	Very low	178 Å²	178	136 Å²	136	83%	0.832	80%	0.796	S	S	*	*			cis	-156.7	178.8	39.4	-155.6	-166.9	131.4	0	0	112.4
919	A	30.9	Very low	29.2	Very low	84 Å²	84	138.3 Å²	138.3	69%	0.694	79%	0.788	S	S	*	*			trans	54.2	120.1	161.4	0	0	0	0	0	119.6
920	A	29.1	Very low	29.7	Very low	88 Å²	88	140.6 Å²	140.6	73%	0.727	78%	0.782	S	S	*	*			cis	96.6	127.7	22.6	0	0	0	0	0	116.8
921	Q	28.7	Very low	29.9	Very low	182 Å²	182	144.1 Å²	144.1	85%	0.85	78%	0.78	S	S	*	*			trans	65.7	102.4	162.4	-54.2	180	22	0	0	120.1
922	H	32.3	Very low	30	Very low	183 Å²	183	145.3 Å²	145.3	85%	0.847	77%	0.768	S	S	*	*				-156.8	149.7	117	-128.4	-103.3	0	0	0	116.1
923	H	31.1	Very low	30.2	Very low	149 Å²	149	146.5 Å²	146.5	69%	0.69	75%	0.754	S	S	*	*			trans	-49	141.7	-171.6	-86	86.2	0	0	0	122
924	H	28.2	Very low	30.3	Very low	168 Å²	168	146.6 Å²	146.6	78%	0.778	75%	0.751	S	S	*	*				42.6	98.8	128.4	-86.2	50.8	0	0	0	120.4
925	H	31.5	Very low	30.4	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.866	75%	0.752	S	S	*	*			trans	-170	138	141	-107.3	57.1	0	0	0	107.5
926	T	33.1	Very low	30.3	Very low	95 Å²	95	147.7 Å²	147.7	58%	0.583	75%	0.751	S	S	*	*			cis	-144.2	129.5	-7.8	-60.7	0	0	0	0	109
927	Q	28.8	Very low	30.4	Very low	194 Å²	194	148.4 Å²	148.4	91%	0.907	75%	0.752	S	S	*	*	S	Bend	trans	-112.3	136.2	158	-160.7	174.3	27.4	0	0	107.2
928	A	30.1	Very low	30.8	Very low	89 Å²	89	148 Å²	148	74%	0.736	75%	0.75	S	S	*	*			trans	65.5	86.2	-178	0	0	0	0	0	117.9
929	H	31.2	Very low	31.1	Very low	153 Å²	153	146.8 Å²	146.8	71%	0.708	74%	0.743	S	S	*	*			trans	-161.8	134.7	142.4	-95.3	-73.5	0	0	0	107
930	H	36.3	Very low	31.2	Very low	149 Å²	149	149.7 Å²	149.7	69%	0.69	74%	0.743	S	S	*	*			cis	-123.9	131.4	-4.9	-93.3	96	0	0	0	111.3
931	Q	28.5	Very low	31.5	Very low	181 Å²	181	152.3 Å²	152.3	85%	0.846	74%	0.74	S	S	*	*			trans	-92.6	163.8	134	-168.6	175.5	83.3	0	0	106.6
932	Q	28.8	Very low	31.6	Very low	131 Å²	131	151 Å²	151	61%	0.612	73%	0.734	S	S	*	*			trans	69.4	155.6	-172.5	-60.3	-175.9	-63.3	0	0	114.7
933	Q	30.2	Very low	31.7	Very low	132 Å²	132	149.1 Å²	149.1	62%	0.617	73%	0.725	S	S	*	*			cis	-128.5	142.2	-5.2	-108.7	130.5	40	0	0	107.4
934	Q	30.4	Very low	31.7	Very low	159 Å²	159	148.5 Å²	148.5	74%	0.743	72%	0.722	S	S	*	*				62.6	154	71.8	-63.1	-175.2	-14.4	0	0	115.8
935	H	30.8	Very low	31.7	Very low	172 Å²	172	147.8 Å²	147.8	80%	0.796	72%	0.719	S	S	*	*			trans	103.1	121.7	-169.3	-64.5	96.8	0	0	0	111.3
936	Q	30.3	Very low	31.6	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	72%	0.717	S	S	*	*			cis	-123.2	148.4	10.7	-69.4	169.9	1.3	0	0	109.1
937	S	32.5	Very low	32.1	Very low	86 Å²	86	147.8 Å²	147.8	60%	0.601	72%	0.722	S	S	*	*			cis	68.4	127.6	45.5	77.4	0	0	0	0	113.8
938	H	36.5	Very low	32.1	Very low	173 Å²	173	143.2 Å²	143.2	80%	0.801	72%	0.717	S	S	*	*			cis	-163.4	-171.2	6.1	-140.5	83.9	0	0	0	111.9
939	H	33.6	Very low	32.5	Very low	152 Å²	152	146.2 Å²	146.2	70%	0.704	72%	0.717	S	S	*	*			trans	81.9	138.9	170.5	-78.8	56.9	0	0	0	118.2
940	Q	33.2	Very low	32.6	Very low	146 Å²	146	144.5 Å²	144.5	68%	0.682	72%	0.719	S	S	*	*			cis	-156.8	120.6	-12.1	-170	162.5	27.9	0	0	114.6
941	Q	35.1	Very low	33	Very low	143 Å²	143	144.8 Å²	144.8	67%	0.668	72%	0.72	S	S	*	*			trans	34.2	128.2	133.7	-152.9	178.7	45.8	0	0	123.4
942	Q	31.6	Very low	33.8	Very low	154 Å²	154	141.1 Å²	141.1	72%	0.72	71%	0.712	S	S	*	*				159.6	119.9	124.1	-84.9	-171.4	28.7	0	0	111
943	H	33.2	Very low	34.1	Very low	143 Å²	143	141.9 Å²	141.9	66%	0.662	72%	0.715	S	S	*	*				73.7	142.9	101.1	-63.9	-17.9	0	0	0	115.6
944	H	31.8	Very low	34.2	Very low	137 Å²	137	141.9 Å²	141.9	63%	0.634	72%	0.715	S	S	*	*			cis	-159.3	154.7	0.8	-131.3	66.7	0	0	0	112.1
945	Q	29.1	Very low	34.3	Very low	153 Å²	153	140.6 Å²	140.6	72%	0.715	71%	0.709	S	S	*	*			trans	32.8	129.2	153	-67.3	-176.5	42.1	0	0	124.6
946	Q	28.1	Very low	34.4	Very low	175 Å²	175	135.7 Å²	135.7	82%	0.818	69%	0.691	S	S	*	*				38.1	163.8	124.6	-80.6	-167.4	42.9	0	0	123.8
947	P	43.4	Very low	34.8	Very low	107 Å²	107	133.9 Å²	133.9	70%	0.695	68%	0.683	S	S	*	*			cis	-140	-166	-20.3	36.1	-14.4	0	0	0	115.2
948	A	29.6	Very low	35	Very low	97 Å²	97	135.3 Å²	135.3	80%	0.802	68%	0.683	S	S	*	*			trans	91.9	128.4	142	0	0	0	0	0	122.8
949	Q	37.5	Very low	35.2	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	68%	0.679	S	S	*	*			trans	-75.4	161	158	-91.6	-99	-11	0	0	110.8
950	P	34.6	Very low	35.3	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	67%	0.674	S	S	*	*				-149.2	138.8	97.3	36.1	-18.5	0	0	0	117.3
951	H	44.8	Very low	35.6	Very low	155 Å²	155	131.5 Å²	131.5	72%	0.718	68%	0.675	S	S	*	*			trans	-79.5	143.2	141.7	-89.8	-57.2	0	0	0	110.3
952	P	45.5	Very low	35.7	Very low	104 Å²	104	133 Å²	133	68%	0.675	68%	0.681	S	S	*	*				-121.2	153.6	119.8	-4.4	26	0	0	0	111.7
953	H	34	Very low	35.9	Very low	148 Å²	148	129.2 Å²	129.2	69%	0.685	68%	0.683	S	S	*	*			cis	65.1	143.1	48.4	-64.6	-87.3	0	0	0	112.8
954	H	31.7	Very low	36	Very low	131 Å²	131	126.3 Å²	126.3	61%	0.606	68%	0.684	S	S	*	*			cis	-155.9	143.6	-2.9	-113.9	-32.2	0	0	0	107
955	Q	32.9	Very low	36.2	Very low	133 Å²	133	126.1 Å²	126.1	62%	0.621	69%	0.693	S	S	*	*				73.8	156.3	80.5	-162.8	-156.3	42	0	0	115.2
956	T	33.6	Very low	36.5	Very low	69 Å²	69	125.5 Å²	125.5	42%	0.423	70%	0.699	S	S	.	*			trans	81	151.2	165	84	0	0	0	0	116.7	S204	S204-T956 WeakPolarHBondContact OG-CB 3.34Å; S204-T956 PolarHBondContact OG-OG1 3.1Å
957	H	39.1	Very low	36.7	Very low	137 Å²	137	120.8 Å²	120.8	63%	0.634	70%	0.698	S	S	*	*			cis	-176.9	175.3	-21.6	-96.6	-26.7	0	0	0	107.5
958	L	36.4	Very low	36.3	Very low	116 Å²	116	119.5 Å²	119.5	61%	0.607	70%	0.704	S	S	*	*			cis	-160.5	-170	-3	-125.1	167.9	0	0	0	108.3
959	H	39.6	Very low	37	Very low	156 Å²	156	120.8 Å²	120.8	72%	0.722	70%	0.702	S	S	*	*			trans	74.3	150.3	152.7	-64.7	139.4	0	0	0	118
960	S	36.4	Very low	37.1	Very low	86 Å²	86	120.4 Å²	120.4	60%	0.601	71%	0.705	S	S	*	*			cis	-162.7	145	-7.4	-112.1	0	0	0	0	115.5
961	H	38.8	Very low	37.3	Very low	149 Å²	149	127.9 Å²	127.9	69%	0.69	73%	0.73	S	S	*	*			trans	65	140.4	137.4	-86.6	-108.8	0	0	0	125.9
962	H	37.8	Very low	36.9	Very low	175 Å²	175	126.5 Å²	126.5	81%	0.81	73%	0.73	S	S	*	*			trans	61.8	145.1	157.9	-60.4	-58.7	0	0	0	119.1
963	G	35.3	Very low	36.5	Very low	74 Å²	74	127.7 Å²	127.7	76%	0.763	73%	0.733	S	S	*	*			cis	165.7	175.9	-1.1	0	0	0	0	0	109.9
964	A	35.3	Very low	36.6	Very low	81 Å²	81	126.6 Å²	126.6	67%	0.669	74%	0.736	S	S	*	*			cis	-169.6	-179.5	-13	0	0	0	0	0	109.1
965	T	36.5	Very low	36.9	Very low	134 Å²	134	126.3 Å²	126.3	82%	0.822	74%	0.743	S	S	*	*			trans	64.7	150.7	168.8	58.4	0	0	0	0	117.6
966	T	35.6	Very low	37.1	Very low	139 Å²	139	125.9 Å²	125.9	85%	0.853	75%	0.751	S	S	*	*			cis	-159.8	164.2	-10.1	16.1	0	0	0	0	106
967	G	32.6	Very low	37.4	Very low	77 Å²	77	129.7 Å²	129.7	79%	0.794	77%	0.773	S	S	*	*			cis	137.9	128	10.8	0	0	0	0	0	109
968	G	34.4	Very low	37.3	Very low	79 Å²	79	129.1 Å²	129.1	81%	0.814	78%	0.783	S	S	*	*			trans	170	141.8	-179.5	0	0	0	0	0	113.3
969	T	45.5	Very low	37.3	Very low	124 Å²	124	130.2 Å²	130.2	76%	0.761	80%	0.796	S	S	*	*			trans	-132	174.4	-171.1	47.1	0	0	0	0	112.5
970	D	38.6	Very low	37.1	Very low	145 Å²	145	128 Å²	128	78%	0.775	80%	0.802	S	S	*	*			trans	89.9	134.8	155.6	-56	-62.5	0	0	0	120.5
971	Q	38.8	Very low	37.2	Very low	273 Å²	273	131.8 Å²	131.8	100%	1.276	82%	0.821	S	S	*	*			trans	71.4	0	177	-55.5	-166.7	24.6	0	0	117.5

Retrieved 971 of 971 residues in 127.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).