A0A061AE99_CAEEL Loading...

LIM zinc-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AE99, Species CAEEL (Caenorhabditis elegans), Gene tag-273, Length 883 aa.

						>A0A061AE99_CAEEL|A0A061AE99|tag-273
MTEEEDPYALSSSESEDEAPKKPIKIEGRSGDLKQLKSALFENKGPVKDEAREEELAALKAGNQELKKMKKDFETGAVHNIENEDDETKIARLEERQKLTEIGQEKFSKFKTKFENIDSTMDEDLEQKLKRMQKEQIGGVGKETLASAKERFEKGESDIVVEKTAVDIERSADLSKMKAAFQEVKQEEKKNCCICDKVVYPVEKVLANKNLYHIQCFKCCKCAKKLTPTNFNSHEGKLLCKVHMLEVFHPEIAHTMDPQNTEEDEHAASDEEEFAVSSKPKQLQGVVKSGGGGVHDELAQLKSLREKKGDFESSCKEVDNVEKKTQIEKDLLAAGKVKANAEKFISGAALENSDDESESADRDPNIIRGSKKAEKVELNFENVGDIKNKWKEGNVETAEAKEAAERKELEALKGGVSVKDRFKERGDNDEQVVERSWNKDELSTSAAAEARKSFMAGSAYDAANPVEKTVKDLDDLKFGQLKGFKDKFEKGEEGVEVQKTQVDLGEGVQLGNIKATFEKGNAVDESEMTAEERAELKKREIEAEFQRYKLARKSAKAQEEVVGEEEANKGYNPLDVEVKMAGKAREKFRQIDASGASPVLPQQSKKSTEPSKWDKKDDKPVAEVINRRNTDEQEPEEEEDDAFDVKNLMNKFKNIGDSGNQKTQNTEHRAELEALKCAAKDFKAKFENAGEADADAAVVEAKRQQMEEEFEAMKREREEAQKRLEEERLAEASASQGNEARDEDVAIKAEHASKMAAKWEKIQQKEAKKAEKGKMPEKKTGNGRFCLPPPDKCSLCTKNVYRAEQFQCFGLLYHVNCFRCIDCKQALRVEKAHRCQQSGDLYCRVHFKLMEENRSRKMLSLEENNNNNEMETAQVEEEEVSDI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	38.5	Very low	224 Å²	224	155.7 Å²	155.7	100%	1.103	83%	0.83	S	S	*	*				0	76.2	0	-65	-171.1	-177	0	0	110.4	E3	M1-E3 PolarHBondContact N-OE1 3.35Å
2	T	37.7	Very low	38.1	Very low	119 Å²	119	152.8 Å²	152.8	73%	0.73	83%	0.832	S	S	*	*			cis	-135.2	143.9	-3.8	44.8	0	0	0	0	106.1
3	E	41.9	Very low	37.6	Very low	150 Å²	150	149.5 Å²	149.5	70%	0.701	83%	0.827	S	S	*	*				53.1	119.7	70.3	-72.2	135.4	-109.8	0	0	110.1	M1	M1-E3 PolarHBondContact N-OE1 3.35Å
4	E	41.9	Very low	37.2	Very low	191 Å²	191	151.5 Å²	151.5	89%	0.893	83%	0.827	S	S	*	*			cis	-141.7	177.5	10.6	-94.8	164.8	138.1	0	0	112.7
5	E	39.7	Very low	37	Very low	188 Å²	188	148.6 Å²	148.6	88%	0.879	82%	0.822	S	S	*	*			trans	-99.7	144.2	-175.6	-58.3	177.2	132.1	0	0	113
6	D	39.7	Very low	36.7	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	82%	0.823	S	S	*	*			trans	-129	110.1	162.8	177.7	-1.1	0	0	0	109.7	Y8	D6-Y8 PolarHBondContact OD1-N 3.08Å
7	P	39.6	Very low	36.5	Very low	116 Å²	116	150.9 Å²	150.9	75%	0.753	82%	0.824	S	S	*	*			trans	-112.6	40.7	179	40.5	-32.2	0	0	0	113.8
8	Y	39.6	Very low	36.4	Very low	198 Å²	198	153.6 Å²	153.6	78%	0.776	83%	0.83	S	S	*	*			trans	-117.8	42.5	176.3	-125.9	-85.4	0	0	0	116.4	D6	D6-Y8 PolarHBondContact OD1-N 3.08Å
9	A	37.8	Very low	36.3	Very low	101 Å²	101	149.7 Å²	149.7	84%	0.835	82%	0.821	S	S	*	*			trans	-92	126.5	168	0	0	0	0	0	112
10	L	37.4	Very low	36.5	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	82%	0.82	S	S	*	*			trans	-103.3	132.4	-179.1	-66.1	168.8	0	0	0	111.9
11	S	32.5	Very low	36.5	Very low	124 Å²	124	151.3 Å²	151.3	87%	0.867	83%	0.825	S	S	*	*			trans	-156.5	130.1	157.6	61.2	0	0	0	0	113.4
12	S	33	Very low	36.5	Very low	121 Å²	121	150.1 Å²	150.1	85%	0.846	81%	0.813	S	S	*	*			trans	-70.6	152	171	-40.5	0	0	0	0	113.5
13	S	31.5	Very low	36.6	Very low	110 Å²	110	150.4 Å²	150.4	77%	0.769	82%	0.817	S	S	*	*			trans	-167.9	144	144.7	55.7	0	0	0	0	111.2
14	E	32.8	Very low	36.2	Very low	177 Å²	177	151.3 Å²	151.3	83%	0.827	83%	0.825	S	S	*	*			trans	-69.6	153.2	166	-48.9	97.7	107.1	0	0	112.3
15	S	33.4	Very low	35.9	Very low	108 Å²	108	149.7 Å²	149.7	76%	0.755	82%	0.815	S	S	*	*				170.6	123.1	126.6	58.9	0	0	0	0	114.3
16	E	33.3	Very low	35.7	Very low	178 Å²	178	149 Å²	149	83%	0.832	82%	0.815	S	S	*	*			trans	34.3	124.6	131.8	-55.2	-176.7	151	0	0	122.6
17	D	33.4	Very low	35.5	Very low	158 Å²	158	149 Å²	149	85%	0.845	81%	0.811	S	S	*	*			trans	24.3	124.5	141.8	-63.9	-71	0	0	0	123.5
18	E	33.5	Very low	35.1	Very low	200 Å²	200	147 Å²	147	94%	0.935	81%	0.812	S	S	*	*				-152	168.5	116	-131.6	-153.7	168.3	0	0	113.6
19	A	35.2	Very low	35	Very low	80 Å²	80	149 Å²	149	66%	0.661	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88.5	153.3	-159.6	0	0	0	0	0	116.6
20	P	40	Very low	35.3	Very low	124 Å²	124	150.5 Å²	150.5	81%	0.805	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.6	148.7	-177.4	29.9	-36.1	0	0	0	114.6
21	K	35.9	Very low	35.8	Very low	209 Å²	209	145.1 Å²	145.1	91%	0.909	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-79.6	151.8	178.4	-70.4	172.4	-178.3	167.5	0	112.3
22	K	37.1	Very low	36.7	Very low	199 Å²	199	144 Å²	144	87%	0.865	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-84.2	152.6	-164.1	-67.5	175.1	-178.2	173.3	0	113.9
23	P	38.6	Very low	37.6	Very low	125 Å²	125	144.6 Å²	144.6	81%	0.812	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-76.8	166.8	-177.7	32.4	-37.5	0	0	0	114.2
24	I	34.6	Very low	38.7	Very low	169 Å²	169	148.1 Å²	148.1	87%	0.867	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.1	137.4	179.2	-63.1	170	0	0	0	110.9
25	K	35.1	Very low	39.9	Very low	156 Å²	156	146 Å²	146	68%	0.678	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-87.2	147.3	170	-77.4	175.2	160.3	-171	0	111.6	E27	K25-E27 HydrophobicContact CB-CG 4.16Å; K25-E27 HydrophobicContact CD-CG 3.97Å; K25-E27 WeakPolarHBondContact CD-OE1 3.42Å; K25-E27 WeakPolarHBondContact CE-OE1 3.45Å; K25-E27 IonicContact NZ-OE1 2.67Å; K25-E27 PolarHBondContact NZ-OE1 2.85Å
26	I	36.5	Very low	40.7	Very low	173 Å²	173	146 Å²	146	89%	0.887	77%	0.765	S	S	*	*			trans	-120	131	141.6	-61.8	179.8	0	0	0	106.4
27	E	34	Very low	41.6	Very low	146 Å²	146	145.2 Å²	145.2	68%	0.682	76%	0.759	S	S	*	*			trans	-107.8	160.7	-175.9	-54.7	-173.7	127.2	0	0	110.2	K25	K25-E27 HydrophobicContact CB-CG 4.16Å; K25-E27 HydrophobicContact CD-CG 3.97Å; K25-E27 WeakPolarHBondContact CD-OE1 3.42Å; K25-E27 WeakPolarHBondContact CE-OE1 3.45Å; K25-E27 IonicContact NZ-OE1 2.67Å; K25-E27 PolarHBondContact NZ-OE1 2.85Å
28	G	32.9	Very low	42.7	Very low	75 Å²	75	140.7 Å²	140.7	77%	0.773	74%	0.739	S	S	*	*			trans	157.7	2.3	166.4	0	0	0	0	0	122.2
29	R	36.1	Very low	43.6	Very low	238 Å²	238	134.3 Å²	134.3	90%	0.898	72%	0.72	S	S	*	*			trans	-149.4	72.7	172.7	-152	76.2	177.7	-156.3	-0.9	114.2	G31	R29-G31 PolarHBondContact O-N 3.11Å; R29-G31 VanDerWaalsContact O-N 3.1Å
30	S	44.4	Very low	44.3	Very low	134 Å²	134	137.2 Å²	137.2	94%	0.937	72%	0.724	S	S	*	*			trans	-77.9	88.7	172.7	54.9	0	0	0	0	111.3
31	G	48.1	Very low	44.7	Very low	44 Å²	44	139.7 Å²	139.7	45%	0.454	72%	0.723	S	S	.	*			trans	-160.8	164.2	175.6	0	0	0	0	0	111.1	R29 L33	R29-G31 PolarHBondContact O-N 3.11Å; R29-G31 VanDerWaalsContact O-N 3.1Å; G31-L33 PolarHBondContact O-N 2.99Å
32	D	50.6	Low	45.4	Very low	99 Å²	99	137 Å²	137	53%	0.529	71%	0.713	S	S	.	*	S	Bend	trans	64.3	-9.7	160.2	-44.6	-27.7	0	0	0	119.7	K34 Q35 L36	D32-K34 PolarHBondContact O-N 3.44Å; D32-K34 VanDerWaalsContact O-N 3.11Å; D32-Q35 WeakPolarHBondContact O-CA 3.43Å; D32-Q35 PolarHBondContact O-N 2.85Å; D32-L36 PolarHBondContact O-N 3.29Å
33	L	52.1	Low	46	Very low	135 Å²	135	134.8 Å²	134.8	71%	0.707	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	172	-170	60.5	0	0	0	113.4	G31	G31-L33 PolarHBondContact O-N 2.99Å
34	K	54.4	Low	46.1	Very low	184 Å²	184	138.1 Å²	138.1	80%	0.8	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-37	167.7	-77.1	-172.2	175.9	-178.2	0	112.8	D32 K37 S38	D32-K34 PolarHBondContact O-N 3.44Å; D32-K34 VanDerWaalsContact O-N 3.11Å; K34-K37 PolarHBondContact O-N 3.09Å; K34-K37 VanDerWaalsContact O-N 3.14Å; K34-S38 PolarHBondContact O-N 3.02Å; K34-S38 VanDerWaalsContact O-N 3.14Å
35	Q	58.3	Low	46.2	Very low	133 Å²	133	133 Å²	133	62%	0.621	70%	0.702	S	S	*	*	H	α-helix	trans	-66.3	-40.2	175.5	-68.3	-177.5	-5.8	0	0	111	D32 K37 S38 A39	D32-Q35 WeakPolarHBondContact O-CA 3.43Å; D32-Q35 PolarHBondContact O-N 2.85Å; Q35-K37 PolarHBondContact O-N 3.36Å; Q35-S38 PolarHBondContact O-N 2.9Å; Q35-S38 VanDerWaalsContact O-N 3.16Å; Q35-A39 WeakPolarHBondContact O-CB 3.27Å; Q35-A39 PolarHBondContact O-N 2.65Å
36	L	51.2	Low	46.4	Very low	108 Å²	108	131.7 Å²	131.7	57%	0.565	71%	0.709	S	S	*	*	H	α-helix	trans	-61.6	-24.6	172	-72.9	169.9	0	0	0	113.6	D32	D32-L36 PolarHBondContact O-N 3.29Å
37	K	51.3	Low	46.6	Very low	161 Å²	161	129.3 Å²	129.3	70%	0.7	70%	0.702	S	S	*	*	H	α-helix	trans	-82	-32.1	173	-99.2	-172.5	175	-174.1	0	113.7	K34 Q35	K34-K37 PolarHBondContact O-N 3.09Å; K34-K37 VanDerWaalsContact O-N 3.14Å; Q35-K37 PolarHBondContact O-N 3.36Å
38	S	56.4	Low	47.3	Very low	62 Å²	62	129 Å²	129	43%	0.434	70%	0.699	S	S	.	*	H	α-helix	trans	-70.4	-47	170.9	-65.9	0	0	0	0	111.6	K34 Q35 L40 F41 E42	K34-S38 PolarHBondContact O-N 3.02Å; K34-S38 VanDerWaalsContact O-N 3.14Å; Q35-S38 PolarHBondContact O-N 2.9Å; Q35-S38 VanDerWaalsContact O-N 3.16Å; S38-L40 PolarHBondContact O-N 3.1Å; S38-L40 VanDerWaalsContact O-N 3.08Å; S38-F41 PolarHBondContact O-N 2.86Å; S38-E42 PolarHBondContact O-N 3.11Å
39	A	53.9	Low	48.2	Very low	66 Å²	66	129.5 Å²	129.5	55%	0.545	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.5	-20.4	-179.8	0	0	0	0	0	114.2	Q35	Q35-A39 WeakPolarHBondContact O-CB 3.27Å; Q35-A39 PolarHBondContact O-N 2.65Å
40	L	49.8	Very low	49.2	Very low	142 Å²	142	124.5 Å²	124.5	74%	0.743	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-8.1	174.9	-101	162.5	0	0	0	114.7	S38	S38-L40 PolarHBondContact O-N 3.1Å; S38-L40 VanDerWaalsContact O-N 3.08Å
41	F	46.5	Very low	50	Low	176 Å²	176	121.6 Å²	121.6	77%	0.772	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-17.5	-178.9	-94.6	-87.8	0	0	0	114.5	S38	S38-F41 PolarHBondContact O-N 2.86Å
42	E	52	Low	50.5	Low	152 Å²	152	126.9 Å²	126.9	71%	0.71	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	0.9	-175.8	-69.6	174.9	163.9	0	0	114.6	S38	S38-E42 PolarHBondContact O-N 3.11Å
43	N	49.4	Very low	51.3	Low	152 Å²	152	128.7 Å²	128.7	81%	0.813	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	40.5	177.5	-87.5	-55.5	0	0	0	114.3
44	K	40.2	Very low	52.2	Low	196 Å²	196	129 Å²	129	85%	0.852	66%	0.664	S	S	*	*			trans	-134.7	89.1	156.7	-76.5	-162	174.6	-170.7	0	111.1
45	G	37.3	Very low	52.9	Low	62 Å²	62	126.1 Å²	126.1	64%	0.639	65%	0.654	S	S	*	*			trans	-60.5	153.8	157.9	0	0	0	0	0	110.3	V47	G45-V47 PolarHBondContact O-N 2.93Å
46	P	39.2	Very low	53.3	Low	127 Å²	127	124 Å²	124	83%	0.825	65%	0.646	S	S	*	*			trans	-72.8	94.8	-174.2	29.8	-35	0	0	0	111.1	K48	P46-K48 PolarHBondContact O-N 3.14Å; P46-K48 VanDerWaalsContact O-N 3.13Å
47	V	40.7	Very low	54.2	Low	124 Å²	124	121.6 Å²	121.6	75%	0.752	64%	0.641	S	S	*	*			trans	-65.5	106.5	151.3	180	0	0	0	0	105.8	G45 D49	G45-V47 PolarHBondContact O-N 2.93Å; V47-D49 PolarHBondContact O-N 2.92Å
48	K	47.4	Very low	55.2	Low	140 Å²	140	116.9 Å²	116.9	61%	0.609	63%	0.633	S	S	*	*			trans	-73.7	113.1	164.5	-68.1	-175.8	178.9	-175.9	0	107.2	P46 E50	P46-K48 PolarHBondContact O-N 3.14Å; P46-K48 VanDerWaalsContact O-N 3.13Å; K48-E50 HydrophobicContact CB-CG 3.72Å; K48-E50 HydrophobicContact CD-CG 4.35Å; K48-E50 PolarHBondContact O-N 3.14Å
49	D	52.4	Low	55.7	Low	85 Å²	85	119.5 Å²	119.5	46%	0.455	64%	0.641	S	S	.	*			trans	-72.7	75.1	163.7	-61.5	-29.6	0	0	0	107.5	V47 A51 R52 E53	V47-D49 PolarHBondContact O-N 2.92Å; D49-A51 PolarHBondContact O-N 2.89Å; D49-R52 HydrophobicContact CB-CB 3.74Å; D49-R52 WeakPolarHBondContact O-CA 3.36Å; D49-R52 WeakPolarHBondContact O-CB 3.23Å; D49-R52 PolarHBondContact O-N 3.24Å; D49-R52 IonicContact OD2-NH1 3.76Å; D49-E53 PolarHBondContact O-N 2.89Å
50	E	56.9	Low	56.5	Low	132 Å²	132	123 Å²	123	62%	0.617	64%	0.644	S	S	*	*	H	α-helix	trans	-57.4	-38	-172.2	-64.2	-172.2	146.2	0	0	111.4	K48 R52 E53 E54	K48-E50 HydrophobicContact CB-CG 3.72Å; K48-E50 HydrophobicContact CD-CG 4.35Å; K48-E50 PolarHBondContact O-N 3.14Å; E50-R52 PolarHBondContact O-N 2.84Å; E50-E53 PolarHBondContact O-N 3.21Å; E50-E54 WeakPolarHBondContact O-CB 3.39Å; E50-E54 PolarHBondContact O-N 3.15Å
51	A	61.3	Low	57.5	Low	74 Å²	74	118.5 Å²	118.5	61%	0.612	63%	0.628	S	S	*	*	H	α-helix	trans	-57.7	-28.3	172	0	0	0	0	0	114.4	D49 E55	D49-A51 PolarHBondContact O-N 2.89Å; A51-E55 WeakPolarHBondContact O-CB 3.38Å; A51-E55 PolarHBondContact O-N 3.16Å
52	R	59.3	Low	58.8	Low	155 Å²	155	111.4 Å²	111.4	59%	0.585	60%	0.604	S	S	*	*	H	α-helix	trans	-88.5	-27.7	-179.3	-175.5	177.4	163.2	-150.7	-4	112.6	D49 E50 L56	D49-R52 HydrophobicContact CB-CB 3.74Å; D49-R52 WeakPolarHBondContact O-CA 3.36Å; D49-R52 WeakPolarHBondContact O-CB 3.23Å; D49-R52 PolarHBondContact O-N 3.24Å; D49-R52 IonicContact OD2-NH1 3.76Å; E50-R52 PolarHBondContact O-N 2.84Å; R52-L56 WeakPolarHBondContact O-CB 3.5Å; R52-L56 PolarHBondContact O-N 3.15Å
53	E	67.3	Low	59.8	Low	137 Å²	137	108 Å²	108	64%	0.64	59%	0.591	S	S	*	*	H	α-helix	trans	-72.2	-35.2	164.7	-65.6	-160.6	128.8	0	0	110.9	D49 E50 L56 A57	D49-E53 PolarHBondContact O-N 2.89Å; E50-E53 PolarHBondContact O-N 3.21Å; E53-L56 PolarHBondContact O-N 3.46Å; E53-A57 WeakPolarHBondContact O-CB 3.42Å; E53-A57 PolarHBondContact O-N 3.45Å
54	E	70	Confident	60.8	Low	141 Å²	141	107.6 Å²	107.6	66%	0.659	58%	0.584	S	S	*	*	H	α-helix	trans	-65.2	-45.9	172.8	-174.2	169.9	-150.6	0	0	112.4	E50 L56 A57 A58	E50-E54 WeakPolarHBondContact O-CB 3.39Å; E50-E54 PolarHBondContact O-N 3.15Å; E54-L56 VanDerWaalsContact C-N 3.34Å; E54-L56 PolarHBondContact O-N 3.4Å; E54-A57 CarbonylContact O-C 3.58Å; E54-A57 WeakPolarHBondContact O-CA 3.39Å; E54-A57 WeakPolarHBondContact O-CB 3.46Å; E54-A57 PolarHBondContact O-N 3.27Å; E54-A58 PolarHBondContact O-N 2.9Å
55	E	69.9	Low	62.3	Low	124 Å²	124	104 Å²	104	58%	0.579	57%	0.571	S	S	*	*	H	α-helix	trans	-59.8	-42.6	173.9	-174.4	-179.7	-146.1	0	0	111.8	A51 A57 A58 L59	A51-E55 WeakPolarHBondContact O-CB 3.38Å; A51-E55 PolarHBondContact O-N 3.16Å; E55-A57 VanDerWaalsContact C-N 3.28Å; E55-A57 PolarHBondContact O-N 3Å; E55-A58 PolarHBondContact O-N 3.43Å; E55-L59 HydrophobicContact CG-CD1 4.29Å; E55-L59 WeakPolarHBondContact O-CB 3.33Å; E55-L59 WeakPolarHBondContact O-CG 3.12Å; E55-L59 PolarHBondContact O-N 2.9Å
56	L	67.5	Low	63.8	Low	89 Å²	89	106.5 Å²	106.5	47%	0.466	57%	0.568	S	S	.	*	H	α-helix	trans	-68.4	-23.4	173.6	-91.8	165	0	0	0	113.7	R52 E53 E54 K60	R52-L56 WeakPolarHBondContact O-CB 3.5Å; R52-L56 PolarHBondContact O-N 3.15Å; E53-L56 PolarHBondContact O-N 3.46Å; E54-L56 VanDerWaalsContact C-N 3.34Å; E54-L56 PolarHBondContact O-N 3.4Å; L56-K60 VanDerWaalsContact O-CD 3.26Å; L56-K60 WeakPolarHBondContact O-CD 3.49Å; L56-K60 WeakPolarHBondContact O-CG 3.46Å; L56-K60 PolarHBondContact O-N 2.93Å
57	A	70.4	Confident	65.6	Low	56 Å²	56	106.8 Å²	106.8	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-77.8	-43.9	171.2	0	0	0	0	0	111.2	E53 E54 E55 K60 A61	E53-A57 WeakPolarHBondContact O-CB 3.42Å; E53-A57 PolarHBondContact O-N 3.45Å; E54-A57 CarbonylContact O-C 3.58Å; E54-A57 WeakPolarHBondContact O-CA 3.39Å; E54-A57 WeakPolarHBondContact O-CB 3.46Å; E54-A57 PolarHBondContact O-N 3.27Å; E55-A57 VanDerWaalsContact C-N 3.28Å; E55-A57 PolarHBondContact O-N 3Å; A57-K60 CarbonylContact O-C 3.59Å; A57-K60 WeakPolarHBondContact O-CB 3.44Å; A57-K60 PolarHBondContact O-N 3.08Å; A57-K60 VanDerWaalsContact O-N 3.14Å; A57-A61 PolarHBondContact O-N 3.47Å
58	A	70.8	Confident	67.1	Low	63 Å²	63	107.6 Å²	107.6	52%	0.521	55%	0.55	S	S	.	*	H	α-helix	trans	-60.4	-45.4	176.2	0	0	0	0	0	111.9	E54 E55 K60 A61 G62	E54-A58 PolarHBondContact O-N 2.9Å; E55-A58 PolarHBondContact O-N 3.43Å; A58-K60 VanDerWaalsContact C-N 3.29Å; A58-K60 PolarHBondContact O-N 3.24Å; A58-A61 WeakPolarHBondContact O-CB 3.47Å; A58-A61 PolarHBondContact O-N 2.91Å; A58-A61 VanDerWaalsContact O-N 3.15Å; A58-G62 PolarHBondContact O-N 3.32Å
59	L	67.6	Low	68.1	Low	117 Å²	117	106.3 Å²	106.3	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-63.8	-31.9	175	-72.4	168.8	0	0	0	112.7	E55 N63	E55-L59 HydrophobicContact CG-CD1 4.29Å; E55-L59 WeakPolarHBondContact O-CB 3.33Å; E55-L59 WeakPolarHBondContact O-CG 3.12Å; E55-L59 PolarHBondContact O-N 2.9Å; L59-N63 WeakPolarHBondContact O-CB 3.42Å; L59-N63 PolarHBondContact O-N 3.46Å
60	K	71.1	Confident	69.1	Low	138 Å²	138	107.8 Å²	107.8	60%	0.6	55%	0.55	S	S	*	*	H	α-helix	trans	-73.4	-36.4	172.3	-74.7	168.8	-170.2	164.2	0	112.2	L56 A57 A58 N63 Q64	L56-K60 VanDerWaalsContact O-CD 3.26Å; L56-K60 WeakPolarHBondContact O-CD 3.49Å; L56-K60 WeakPolarHBondContact O-CG 3.46Å; L56-K60 PolarHBondContact O-N 2.93Å; A57-K60 CarbonylContact O-C 3.59Å; A57-K60 WeakPolarHBondContact O-CB 3.44Å; A57-K60 PolarHBondContact O-N 3.08Å; A57-K60 VanDerWaalsContact O-N 3.14Å; A58-K60 VanDerWaalsContact C-N 3.29Å; A58-K60 PolarHBondContact O-N 3.24Å; K60-N63 PolarHBondContact O-N 3.37Å; K60-Q64 WeakPolarHBondContact O-CG 3.36Å; K60-Q64 PolarHBondContact O-N 2.95Å
61	A	70.2	Confident	70	Confident	49 Å²	49	107.9 Å²	107.9	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-49.8	174.9	0	0	0	0	0	111.2	A57 A58 N63 Q64 E65	A57-A61 PolarHBondContact O-N 3.47Å; A58-A61 WeakPolarHBondContact O-CB 3.47Å; A58-A61 PolarHBondContact O-N 2.91Å; A58-A61 VanDerWaalsContact O-N 3.15Å; A61-N63 VanDerWaalsContact C-N 3.25Å; A61-N63 PolarHBondContact O-N 3.02Å; A61-Q64 CarbonylContact O-C 3.53Å; A61-Q64 WeakPolarHBondContact O-CA 3.38Å; A61-Q64 WeakPolarHBondContact O-CB 3.35Å; A61-Q64 PolarHBondContact O-N 2.97Å; A61-E65 PolarHBondContact O-N 3.06Å
62	G	74.2	Confident	70.5	Confident	27 Å²	27	108.1 Å²	108.1	28%	0.278	54%	0.539	S	S	.	.	H	α-helix	trans	-59.6	-33.9	174.7	0	0	0	0	0	113.1	A58 Q64 E65 L66	A58-G62 PolarHBondContact O-N 3.32Å; G62-Q64 VanDerWaalsContact C-N 3.34Å; G62-E65 PolarHBondContact O-N 2.99Å; G62-L66 WeakPolarHBondContact O-CB 3.37Å; G62-L66 WeakPolarHBondContact O-CG 3.49Å; G62-L66 PolarHBondContact O-N 2.87Å
63	N	72.6	Confident	70.6	Confident	80 Å²	80	109.5 Å²	109.5	43%	0.428	55%	0.55	S	S	.	.	H	α-helix	trans	-69.1	-29.6	172.9	-159.1	-87	0	0	0	113	L59 K60 A61 K67	L59-N63 WeakPolarHBondContact O-CB 3.42Å; L59-N63 PolarHBondContact O-N 3.46Å; K60-N63 PolarHBondContact O-N 3.37Å; A61-N63 VanDerWaalsContact C-N 3.25Å; A61-N63 PolarHBondContact O-N 3.02Å; N63-K67 WeakPolarHBondContact O-CD 3.41Å; N63-K67 WeakPolarHBondContact O-CG 3.42Å; N63-K67 PolarHBondContact O-N 3.4Å; N63-K67 WeakPolarHBondContact OD1-CE 3.45Å; N63-K67 PolarHBondContact OD1-NZ 3.33Å
64	Q	69.6	Low	70.1	Confident	143 Å²	143	109.3 Å²	109.3	67%	0.668	55%	0.549	S	S	*	.	H	α-helix	trans	-74.9	-39.4	171	-72.4	-176.1	-1.5	0	0	112	K60 A61 G62 K67 K68	K60-Q64 WeakPolarHBondContact O-CG 3.36Å; K60-Q64 PolarHBondContact O-N 2.95Å; A61-Q64 CarbonylContact O-C 3.53Å; A61-Q64 WeakPolarHBondContact O-CA 3.38Å; A61-Q64 WeakPolarHBondContact O-CB 3.35Å; A61-Q64 PolarHBondContact O-N 2.97Å; G62-Q64 VanDerWaalsContact C-N 3.34Å; Q64-K67 PolarHBondContact O-N 3.19Å; Q64-K68 WeakPolarHBondContact O-CB 3.48Å; Q64-K68 PolarHBondContact O-N 3.37Å
65	E	71.8	Confident	69.5	Low	122 Å²	122	106.9 Å²	106.9	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-45.1	173.9	-70.1	-162.7	122.1	0	0	112.1	A61 G62 K67 K68 M69	A61-E65 PolarHBondContact O-N 3.06Å; G62-E65 PolarHBondContact O-N 2.99Å; E65-K67 VanDerWaalsContact C-N 3.26Å; E65-K67 PolarHBondContact O-N 3.37Å; E65-K68 CarbonylContact O-C 3.56Å; E65-K68 WeakPolarHBondContact O-CA 3.38Å; E65-K68 WeakPolarHBondContact O-CB 2.84Å; E65-K68 PolarHBondContact O-N 3.16Å; E65-M69 HydrophobicContact CB-CE 4.06Å; E65-M69 WeakPolarHBondContact O-CG 3.42Å; E65-M69 PolarHBondContact O-N 3.44Å
66	L	70.8	Confident	68.6	Low	113 Å²	113	103.6 Å²	103.6	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-59.6	-36.2	174.1	-76.2	167.7	0	0	0	112.3	G62 K70	G62-L66 WeakPolarHBondContact O-CB 3.37Å; G62-L66 WeakPolarHBondContact O-CG 3.49Å; G62-L66 PolarHBondContact O-N 2.87Å; L66-K70 WeakPolarHBondContact O-CB 3.24Å; L66-K70 PolarHBondContact O-N 2.93Å
67	K	75.3	Confident	67.7	Low	134 Å²	134	102.8 Å²	102.8	58%	0.583	55%	0.549	S	S	*	.	H	α-helix	trans	-70.1	-30.9	172.3	-78.5	166.6	177.8	152.5	0	112.8	N63 Q64 E65 K71	N63-K67 WeakPolarHBondContact O-CD 3.41Å; N63-K67 WeakPolarHBondContact O-CG 3.42Å; N63-K67 PolarHBondContact O-N 3.4Å; N63-K67 WeakPolarHBondContact OD1-CE 3.45Å; N63-K67 PolarHBondContact OD1-NZ 3.33Å; Q64-K67 PolarHBondContact O-N 3.19Å; E65-K67 VanDerWaalsContact C-N 3.26Å; E65-K67 PolarHBondContact O-N 3.37Å; K67-K71 VanDerWaalsContact O-CB 3.29Å; K67-K71 WeakPolarHBondContact O-CB 3.39Å; K67-K71 PolarHBondContact O-N 3.11Å
68	K	73.8	Confident	66.4	Low	141 Å²	141	106 Å²	106	61%	0.613	56%	0.563	S	S	*	*	H	α-helix	trans	-70.1	-56.1	175.1	-157	-177.8	177.9	-168.9	0	110.1	Q64 E65 K70 K71 D72	Q64-K68 WeakPolarHBondContact O-CB 3.48Å; Q64-K68 PolarHBondContact O-N 3.37Å; E65-K68 CarbonylContact O-C 3.56Å; E65-K68 WeakPolarHBondContact O-CA 3.38Å; E65-K68 WeakPolarHBondContact O-CB 2.84Å; E65-K68 PolarHBondContact O-N 3.16Å; K68-K70 VanDerWaalsContact C-N 3.29Å; K68-K70 PolarHBondContact O-N 3.21Å; K68-K71 CarbonylContact O-C 3.57Å; K68-K71 WeakPolarHBondContact O-CA 3.44Å; K68-K71 WeakPolarHBondContact O-CB 3.34Å; K68-K71 PolarHBondContact O-N 3.13Å; K68-D72 PolarHBondContact O-N 3.49Å
69	M	68	Low	64.9	Low	112 Å²	112	111.3 Å²	111.3	55%	0.552	58%	0.577	S	S	*	*	H	α-helix	trans	-53.1	-44.1	174	-63.3	-178.6	-142.6	0	0	112.3	E65 K71 D72 F73	E65-M69 HydrophobicContact CB-CE 4.06Å; E65-M69 WeakPolarHBondContact O-CG 3.42Å; E65-M69 PolarHBondContact O-N 3.44Å; M69-K71 PolarHBondContact O-N 3.25Å; M69-D72 PolarHBondContact O-N 3.05Å; M69-F73 WeakPolarHBondContact O-CB 3.46Å; M69-F73 PolarHBondContact O-N 3.37Å
70	K	73.4	Confident	63.5	Low	117 Å²	117	112 Å²	112	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-62.9	-40.7	176	-174.5	172.5	-179.2	-70.4	0	112.1	L66 K68 E74	L66-K70 WeakPolarHBondContact O-CB 3.24Å; L66-K70 PolarHBondContact O-N 2.93Å; K68-K70 VanDerWaalsContact C-N 3.29Å; K68-K70 PolarHBondContact O-N 3.21Å; K70-E74 HydrophobicContact CG-CG 4.47Å; K70-E74 IonicContact NZ-OE1 2.6Å; K70-E74 PolarHBondContact NZ-OE1 3.3Å; K70-E74 IonicContact NZ-OE2 3.61Å; K70-E74 PolarHBondContact NZ-OE2 3.14Å; K70-E74 VanDerWaalsContact O-CB 3.31Å; K70-E74 WeakPolarHBondContact O-CB 3.46Å; K70-E74 VanDerWaalsContact O-CG 3.26Å; K70-E74 WeakPolarHBondContact O-CG 3.41Å; K70-E74 PolarHBondContact O-N 3.42Å
71	K	74.6	Confident	62.7	Low	134 Å²	134	110.8 Å²	110.8	58%	0.583	58%	0.58	S	S	*	*	H	α-helix	trans	-69	-38.8	175.9	-174.3	179.3	179	-174.8	0	112.7	K67 K68 M69 F73 E74 T75	K67-K71 VanDerWaalsContact O-CB 3.29Å; K67-K71 WeakPolarHBondContact O-CB 3.39Å; K67-K71 PolarHBondContact O-N 3.11Å; K68-K71 CarbonylContact O-C 3.57Å; K68-K71 WeakPolarHBondContact O-CA 3.44Å; K68-K71 WeakPolarHBondContact O-CB 3.34Å; K68-K71 PolarHBondContact O-N 3.13Å; M69-K71 PolarHBondContact O-N 3.25Å; K71-F73 VanDerWaalsContact C-N 3.31Å; K71-E74 PolarHBondContact O-N 3.1Å; K71-T75 HydrophobicContact CG-CG2 4.33Å; K71-T75 WeakPolarHBondContact O-CB 3.35Å; K71-T75 WeakPolarHBondContact O-CG2 3.41Å; K71-T75 PolarHBondContact O-N 3.23Å; K71-T75 PolarHBondContact O-OG1 2.92Å
72	D	72	Confident	61.7	Low	79 Å²	79	116.1 Å²	116.1	42%	0.422	60%	0.596	S	S	.	*	H	α-helix	trans	-67.8	-35.7	178.8	-58.3	-27.6	0	0	0	110.2	K68 M69 T75 G76	K68-D72 PolarHBondContact O-N 3.49Å; M69-D72 PolarHBondContact O-N 3.05Å; D72-T75 PolarHBondContact O-OG1 3.44Å; D72-G76 PolarHBondContact O-N 2.89Å
73	F	61.5	Low	60.7	Low	184 Å²	184	122.4 Å²	122.4	81%	0.807	62%	0.624	S	S	*	*	H	α-helix	trans	-67.9	-47.6	168.6	-165.3	-95.1	0	0	0	112.6	M69 K71 T75 G76	M69-F73 WeakPolarHBondContact O-CB 3.46Å; M69-F73 PolarHBondContact O-N 3.37Å; K71-F73 VanDerWaalsContact C-N 3.31Å; F73-T75 VanDerWaalsContact C-N 3.26Å; F73-T75 PolarHBondContact O-N 3Å; F73-G76 PolarHBondContact O-N 3.01Å
74	E	57.7	Low	59.7	Low	132 Å²	132	121.7 Å²	121.7	62%	0.617	62%	0.618	S	S	*	*	H	α-helix	trans	-67.8	-19.9	179.4	-76.6	178.2	144.4	0	0	114.1	K70 K71	K70-E74 HydrophobicContact CG-CG 4.47Å; K70-E74 IonicContact NZ-OE1 2.6Å; K70-E74 PolarHBondContact NZ-OE1 3.3Å; K70-E74 IonicContact NZ-OE2 3.61Å; K70-E74 PolarHBondContact NZ-OE2 3.14Å; K70-E74 VanDerWaalsContact O-CB 3.31Å; K70-E74 WeakPolarHBondContact O-CB 3.46Å; K70-E74 VanDerWaalsContact O-CG 3.26Å; K70-E74 WeakPolarHBondContact O-CG 3.41Å; K70-E74 PolarHBondContact O-N 3.42Å; K71-E74 PolarHBondContact O-N 3.1Å
75	T	56.2	Low	59.3	Low	90 Å²	90	121 Å²	121	55%	0.552	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-0.1	175.4	52	0	0	0	0	113.8	K71 D72 F73 A77	K71-T75 HydrophobicContact CG-CG2 4.33Å; K71-T75 WeakPolarHBondContact O-CB 3.35Å; K71-T75 WeakPolarHBondContact O-CG2 3.41Å; K71-T75 PolarHBondContact O-N 3.23Å; K71-T75 PolarHBondContact O-OG1 2.92Å; D72-T75 PolarHBondContact O-OG1 3.44Å; F73-T75 VanDerWaalsContact C-N 3.26Å; F73-T75 PolarHBondContact O-N 3Å; T75-A77 VanDerWaalsContact C-N 3.29Å; T75-A77 PolarHBondContact O-N 3.37Å
76	G	51.4	Low	58.8	Low	55 Å²	55	120.3 Å²	120.3	57%	0.567	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.1	29.6	171.7	0	0	0	0	0	114.4	D72 F73 V78	D72-G76 PolarHBondContact O-N 2.89Å; F73-G76 PolarHBondContact O-N 3.01Å; G76-V78 PolarHBondContact O-N 2.8Å
77	A	49.8	Very low	58.3	Low	72 Å²	72	123 Å²	123	60%	0.595	63%	0.628	S	S	*	*			trans	-75.5	57	-172.3	0	0	0	0	0	113.6	T75 H79	T75-A77 VanDerWaalsContact C-N 3.29Å; T75-A77 PolarHBondContact O-N 3.37Å; A77-H79 PolarHBondContact O-N 3.13Å
78	V	41.6	Very low	57.6	Low	123 Å²	123	119.2 Å²	119.2	75%	0.745	62%	0.617	S	S	*	*			trans	-65.4	118.4	168.5	-178.1	0	0	0	0	108.3	G76 N80	G76-V78 PolarHBondContact O-N 2.8Å; V78-N80 PolarHBondContact O-N 2.86Å
79	H	39.4	Very low	57.1	Low	176 Å²	176	116.7 Å²	116.7	82%	0.815	61%	0.606	S	S	*	*			trans	-68.9	119.7	173.5	-125.3	72	0	0	0	109	A77 I81	A77-H79 PolarHBondContact O-N 3.13Å; H79-I81 PolarHBondContact O-N 2.91Å; H79-I81 VanDerWaalsContact O-N 3.13Å
80	N	39	Very low	57	Low	130 Å²	130	116 Å²	116	70%	0.695	60%	0.604	S	S	*	*			trans	-68.7	109.8	176.1	-78.5	-16.6	0	0	0	109.9	V78 E82	V78-N80 PolarHBondContact O-N 2.86Å; N80-E82 PolarHBondContact O-N 3.28Å
81	I	54.1	Low	56.8	Low	113 Å²	113	113.2 Å²	113.2	58%	0.579	60%	0.602	S	S	*	*			trans	-78.4	74.4	177.3	-51.3	175.6	0	0	0	109.3	H79 E84	H79-I81 PolarHBondContact O-N 2.91Å; H79-I81 VanDerWaalsContact O-N 3.13Å; I81-E84 WeakPolarHBondContact CG2-OE2 3.4Å
82	E	49.7	Very low	56.4	Low	161 Å²	161	112.7 Å²	112.7	75%	0.752	60%	0.597	S	S	*	*	S	Bend	trans	-115.6	-10.1	174.6	-66	-168	139.7	0	0	113.3	N80	N80-E82 PolarHBondContact O-N 3.28Å
83	N	53.3	Low	56	Low	160 Å²	160	113.5 Å²	113.5	86%	0.856	60%	0.6	S	S	*	*	S	Bend	trans	-142.7	80.8	174.7	-65.8	-87.3	0	0	0	111.2
84	E	50.3	Low	56.4	Low	64 Å²	64	109.2 Å²	109.2	30%	0.299	58%	0.583	S	S	.	*			trans	-134.3	133.4	165.1	-78.1	-176.3	139.8	0	0	108	I81 K89 R92	I81-E84 WeakPolarHBondContact CG2-OE2 3.4Å; E84-K89 WeakPolarHBondContact O-CE 3.49Å; E84-K89 PolarHBondContact O-NZ 2.9Å; E84-R92 IonicContact OE1-CZ 3.16Å; E84-R92 IonicContact OE1-NH1 2.61Å; E84-R92 PolarHBondContact OE1-NH1 3.43Å; E84-R92 IonicContact OE1-NH2 3Å; E84-R92 PolarHBondContact OE1-NH2 2.89Å; E84-R92 IonicContact OE2-CZ 3.23Å; E84-R92 IonicContact OE2-NH1 3.49Å; E84-R92 PolarHBondContact OE2-NH1 2.95Å; E84-R92 IonicContact OE2-NH2 3.55Å
85	D	62.4	Low	56.9	Low	128 Å²	128	108.7 Å²	108.7	68%	0.684	58%	0.58	S	S	*	*			trans	-65.8	151.8	-172	-59.1	-73.4	0	0	0	113.2	E87 T88 K89	D85-E87 VanDerWaalsContact C-N 3.27Å; D85-E87 PolarHBondContact O-N 3.4Å; D85-T88 WeakPolarHBondContact O-CB 3.48Å; D85-T88 PolarHBondContact O-N 2.93Å; D85-T88 PolarHBondContact O-OG1 3.04Å; D85-K89 PolarHBondContact O-N 3.14Å
86	D	59.7	Low	57.2	Low	109 Å²	109	112.6 Å²	112.6	58%	0.583	59%	0.585	S	S	*	*	H	α-helix	trans	-64.3	-26.5	-170.3	-68.6	-38.3	0	0	0	114.1	T88 K89 I90	D86-T88 VanDerWaalsContact C-N 3.28Å; D86-T88 PolarHBondContact O-N 3.24Å; D86-K89 PolarHBondContact O-N 3.42Å; D86-K89 IonicContact OD1-NZ 2.69Å; D86-K89 PolarHBondContact OD1-NZ 3.29Å; D86-I90 VanDerWaalsContact O-CG1 3.29Å; D86-I90 WeakPolarHBondContact O-CG1 3.3Å; D86-I90 PolarHBondContact O-N 3.36Å
87	E	60.2	Low	57.8	Low	168 Å²	168	115.4 Å²	115.4	79%	0.785	58%	0.583	S	S	*	*	H	α-helix	trans	-58.9	-38.2	168.9	-73.5	-170.7	121.1	0	0	112.3	D85 K89 I90 A91	D85-E87 VanDerWaalsContact C-N 3.27Å; D85-E87 PolarHBondContact O-N 3.4Å; E87-K89 VanDerWaalsContact C-N 3.35Å; E87-I90 PolarHBondContact O-N 3.39Å; E87-A91 WeakPolarHBondContact O-CB 3.2Å; E87-A91 PolarHBondContact O-N 2.95Å
88	T	61.1	Low	58.8	Low	56 Å²	56	116.6 Å²	116.6	34%	0.344	58%	0.575	S	S	.	*	H	α-helix	trans	-71.2	-32.6	178.7	72.4	0	0	0	0	111.9	D85 D86 R92	D85-T88 WeakPolarHBondContact O-CB 3.48Å; D85-T88 PolarHBondContact O-N 2.93Å; D85-T88 PolarHBondContact O-OG1 3.04Å; D86-T88 VanDerWaalsContact C-N 3.28Å; D86-T88 PolarHBondContact O-N 3.24Å; T88-R92 PolarHBondContact O-N 3.11Å
89	K	63.4	Low	59.4	Low	87 Å²	87	115.9 Å²	115.9	38%	0.378	57%	0.567	S	S	.	*	H	α-helix	trans	-68.8	-43.7	172.9	-55.6	-169.8	-170.4	84.4	0	110.8	E84 D85 D86 E87 R92 L93	E84-K89 WeakPolarHBondContact O-CE 3.49Å; E84-K89 PolarHBondContact O-NZ 2.9Å; D85-K89 PolarHBondContact O-N 3.14Å; D86-K89 PolarHBondContact O-N 3.42Å; D86-K89 IonicContact OD1-NZ 2.69Å; D86-K89 PolarHBondContact OD1-NZ 3.29Å; E87-K89 VanDerWaalsContact C-N 3.35Å; K89-R92 PolarHBondContact O-N 3.48Å; K89-L93 WeakPolarHBondContact O-CB 3.19Å; K89-L93 VanDerWaalsContact O-CG 3.24Å; K89-L93 WeakPolarHBondContact O-CG 3.22Å; K89-L93 PolarHBondContact O-N 3.2Å
90	I	66.9	Low	60.3	Low	99 Å²	99	111 Å²	111	51%	0.508	55%	0.549	S	S	.	.	H	α-helix	trans	-62.4	-44.9	175	-68.3	163.9	0	0	0	110.3	D86 E87 R92 L93 E94	D86-I90 VanDerWaalsContact O-CG1 3.29Å; D86-I90 WeakPolarHBondContact O-CG1 3.3Å; D86-I90 PolarHBondContact O-N 3.36Å; E87-I90 PolarHBondContact O-N 3.39Å; I90-R92 PolarHBondContact O-N 2.88Å; I90-L93 CarbonylContact O-C 3.36Å; I90-L93 PolarHBondContact O-N 2.91Å; I90-L93 VanDerWaalsContact O-N 3.13Å; I90-E94 PolarHBondContact O-N 3.09Å
91	A	68.8	Low	61.5	Low	58 Å²	58	110 Å²	110	48%	0.479	54%	0.54	S	S	.	.	H	α-helix	trans	-60.7	-46	176.7	0	0	0	0	0	112.6	E87 L93 E94 E95	E87-A91 WeakPolarHBondContact O-CB 3.2Å; E87-A91 PolarHBondContact O-N 2.95Å; A91-L93 VanDerWaalsContact C-N 3.32Å; A91-L93 PolarHBondContact O-N 2.88Å; A91-E94 PolarHBondContact O-N 2.88Å; A91-E95 WeakPolarHBondContact O-CB 3.47Å; A91-E95 PolarHBondContact O-N 3Å
92	R	66.1	Low	61.9	Low	123 Å²	123	108.4 Å²	108.4	46%	0.464	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-31.5	173.4	-76.6	-160.7	-168	117.3	3	112.8	E84 T88 K89 I90 R96	E84-R92 IonicContact OE1-CZ 3.16Å; E84-R92 IonicContact OE1-NH1 2.61Å; E84-R92 PolarHBondContact OE1-NH1 3.43Å; E84-R92 IonicContact OE1-NH2 3Å; E84-R92 PolarHBondContact OE1-NH2 2.89Å; E84-R92 IonicContact OE2-CZ 3.23Å; E84-R92 IonicContact OE2-NH1 3.49Å; E84-R92 PolarHBondContact OE2-NH1 2.95Å; E84-R92 IonicContact OE2-NH2 3.55Å; T88-R92 PolarHBondContact O-N 3.11Å; K89-R92 PolarHBondContact O-N 3.48Å; I90-R92 PolarHBondContact O-N 2.88Å; R92-R96 WeakPolarHBondContact O-CB 3.44Å; R92-R96 PolarHBondContact O-N 3.2Å
93	L	62.8	Low	62.8	Low	96 Å²	96	102.3 Å²	102.3	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-71.2	-41.3	175.1	-75.9	169.4	0	0	0	111.7	K89 I90 A91 R96 Q97	K89-L93 WeakPolarHBondContact O-CB 3.19Å; K89-L93 VanDerWaalsContact O-CG 3.24Å; K89-L93 WeakPolarHBondContact O-CG 3.22Å; K89-L93 PolarHBondContact O-N 3.2Å; I90-L93 CarbonylContact O-C 3.36Å; I90-L93 PolarHBondContact O-N 2.91Å; I90-L93 VanDerWaalsContact O-N 3.13Å; A91-L93 VanDerWaalsContact C-N 3.32Å; A91-L93 PolarHBondContact O-N 2.88Å; L93-R96 PolarHBondContact O-N 2.88Å; L93-Q97 WeakPolarHBondContact O-CB 3.41Å; L93-Q97 VanDerWaalsContact O-CG 3.31Å; L93-Q97 WeakPolarHBondContact O-CG 3.25Å; L93-Q97 PolarHBondContact O-N 3.16Å
94	E	70.6	Confident	63	Low	93 Å²	93	101.2 Å²	101.2	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-45.6	171	-92.8	-160.9	-165.5	0	0	112	I90 A91 R96 Q97 K98	I90-E94 PolarHBondContact O-N 3.09Å; A91-E94 PolarHBondContact O-N 2.88Å; E94-R96 VanDerWaalsContact C-N 3.31Å; E94-R96 PolarHBondContact O-N 2.82Å; E94-Q97 PolarHBondContact O-N 3.22Å; E94-K98 WeakPolarHBondContact O-CB 3.46Å; E94-K98 WeakPolarHBondContact O-CD 3.3Å; E94-K98 VanDerWaalsContact O-CG 3.22Å; E94-K98 WeakPolarHBondContact O-CG 3.28Å; E94-K98 PolarHBondContact O-N 3.05Å; E94-K98 IonicContact OE2-NZ 2.67Å; E94-K98 PolarHBondContact OE2-NZ 3.07Å
95	E	69.1	Low	63.8	Low	122 Å²	122	103.3 Å²	103.3	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-41.8	177.4	-175.2	176.6	-148.6	0	0	110.8	A91 K98 L99	A91-E95 WeakPolarHBondContact O-CB 3.47Å; A91-E95 PolarHBondContact O-N 3Å; E95-K98 PolarHBondContact O-N 3.32Å; E95-L99 HydrophobicContact CG-CD1 4.34Å; E95-L99 WeakPolarHBondContact O-CB 3.45Å; E95-L99 VanDerWaalsContact O-CG 3.29Å; E95-L99 WeakPolarHBondContact O-CG 3.38Å; E95-L99 PolarHBondContact O-N 3.36Å
96	R	62.2	Low	64.1	Low	172 Å²	172	103.5 Å²	103.5	65%	0.649	51%	0.507	S	S	*	.	H	α-helix	trans	-69	-34.1	175.2	-172.8	165.6	172.4	-102	1	112.5	R92 L93 E94 L99 T100	R92-R96 WeakPolarHBondContact O-CB 3.44Å; R92-R96 PolarHBondContact O-N 3.2Å; L93-R96 PolarHBondContact O-N 2.88Å; E94-R96 VanDerWaalsContact C-N 3.31Å; E94-R96 PolarHBondContact O-N 2.82Å; R96-L99 PolarHBondContact O-N 3.22Å; R96-T100 WeakPolarHBondContact O-CG2 3.36Å; R96-T100 PolarHBondContact O-N 3.1Å; R96-T100 PolarHBondContact O-OG1 3.1Å
97	Q	64.3	Low	64	Low	113 Å²	113	105.8 Å²	105.8	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-50.2	170.6	-82.8	174	-29.4	0	0	110.8	L93 E94 L99 T100 E101	L93-Q97 WeakPolarHBondContact O-CB 3.41Å; L93-Q97 VanDerWaalsContact O-CG 3.31Å; L93-Q97 WeakPolarHBondContact O-CG 3.25Å; L93-Q97 PolarHBondContact O-N 3.16Å; E94-Q97 PolarHBondContact O-N 3.22Å; Q97-L99 VanDerWaalsContact C-N 3.27Å; Q97-L99 PolarHBondContact O-N 3.41Å; Q97-T100 WeakPolarHBondContact CA-OG1 3.32Å; Q97-T100 CarbonylContact O-C 3.28Å; Q97-T100 WeakPolarHBondContact O-CA 3.45Å; Q97-T100 PolarHBondContact O-N 3.49Å; Q97-T100 PolarHBondContact O-OG1 3.42Å; Q97-E101 WeakPolarHBondContact O-CG 3.49Å; Q97-E101 PolarHBondContact O-N 2.73Å
98	K	69.4	Low	64.3	Low	98 Å²	98	101 Å²	101	43%	0.426	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-37.1	175.5	-68.4	159.5	-165.8	170.4	0	111.8	E94 E95 E101 I102	E94-K98 WeakPolarHBondContact O-CB 3.46Å; E94-K98 WeakPolarHBondContact O-CD 3.3Å; E94-K98 VanDerWaalsContact O-CG 3.22Å; E94-K98 WeakPolarHBondContact O-CG 3.28Å; E94-K98 PolarHBondContact O-N 3.05Å; E94-K98 IonicContact OE2-NZ 2.67Å; E94-K98 PolarHBondContact OE2-NZ 3.07Å; E95-K98 PolarHBondContact O-N 3.32Å; K98-E101 PolarHBondContact O-N 2.7Å; K98-I102 VanDerWaalsContact O-CB 3.3Å; K98-I102 WeakPolarHBondContact O-CB 3.32Å; K98-I102 WeakPolarHBondContact O-CD1 3.47Å; K98-I102 WeakPolarHBondContact O-CG1 3.42Å; K98-I102 PolarHBondContact O-N 2.78Å
99	L	55.3	Low	64.4	Low	108 Å²	108	104.3 Å²	104.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-67.6	-35.4	171.5	-75.2	168.3	0	0	0	112.8	E95 R96 Q97 G103	E95-L99 HydrophobicContact CG-CD1 4.34Å; E95-L99 WeakPolarHBondContact O-CB 3.45Å; E95-L99 VanDerWaalsContact O-CG 3.29Å; E95-L99 WeakPolarHBondContact O-CG 3.38Å; E95-L99 PolarHBondContact O-N 3.36Å; R96-L99 PolarHBondContact O-N 3.22Å; Q97-L99 VanDerWaalsContact C-N 3.27Å; Q97-L99 PolarHBondContact O-N 3.41Å; L99-G103 PolarHBondContact O-N 3.39Å
100	T	57.5	Low	64.3	Low	72 Å²	72	107.2 Å²	107.2	44%	0.442	52%	0.519	S	S	.	.	H	α-helix	trans	-73.9	-30.1	171.1	53.2	0	0	0	0	113.6	R96 Q97 G103 Q104	R96-T100 WeakPolarHBondContact O-CG2 3.36Å; R96-T100 PolarHBondContact O-N 3.1Å; R96-T100 PolarHBondContact O-OG1 3.1Å; Q97-T100 WeakPolarHBondContact CA-OG1 3.32Å; Q97-T100 CarbonylContact O-C 3.28Å; Q97-T100 WeakPolarHBondContact O-CA 3.45Å; Q97-T100 PolarHBondContact O-N 3.49Å; Q97-T100 PolarHBondContact O-OG1 3.42Å; T100-G103 CarbonylContact O-C 3.52Å; T100-G103 WeakPolarHBondContact O-CA 3.37Å; T100-G103 PolarHBondContact O-N 2.95Å; T100-Q104 WeakPolarHBondContact O-CB 3.46Å; T100-Q104 VanDerWaalsContact O-CG 3.28Å; T100-Q104 WeakPolarHBondContact O-CG 3.42Å; T100-Q104 PolarHBondContact O-N 3.46Å
101	E	63.8	Low	64.3	Low	111 Å²	111	107.8 Å²	107.8	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-71	-46.2	173.4	-71.6	168.7	167.8	0	0	110.6	Q97 K98 G103 Q104 E105	Q97-E101 WeakPolarHBondContact O-CG 3.49Å; Q97-E101 PolarHBondContact O-N 2.73Å; K98-E101 PolarHBondContact O-N 2.7Å; E101-G103 PolarHBondContact O-N 3.43Å; E101-Q104 CarbonylContact O-C 3.57Å; E101-Q104 PolarHBondContact O-N 2.99Å; E101-Q104 VanDerWaalsContact O-N 3.17Å; E101-E105 WeakPolarHBondContact O-CB 3.44Å; E101-E105 PolarHBondContact O-N 2.89Å
102	I	63.6	Low	64.2	Low	78 Å²	78	108.1 Å²	108.1	40%	0.4	51%	0.514	S	S	.	.	H	α-helix	trans	-59.5	-35.3	168.6	-69.7	164.7	0	0	0	110.4	K98 K106	K98-I102 VanDerWaalsContact O-CB 3.3Å; K98-I102 WeakPolarHBondContact O-CB 3.32Å; K98-I102 WeakPolarHBondContact O-CD1 3.47Å; K98-I102 WeakPolarHBondContact O-CG1 3.42Å; K98-I102 PolarHBondContact O-N 2.78Å; I102-K106 HydrophobicContact CG2-CD 3.96Å; I102-K106 VanDerWaalsContact O-CB 3.26Å; I102-K106 WeakPolarHBondContact O-CB 3.49Å; I102-K106 WeakPolarHBondContact O-CD 3.26Å; I102-K106 WeakPolarHBondContact O-CG 3.36Å; I102-K106 PolarHBondContact O-N 2.92Å
103	G	67.4	Low	64.3	Low	33 Å²	33	108.9 Å²	108.9	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-50.3	171.8	0	0	0	0	0	112.5	L99 T100 E101 K106 F107	L99-G103 PolarHBondContact O-N 3.39Å; T100-G103 CarbonylContact O-C 3.52Å; T100-G103 WeakPolarHBondContact O-CA 3.37Å; T100-G103 PolarHBondContact O-N 2.95Å; E101-G103 PolarHBondContact O-N 3.43Å; G103-K106 CarbonylContact O-C 3.59Å; G103-K106 PolarHBondContact O-N 3.13Å; G103-F107 WeakPolarHBondContact O-CB 3.21Å; G103-F107 PolarHBondContact O-N 3.2Å
104	Q	58.8	Low	64.3	Low	137 Å²	137	110.6 Å²	110.6	64%	0.64	53%	0.525	S	S	*	.	H	α-helix	trans	-69.5	-35.4	178.9	-74.3	173.8	12	0	0	112.5	T100 E101 F107 S108	T100-Q104 WeakPolarHBondContact O-CB 3.46Å; T100-Q104 VanDerWaalsContact O-CG 3.28Å; T100-Q104 WeakPolarHBondContact O-CG 3.42Å; T100-Q104 PolarHBondContact O-N 3.46Å; E101-Q104 CarbonylContact O-C 3.57Å; E101-Q104 PolarHBondContact O-N 2.99Å; E101-Q104 VanDerWaalsContact O-N 3.17Å; Q104-F107 CarbonylContact O-C 3.45Å; Q104-F107 PolarHBondContact O-N 3.24Å; Q104-S108 WeakPolarHBondContact O-CB 3.39Å; Q104-S108 PolarHBondContact O-N 2.83Å
105	E	66.1	Low	64.1	Low	108 Å²	108	110.9 Å²	110.9	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-46.8	169.2	-84	-154	169.2	0	0	110.9	E101 F107 S108 K109	E101-E105 WeakPolarHBondContact O-CB 3.44Å; E101-E105 PolarHBondContact O-N 2.89Å; E105-F107 VanDerWaalsContact C-N 3.28Å; E105-F107 PolarHBondContact O-N 3.22Å; E105-S108 PolarHBondContact O-N 3.2Å; E105-K109 VanDerWaalsContact O-CB 3.25Å; E105-K109 WeakPolarHBondContact O-CB 3.12Å; E105-K109 WeakPolarHBondContact O-CD 3.47Å; E105-K109 WeakPolarHBondContact O-CG 3.39Å; E105-K109 PolarHBondContact O-N 3.21Å; E105-K109 IonicContact OE2-NZ 2.59Å; E105-K109 PolarHBondContact OE2-NZ 2.92Å
106	K	69.9	Low	63.9	Low	133 Å²	133	109.7 Å²	109.7	58%	0.578	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-38.7	175	-76.9	167.8	-178.3	172.6	0	110.8	I102 G103 K109 F110	I102-K106 HydrophobicContact CG2-CD 3.96Å; I102-K106 VanDerWaalsContact O-CB 3.26Å; I102-K106 WeakPolarHBondContact O-CB 3.49Å; I102-K106 WeakPolarHBondContact O-CD 3.26Å; I102-K106 WeakPolarHBondContact O-CG 3.36Å; I102-K106 PolarHBondContact O-N 2.92Å; G103-K106 CarbonylContact O-C 3.59Å; G103-K106 PolarHBondContact O-N 3.13Å; K106-K109 PolarHBondContact O-N 3.3Å; K106-F110 WeakPolarHBondContact O-CB 3.37Å; K106-F110 PolarHBondContact O-N 3.33Å
107	F	56.6	Low	64.1	Low	157 Å²	157	104.9 Å²	104.9	69%	0.689	51%	0.51	S	S	*	.	H	α-helix	trans	-70.6	-33	176.6	-148.1	-92	0	0	0	112.4	G103 Q104 E105 K111	G103-F107 WeakPolarHBondContact O-CB 3.21Å; G103-F107 PolarHBondContact O-N 3.2Å; Q104-F107 CarbonylContact O-C 3.45Å; Q104-F107 PolarHBondContact O-N 3.24Å; E105-F107 VanDerWaalsContact C-N 3.28Å; E105-F107 PolarHBondContact O-N 3.22Å; F107-K111 WeakPolarHBondContact O-CA 3.4Å; F107-K111 WeakPolarHBondContact O-CB 3.49Å; F107-K111 PolarHBondContact O-N 3.23Å
108	S	67.7	Low	64	Low	68 Å²	68	104.2 Å²	104.2	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-73	-40.6	173.2	-176.3	0	0	0	0	111.4	Q104 E105 F110 K111 T112	Q104-S108 WeakPolarHBondContact O-CB 3.39Å; Q104-S108 PolarHBondContact O-N 2.83Å; E105-S108 PolarHBondContact O-N 3.2Å; S108-F110 VanDerWaalsContact C-N 3.32Å; S108-F110 PolarHBondContact O-N 2.88Å; S108-K111 PolarHBondContact O-N 3Å; S108-T112 WeakPolarHBondContact O-CB 3.5Å; S108-T112 WeakPolarHBondContact O-CG2 3.45Å; S108-T112 PolarHBondContact O-N 2.94Å; S108-T112 PolarHBondContact O-OG1 3.09Å
109	K	63.2	Low	63.7	Low	124 Å²	124	102.5 Å²	102.5	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-68.5	-28.6	172.5	-69.6	161.3	-175.3	171.6	0	112.1	E105 K106 K113	E105-K109 VanDerWaalsContact O-CB 3.25Å; E105-K109 WeakPolarHBondContact O-CB 3.12Å; E105-K109 WeakPolarHBondContact O-CD 3.47Å; E105-K109 WeakPolarHBondContact O-CG 3.39Å; E105-K109 PolarHBondContact O-N 3.21Å; E105-K109 IonicContact OE2-NZ 2.59Å; E105-K109 PolarHBondContact OE2-NZ 2.92Å; K106-K109 PolarHBondContact O-N 3.3Å; K109-K113 WeakPolarHBondContact O-CB 3.47Å; K109-K113 PolarHBondContact O-N 2.95Å
110	F	59.9	Low	64.1	Low	148 Å²	148	101 Å²	101	65%	0.649	51%	0.506	S	S	*	.	H	α-helix	trans	-76.8	-44.6	167.6	-106.3	-91.7	0	0	0	112	K106 S108 K113 F114	K106-F110 WeakPolarHBondContact O-CB 3.37Å; K106-F110 PolarHBondContact O-N 3.33Å; S108-F110 VanDerWaalsContact C-N 3.32Å; S108-F110 PolarHBondContact O-N 2.88Å; F110-K113 CarbonylContact O-C 3.58Å; F110-K113 WeakPolarHBondContact O-CA 3.4Å; F110-K113 WeakPolarHBondContact O-CB 3.34Å; F110-K113 PolarHBondContact O-N 3.49Å; F110-K113 VanDerWaalsContact O-N 3.11Å; F110-F114 WeakPolarHBondContact O-CB 3.4Å; F110-F114 PolarHBondContact O-N 3.48Å
111	K	67.6	Low	64.3	Low	111 Å²	111	102.5 Å²	102.5	48%	0.483	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-48.7	-178.3	176.7	173.3	172.4	176.6	0	111.8	F107 S108 K113 F114 E115	F107-K111 WeakPolarHBondContact O-CA 3.4Å; F107-K111 WeakPolarHBondContact O-CB 3.49Å; F107-K111 PolarHBondContact O-N 3.23Å; S108-K111 PolarHBondContact O-N 3Å; K111-K113 PolarHBondContact O-N 3.31Å; K111-F114 CarbonylContact O-C 3.55Å; K111-F114 WeakPolarHBondContact O-CA 3.39Å; K111-F114 WeakPolarHBondContact O-CB 3.32Å; K111-F114 PolarHBondContact O-N 3.16Å; K111-E115 WeakPolarHBondContact CE-OE1 3.46Å; K111-E115 HydrophobicContact CG-CG 4.34Å; K111-E115 IonicContact NZ-OE1 2.73Å; K111-E115 PolarHBondContact NZ-OE1 3.42Å; K111-E115 WeakPolarHBondContact O-CG 3.4Å; K111-E115 PolarHBondContact O-N 3.03Å
112	T	66.1	Low	64.4	Low	66 Å²	66	102 Å²	102	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-32.8	171.5	50	0	0	0	0	111.8	S108 N116	S108-T112 WeakPolarHBondContact O-CB 3.5Å; S108-T112 WeakPolarHBondContact O-CG2 3.45Å; S108-T112 PolarHBondContact O-N 2.94Å; S108-T112 PolarHBondContact O-OG1 3.09Å; T112-N116 WeakPolarHBondContact O-CB 3.4Å; T112-N116 PolarHBondContact O-N 2.89Å; T112-N116 PolarHBondContact O-ND2 2.95Å; T112-N116 VanDerWaalsContact O-ND2 3.15Å
113	K	68.5	Low	64.7	Low	139 Å²	139	104 Å²	104	60%	0.604	52%	0.518	S	S	*	.	H	α-helix	trans	-74.7	-21.4	171.6	-168.4	171.2	-176.5	-179.8	0	113.4	K109 F110 K111 I117	K109-K113 WeakPolarHBondContact O-CB 3.47Å; K109-K113 PolarHBondContact O-N 2.95Å; F110-K113 CarbonylContact O-C 3.58Å; F110-K113 WeakPolarHBondContact O-CA 3.4Å; F110-K113 WeakPolarHBondContact O-CB 3.34Å; F110-K113 PolarHBondContact O-N 3.49Å; F110-K113 VanDerWaalsContact O-N 3.11Å; K111-K113 PolarHBondContact O-N 3.31Å; K113-I117 HydrophobicContact CG-CD1 4.4Å; K113-I117 VanDerWaalsContact O-CB 3.22Å; K113-I117 WeakPolarHBondContact O-CB 3.18Å; K113-I117 WeakPolarHBondContact O-CD1 3.32Å; K113-I117 WeakPolarHBondContact O-CG1 3.42Å; K113-I117 PolarHBondContact O-N 2.9Å
114	F	63.1	Low	65	Low	131 Å²	131	105.8 Å²	105.8	58%	0.575	52%	0.519	S	S	*	.	H	α-helix	trans	-83.7	-47.3	177	-144.2	-83.1	0	0	0	110.9	F110 K111 N116 I117 D118	F110-F114 WeakPolarHBondContact O-CB 3.4Å; F110-F114 PolarHBondContact O-N 3.48Å; K111-F114 CarbonylContact O-C 3.55Å; K111-F114 WeakPolarHBondContact O-CA 3.39Å; K111-F114 WeakPolarHBondContact O-CB 3.32Å; K111-F114 PolarHBondContact O-N 3.16Å; F114-N116 PolarHBondContact O-N 3.43Å; F114-I117 WeakPolarHBondContact O-CA 3.29Å; F114-I117 WeakPolarHBondContact O-CB 3.47Å; F114-I117 PolarHBondContact O-N 3.39Å; F114-D118 PolarHBondContact O-N 3.45Å
115	E	67.1	Low	65.5	Low	100 Å²	100	101.3 Å²	101.3	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-35	171.6	-66.6	169.5	149.7	0	0	111.1	K111 S119	K111-E115 WeakPolarHBondContact CE-OE1 3.46Å; K111-E115 HydrophobicContact CG-CG 4.34Å; K111-E115 IonicContact NZ-OE1 2.73Å; K111-E115 PolarHBondContact NZ-OE1 3.42Å; K111-E115 WeakPolarHBondContact O-CG 3.4Å; K111-E115 PolarHBondContact O-N 3.03Å; E115-S119 PolarHBondContact O-OG 3.28Å
116	N	63.7	Low	65.9	Low	97 Å²	97	100.8 Å²	100.8	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-82.5	-12	169	-65.1	-16.6	0	0	0	113.9	T112 F114 T120	T112-N116 WeakPolarHBondContact O-CB 3.4Å; T112-N116 PolarHBondContact O-N 2.89Å; T112-N116 PolarHBondContact O-ND2 2.95Å; T112-N116 VanDerWaalsContact O-ND2 3.15Å; F114-N116 PolarHBondContact O-N 3.43Å; N116-T120 VanDerWaalsContact O-CB 3.31Å; N116-T120 WeakPolarHBondContact O-CB 3.42Å; N116-T120 VanDerWaalsContact O-CG2 3.31Å; N116-T120 WeakPolarHBondContact O-CG2 3.38Å; N116-T120 PolarHBondContact O-N 3.47Å; N116-T120 PolarHBondContact O-OG1 3.42Å
117	I	67.1	Low	66	Low	70 Å²	70	99.3 Å²	99.3	36%	0.359	49%	0.492	S	S	.	.	H	α-helix	trans	-74	-45.4	173.6	-97.2	162	0	0	0	109.4	K113 F114 S119 T120 M121	K113-I117 HydrophobicContact CG-CD1 4.4Å; K113-I117 VanDerWaalsContact O-CB 3.22Å; K113-I117 WeakPolarHBondContact O-CB 3.18Å; K113-I117 WeakPolarHBondContact O-CD1 3.32Å; K113-I117 WeakPolarHBondContact O-CG1 3.42Å; K113-I117 PolarHBondContact O-N 2.9Å; F114-I117 WeakPolarHBondContact O-CA 3.29Å; F114-I117 WeakPolarHBondContact O-CB 3.47Å; F114-I117 PolarHBondContact O-N 3.39Å; I117-S119 VanDerWaalsContact C-N 3.3Å; I117-S119 PolarHBondContact O-N 3.49Å; I117-T120 PolarHBondContact O-N 3.17Å; I117-T120 PolarHBondContact O-OG1 3.03Å; I117-M121 HydrophobicContact CG2-CG 4.32Å; I117-M121 WeakPolarHBondContact O-CA 3.47Å; I117-M121 WeakPolarHBondContact O-CB 3.28Å; I117-M121 WeakPolarHBondContact O-CG 3.29Å; I117-M121 PolarHBondContact O-N 2.72Å
118	D	61.1	Low	66.9	Low	99 Å²	99	97.6 Å²	97.6	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-44	174.1	-65.4	-25.1	0	0	0	110.2	F114 T120 M121 D122	F114-D118 PolarHBondContact O-N 3.45Å; D118-T120 PolarHBondContact O-N 3.18Å; D118-M121 PolarHBondContact O-N 2.89Å; D118-D122 PolarHBondContact O-N 3.14Å
119	S	63.2	Low	67	Low	63 Å²	63	98.1 Å²	98.1	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-41.6	176.8	-53.7	0	0	0	0	113.2	E115 I117 E123	E115-S119 PolarHBondContact O-OG 3.28Å; I117-S119 VanDerWaalsContact C-N 3.3Å; I117-S119 PolarHBondContact O-N 3.49Å; S119-E123 WeakPolarHBondContact O-CG 3.45Å; S119-E123 PolarHBondContact O-N 3.44Å
120	T	64.4	Low	67.4	Low	76 Å²	76	97.3 Å²	97.3	47%	0.466	48%	0.478	S	S	.	.	H	α-helix	trans	-82.4	-20.9	177.9	53.7	0	0	0	0	113.5	N116 I117 D118 D124	N116-T120 VanDerWaalsContact O-CB 3.31Å; N116-T120 WeakPolarHBondContact O-CB 3.42Å; N116-T120 VanDerWaalsContact O-CG2 3.31Å; N116-T120 WeakPolarHBondContact O-CG2 3.38Å; N116-T120 PolarHBondContact O-N 3.47Å; N116-T120 PolarHBondContact O-OG1 3.42Å; I117-T120 PolarHBondContact O-N 3.17Å; I117-T120 PolarHBondContact O-OG1 3.03Å; D118-T120 PolarHBondContact O-N 3.18Å; T120-D124 WeakPolarHBondContact O-CB 3.39Å; T120-D124 PolarHBondContact O-N 3.36Å
121	M	61.6	Low	67.8	Low	104 Å²	104	96.4 Å²	96.4	51%	0.512	47%	0.47	S	S	.	.	H	α-helix	trans	-69.3	-43.6	166.4	-79.3	-98.3	50.1	0	0	110.2	I117 D118 L125	I117-M121 HydrophobicContact CG2-CG 4.32Å; I117-M121 WeakPolarHBondContact O-CA 3.47Å; I117-M121 WeakPolarHBondContact O-CB 3.28Å; I117-M121 WeakPolarHBondContact O-CG 3.29Å; I117-M121 PolarHBondContact O-N 2.72Å; D118-M121 PolarHBondContact O-N 2.89Å; M121-L125 WeakPolarHBondContact O-CA 3.26Å; M121-L125 WeakPolarHBondContact O-CB 3.31Å; M121-L125 PolarHBondContact O-N 2.81Å
122	D	66.8	Low	67.4	Low	99 Å²	99	95 Å²	95	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-39.9	172.6	-86.1	-19	0	0	0	111.6	D118 L125 E126	D118-D122 PolarHBondContact O-N 3.14Å; D122-L125 PolarHBondContact O-N 2.85Å; D122-E126 WeakPolarHBondContact O-CB 3.43Å; D122-E126 PolarHBondContact O-N 3.4Å
123	E	69.2	Low	67.1	Low	122 Å²	122	97.5 Å²	97.5	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-66.1	-40.5	173.6	-76.1	-173.5	169.4	0	0	113.2	S119 Q127	S119-E123 WeakPolarHBondContact O-CG 3.45Å; S119-E123 PolarHBondContact O-N 3.44Å; E123-Q127 VanDerWaalsContact O-CB 3.28Å; E123-Q127 WeakPolarHBondContact O-CB 3.37Å; E123-Q127 VanDerWaalsContact O-CG 3.27Å; E123-Q127 WeakPolarHBondContact O-CG 3.36Å; E123-Q127 PolarHBondContact O-N 3.03Å
124	D	74	Confident	66.8	Low	69 Å²	69	98.8 Å²	98.8	37%	0.369	48%	0.479	S	S	.	.	H	α-helix	trans	-73.3	-37.5	174.7	-170.9	62.1	0	0	0	111.3	T120 E126 Q127 K128	T120-D124 WeakPolarHBondContact O-CB 3.39Å; T120-D124 PolarHBondContact O-N 3.36Å; D124-E126 VanDerWaalsContact C-N 3.35Å; D124-Q127 CarbonylContact O-C 3.57Å; D124-Q127 PolarHBondContact O-N 3.34Å; D124-K128 WeakPolarHBondContact O-CA 3.38Å; D124-K128 WeakPolarHBondContact O-CB 3.49Å; D124-K128 PolarHBondContact O-N 2.94Å
125	L	69.4	Low	66.4	Low	44 Å²	44	98.3 Å²	98.3	23%	0.23	48%	0.479	C	S	.	.	H	α-helix	trans	-66.2	-37.8	174.7	-164.6	107.9	0	0	0	110.8	M121 D122 K128 L129	M121-L125 WeakPolarHBondContact O-CA 3.26Å; M121-L125 WeakPolarHBondContact O-CB 3.31Å; M121-L125 PolarHBondContact O-N 2.81Å; D122-L125 PolarHBondContact O-N 2.85Å; L125-K128 CarbonylContact O-C 3.34Å; L125-K128 PolarHBondContact O-N 3.07Å; L125-L129 HydrophobicContact CD2-CD1 3.94Å; L125-L129 HydrophobicContact CG-CD1 4.38Å; L125-L129 VanDerWaalsContact O-CB 3.26Å; L125-L129 WeakPolarHBondContact O-CB 3.47Å; L125-L129 VanDerWaalsContact O-CG 3.23Å; L125-L129 WeakPolarHBondContact O-CG 3.42Å; L125-L129 PolarHBondContact O-N 3.18Å
126	E	73.1	Confident	65.6	Low	97 Å²	97	100.5 Å²	100.5	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-71.9	-36.8	172.8	-155.2	-147.6	-168.8	0	0	111.3	D122 D124 K128 K130	D122-E126 WeakPolarHBondContact O-CB 3.43Å; D122-E126 PolarHBondContact O-N 3.4Å; D124-E126 VanDerWaalsContact C-N 3.35Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 2.66Å; E126-K130 HydrophobicContact CG-CD 4.28Å; E126-K130 WeakPolarHBondContact O-CB 3.33Å; E126-K130 WeakPolarHBondContact O-CD 3.3Å; E126-K130 WeakPolarHBondContact O-CG 3.37Å; E126-K130 PolarHBondContact O-N 3.18Å; E126-K130 WeakPolarHBondContact OE1-CE 3.14Å; E126-K130 IonicContact OE1-NZ 2.66Å; E126-K130 PolarHBondContact OE1-NZ 3Å; E126-K130 WeakPolarHBondContact OE2-CE 3.22Å; E126-K130 IonicContact OE2-NZ 3.63Å; E126-K130 PolarHBondContact OE2-NZ 2.88Å
127	Q	72.8	Confident	65.1	Low	101 Å²	101	101.8 Å²	101.8	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-66.8	-29.1	169.5	-79.4	-172.9	56.6	0	0	113	E123 D124 K130 R131	E123-Q127 VanDerWaalsContact O-CB 3.28Å; E123-Q127 WeakPolarHBondContact O-CB 3.37Å; E123-Q127 VanDerWaalsContact O-CG 3.27Å; E123-Q127 WeakPolarHBondContact O-CG 3.36Å; E123-Q127 PolarHBondContact O-N 3.03Å; D124-Q127 CarbonylContact O-C 3.57Å; D124-Q127 PolarHBondContact O-N 3.34Å; Q127-K130 CarbonylContact O-C 3.57Å; Q127-R131 WeakPolarHBondContact O-CB 3.25Å; Q127-R131 WeakPolarHBondContact O-CG 3.15Å; Q127-R131 PolarHBondContact O-N 2.72Å
128	K	74.8	Confident	64.3	Low	121 Å²	121	101.5 Å²	101.5	53%	0.526	51%	0.509	S	S	.	.	H	α-helix	trans	-84.7	-32.6	-179.7	-171.4	175.2	-173.1	175.9	0	111.4	D124 L125 E126 R131 M132	D124-K128 WeakPolarHBondContact O-CA 3.38Å; D124-K128 WeakPolarHBondContact O-CB 3.49Å; D124-K128 PolarHBondContact O-N 2.94Å; L125-K128 CarbonylContact O-C 3.34Å; L125-K128 PolarHBondContact O-N 3.07Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 2.66Å; K128-R131 PolarHBondContact O-N 2.67Å; K128-M132 WeakPolarHBondContact O-CB 3.33Å; K128-M132 WeakPolarHBondContact O-CG 3.4Å; K128-M132 PolarHBondContact O-N 3.26Å
129	L	70.8	Confident	63.5	Low	80 Å²	80	99.6 Å²	99.6	42%	0.419	51%	0.512	S	S	.	.	H	α-helix	trans	-69.1	-43.1	163.9	-74.2	169	0	0	0	110.5	L125 R131 M132 Q133	L125-L129 HydrophobicContact CD2-CD1 3.94Å; L125-L129 HydrophobicContact CG-CD1 4.38Å; L125-L129 VanDerWaalsContact O-CB 3.26Å; L125-L129 WeakPolarHBondContact O-CB 3.47Å; L125-L129 VanDerWaalsContact O-CG 3.23Å; L125-L129 WeakPolarHBondContact O-CG 3.42Å; L125-L129 PolarHBondContact O-N 3.18Å; L129-R131 VanDerWaalsContact C-N 3.32Å; L129-R131 PolarHBondContact O-N 3.27Å; L129-M132 HydrophobicContact CD2-CE 4.34Å; L129-M132 PolarHBondContact O-N 3.05Å; L129-Q133 WeakPolarHBondContact O-CA 3.3Å; L129-Q133 WeakPolarHBondContact O-CB 3.31Å; L129-Q133 PolarHBondContact O-N 3.15Å
130	K	70.8	Confident	62.7	Low	106 Å²	106	101.2 Å²	101.2	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-31.2	172	-74.9	166.3	177.6	169.1	0	112	E126 Q127 K134	E126-K130 HydrophobicContact CG-CD 4.28Å; E126-K130 WeakPolarHBondContact O-CB 3.33Å; E126-K130 WeakPolarHBondContact O-CD 3.3Å; E126-K130 WeakPolarHBondContact O-CG 3.37Å; E126-K130 PolarHBondContact O-N 3.18Å; E126-K130 WeakPolarHBondContact OE1-CE 3.14Å; E126-K130 IonicContact OE1-NZ 2.66Å; E126-K130 PolarHBondContact OE1-NZ 3Å; E126-K130 WeakPolarHBondContact OE2-CE 3.22Å; E126-K130 IonicContact OE2-NZ 3.63Å; E126-K130 PolarHBondContact OE2-NZ 2.88Å; Q127-K130 CarbonylContact O-C 3.57Å; K130-K134 WeakPolarHBondContact O-CB 3.23Å; K130-K134 PolarHBondContact O-N 2.92Å
131	R	68.9	Low	61.7	Low	130 Å²	130	98.5 Å²	98.5	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-69	-57	168.1	-85.4	-175	178	99	-7	111.2	Q127 K128 L129 Q133 K134 E135	Q127-R131 WeakPolarHBondContact O-CB 3.25Å; Q127-R131 WeakPolarHBondContact O-CG 3.15Å; Q127-R131 PolarHBondContact O-N 2.72Å; K128-R131 PolarHBondContact O-N 2.67Å; L129-R131 VanDerWaalsContact C-N 3.32Å; L129-R131 PolarHBondContact O-N 3.27Å; R131-Q133 VanDerWaalsContact C-N 3.28Å; R131-Q133 PolarHBondContact O-N 3.39Å; R131-K134 CarbonylContact O-C 3.49Å; R131-K134 WeakPolarHBondContact O-CA 3.25Å; R131-K134 WeakPolarHBondContact O-CB 3.05Å; R131-K134 PolarHBondContact O-N 3.18Å; R131-E135 WeakPolarHBondContact O-CB 3.31Å; R131-E135 WeakPolarHBondContact O-CG 3.3Å; R131-E135 PolarHBondContact O-N 2.88Å
132	M	59.5	Low	61.2	Low	80 Å²	80	102 Å²	102	39%	0.394	52%	0.519	S	S	.	.	H	α-helix	trans	-57.3	-40.4	179	-77.2	-147	-56.5	0	0	112.2	K128 L129 E135 Q136	K128-M132 WeakPolarHBondContact O-CB 3.33Å; K128-M132 WeakPolarHBondContact O-CG 3.4Å; K128-M132 PolarHBondContact O-N 3.26Å; L129-M132 HydrophobicContact CD2-CE 4.34Å; L129-M132 PolarHBondContact O-N 3.05Å; M132-E135 PolarHBondContact O-N 2.91Å; M132-Q136 VanDerWaalsContact O-CB 3.25Å; M132-Q136 WeakPolarHBondContact O-CB 3.41Å; M132-Q136 VanDerWaalsContact O-CG 3.3Å; M132-Q136 WeakPolarHBondContact O-CG 3.42Å; M132-Q136 PolarHBondContact O-N 3.45Å
133	Q	58.4	Low	60.4	Low	120 Å²	120	103.8 Å²	103.8	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-67.7	-38.3	175	-171.6	177.5	64.2	0	0	111.1	L129 R131 E135 I137	L129-Q133 WeakPolarHBondContact O-CA 3.3Å; L129-Q133 WeakPolarHBondContact O-CB 3.31Å; L129-Q133 PolarHBondContact O-N 3.15Å; R131-Q133 VanDerWaalsContact C-N 3.28Å; R131-Q133 PolarHBondContact O-N 3.39Å; Q133-E135 VanDerWaalsContact C-N 3.31Å; Q133-E135 PolarHBondContact O-N 3.16Å; Q133-I137 HydrophobicContact CG-CD1 3.67Å; Q133-I137 HydrophobicContact CG-CG1 4.39Å; Q133-I137 WeakPolarHBondContact O-CB 3.44Å; Q133-I137 WeakPolarHBondContact O-CG1 3.33Å; Q133-I137 PolarHBondContact O-N 3.23Å
134	K	63.1	Low	59.6	Low	165 Å²	165	102.5 Å²	102.5	72%	0.717	53%	0.525	S	S	*	.	H	α-helix	trans	-73.6	-16.9	173.6	-177.3	177.1	177.7	-176.9	0	113.9	K130 R131 G138	K130-K134 WeakPolarHBondContact O-CB 3.23Å; K130-K134 PolarHBondContact O-N 2.92Å; R131-K134 CarbonylContact O-C 3.49Å; R131-K134 WeakPolarHBondContact O-CA 3.25Å; R131-K134 WeakPolarHBondContact O-CB 3.05Å; R131-K134 PolarHBondContact O-N 3.18Å; K134-G138 WeakPolarHBondContact O-CA 3.47Å; K134-G138 PolarHBondContact O-N 2.69Å
135	E	54.4	Low	58.5	Low	122 Å²	122	104.3 Å²	104.3	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-96.9	-34.7	176.8	-73.7	162.7	-167.2	0	0	111.3	R131 M132 Q133 G138 G139	R131-E135 WeakPolarHBondContact O-CB 3.31Å; R131-E135 WeakPolarHBondContact O-CG 3.3Å; R131-E135 PolarHBondContact O-N 2.88Å; M132-E135 PolarHBondContact O-N 2.91Å; Q133-E135 VanDerWaalsContact C-N 3.31Å; Q133-E135 PolarHBondContact O-N 3.16Å; E135-G138 CarbonylContact O-C 3.58Å; E135-G139 VanDerWaalsContact O-CA 3.24Å; E135-G139 WeakPolarHBondContact O-CA 3.32Å; E135-G139 PolarHBondContact O-N 2.9Å
136	Q	51	Low	57.7	Low	146 Å²	146	104.8 Å²	104.8	68%	0.682	54%	0.544	S	S	*	.	H	α-helix	trans	-71.2	-40.7	168.7	-73.1	-179.7	-25.4	0	0	111.8	M132	M132-Q136 VanDerWaalsContact O-CB 3.25Å; M132-Q136 WeakPolarHBondContact O-CB 3.41Å; M132-Q136 VanDerWaalsContact O-CG 3.3Å; M132-Q136 WeakPolarHBondContact O-CG 3.42Å; M132-Q136 PolarHBondContact O-N 3.45Å
137	I	51.7	Low	56.8	Low	124 Å²	124	103.1 Å²	103.1	64%	0.636	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-21.5	175.1	-57.3	176.5	0	0	0	111.5	Q133	Q133-I137 HydrophobicContact CG-CD1 3.67Å; Q133-I137 HydrophobicContact CG-CG1 4.39Å; Q133-I137 WeakPolarHBondContact O-CB 3.44Å; Q133-I137 WeakPolarHBondContact O-CG1 3.33Å; Q133-I137 PolarHBondContact O-N 3.23Å
138	G	50.5	Low	55.8	Low	63 Å²	63	101.1 Å²	101.1	65%	0.649	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	8.1	177.5	0	0	0	0	0	115.7	K134 E135	K134-G138 WeakPolarHBondContact O-CA 3.47Å; K134-G138 PolarHBondContact O-N 2.69Å; E135-G138 CarbonylContact O-C 3.58Å
139	G	45.3	Very low	54.6	Low	59 Å²	59	101.1 Å²	101.1	61%	0.608	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-20	-178.7	0	0	0	0	0	115	E135	E135-G139 VanDerWaalsContact O-CA 3.24Å; E135-G139 WeakPolarHBondContact O-CA 3.32Å; E135-G139 PolarHBondContact O-N 2.9Å
140	V	45.8	Very low	53.5	Low	97 Å²	97	102 Å²	102	59%	0.588	55%	0.546	S	S	*	.	S	Bend	trans	-117.2	91.1	175.9	-171.7	0	0	0	0	109.1	K142 L145	V140-K142 PolarHBondContact O-N 2.82Å; V140-L145 HydrophobicContact CG1-CD1 4.15Å
141	G	44.5	Very low	52.6	Low	19 Å²	19	107 Å²	107	20%	0.196	56%	0.562	C	S	.	*			trans	-55.5	127.9	-176.5	0	0	0	0	0	112.6	E143 T144 L145	G141-E143 VanDerWaalsContact C-OE1 3.31Å; G141-E143 VanDerWaalsContact CA-OE1 3.22Å; G141-E143 WeakPolarHBondContact CA-OE1 3.44Å; G141-E143 PolarHBondContact O-N 3.07Å; G141-T144 WeakPolarHBondContact CA-OG1 3.29Å; G141-T144 PolarHBondContact O-N 2.93Å; G141-T144 PolarHBondContact O-OG1 2.96Å; G141-T144 VanDerWaalsContact O-OG1 3.04Å; G141-L145 PolarHBondContact O-N 3.04Å
142	K	50.7	Low	51.3	Low	179 Å²	179	109.7 Å²	109.7	78%	0.778	58%	0.578	S	S	*	*	H	α-helix	trans	-64.5	-26.2	170.2	-71.5	-178.1	178.5	177.7	0	110.4	V140 A146	V140-K142 PolarHBondContact O-N 2.82Å; K142-A146 WeakPolarHBondContact O-CB 3.33Å; K142-A146 PolarHBondContact O-N 3.25Å
143	E	50	Low	50.7	Low	135 Å²	135	110.2 Å²	110.2	63%	0.631	58%	0.579	S	S	*	*	H	α-helix	trans	-72.8	-42.2	170.5	45.3	-79.5	98.7	0	0	113.4	G141 A146 S147	G141-E143 VanDerWaalsContact C-OE1 3.31Å; G141-E143 VanDerWaalsContact CA-OE1 3.22Å; G141-E143 WeakPolarHBondContact CA-OE1 3.44Å; G141-E143 PolarHBondContact O-N 3.07Å; E143-A146 PolarHBondContact O-N 3.39Å; E143-S147 WeakPolarHBondContact O-CB 3.34Å; E143-S147 PolarHBondContact O-N 3.31Å; E143-S147 PolarHBondContact O-OG 2.96Å
144	T	51.5	Low	50.1	Low	96 Å²	96	111.3 Å²	111.3	59%	0.589	58%	0.582	S	S	*	*	H	α-helix	trans	-70.1	-37.2	176.7	48.2	0	0	0	0	111.7	G141 A148	G141-T144 WeakPolarHBondContact CA-OG1 3.29Å; G141-T144 PolarHBondContact O-N 2.93Å; G141-T144 PolarHBondContact O-OG1 2.96Å; G141-T144 VanDerWaalsContact O-OG1 3.04Å; T144-A148 WeakPolarHBondContact O-CB 3.37Å; T144-A148 PolarHBondContact O-N 2.87Å
145	L	51.4	Low	49	Very low	106 Å²	106	106.4 Å²	106.4	56%	0.555	58%	0.578	S	S	*	*	H	α-helix	trans	-71.5	-35.6	174.2	-144	159.5	0	0	0	111.3	V140 G141 K149	V140-L145 HydrophobicContact CG1-CD1 4.15Å; G141-L145 PolarHBondContact O-N 3.04Å; L145-K149 WeakPolarHBondContact O-CB 3.12Å; L145-K149 PolarHBondContact O-N 3.28Å
146	A	53.7	Low	48.3	Very low	54 Å²	54	109.5 Å²	109.5	45%	0.446	59%	0.593	S	S	.	*	H	α-helix	trans	-66.1	-44.4	171.6	0	0	0	0	0	112.9	K142 E143 K149 E150	K142-A146 WeakPolarHBondContact O-CB 3.33Å; K142-A146 PolarHBondContact O-N 3.25Å; E143-A146 PolarHBondContact O-N 3.39Å; A146-K149 CarbonylContact O-C 3.53Å; A146-K149 PolarHBondContact O-N 3.32Å; A146-E150 WeakPolarHBondContact O-CB 3.3Å; A146-E150 PolarHBondContact O-N 3.15Å
147	S	52.6	Low	47.4	Very low	62 Å²	62	108 Å²	108	43%	0.434	60%	0.598	S	S	.	*	H	α-helix	trans	-73.4	-30.6	178.3	-65.2	0	0	0	0	113.2	E143 R151	E143-S147 WeakPolarHBondContact O-CB 3.34Å; E143-S147 PolarHBondContact O-N 3.31Å; E143-S147 PolarHBondContact O-OG 2.96Å; S147-R151 WeakPolarHBondContact O-CB 3.5Å; S147-R151 VanDerWaalsContact O-CG 3.31Å; S147-R151 WeakPolarHBondContact O-CG 3.49Å; S147-R151 PolarHBondContact O-N 3.24Å
148	A	51.9	Low	46.5	Very low	59 Å²	59	109.4 Å²	109.4	49%	0.488	61%	0.607	S	S	.	*	H	α-helix	trans	-66.2	-43.4	168.5	0	0	0	0	0	110.9	T144 R151 F152	T144-A148 WeakPolarHBondContact O-CB 3.37Å; T144-A148 PolarHBondContact O-N 2.87Å; A148-R151 PolarHBondContact O-N 2.81Å; A148-F152 WeakPolarHBondContact O-CB 3.5Å; A148-F152 PolarHBondContact O-N 3.09Å
149	K	49.1	Very low	45.7	Very low	122 Å²	122	114 Å²	114	53%	0.53	62%	0.615	S	S	.	*	H	α-helix	trans	-62.3	-45.9	173.8	-173.8	174.8	179.4	-178.9	0	111.5	L145 A146 R151 F152 E153	L145-K149 WeakPolarHBondContact O-CB 3.12Å; L145-K149 PolarHBondContact O-N 3.28Å; A146-K149 CarbonylContact O-C 3.53Å; A146-K149 PolarHBondContact O-N 3.32Å; K149-R151 VanDerWaalsContact C-N 3.33Å; K149-R151 PolarHBondContact O-N 3.42Å; K149-F152 CarbonylContact O-C 3.59Å; K149-F152 PolarHBondContact O-N 3.06Å; K149-F152 VanDerWaalsContact O-N 3.12Å; K149-E153 VanDerWaalsContact CE-OE2 3.24Å; K149-E153 WeakPolarHBondContact CE-OE2 3.28Å; K149-E153 WeakPolarHBondContact O-CB 3.29Å; K149-E153 PolarHBondContact O-N 3.35Å
150	E	48.8	Very low	45.1	Very low	98 Å²	98	116.8 Å²	116.8	46%	0.458	62%	0.62	S	S	.	*	H	α-helix	trans	-60.6	-40.2	178	-166.7	-172.8	164.5	0	0	112	A146 E153 K154	A146-E150 WeakPolarHBondContact O-CB 3.3Å; A146-E150 PolarHBondContact O-N 3.15Å; E150-E153 CarbonylContact O-C 3.58Å; E150-E153 PolarHBondContact O-N 3.44Å; E150-K154 HydrophobicContact CG-CD 4.42Å; E150-K154 PolarHBondContact O-N 3.5Å; E150-K154 IonicContact OE1-NZ 3.62Å; E150-K154 PolarHBondContact OE1-NZ 3.26Å
151	R	51.5	Low	44.5	Very low	210 Å²	210	118.5 Å²	118.5	79%	0.792	63%	0.63	S	S	*	*	H	α-helix	trans	-65.2	-39.4	173.6	-75.3	174.5	171.5	-164.9	-5	112.6	S147 A148 K149 E153	S147-R151 WeakPolarHBondContact O-CB 3.5Å; S147-R151 VanDerWaalsContact O-CG 3.31Å; S147-R151 WeakPolarHBondContact O-CG 3.49Å; S147-R151 PolarHBondContact O-N 3.24Å; A148-R151 PolarHBondContact O-N 2.81Å; K149-R151 VanDerWaalsContact C-N 3.33Å; K149-R151 PolarHBondContact O-N 3.42Å; R151-E153 VanDerWaalsContact C-N 3.27Å; R151-E153 PolarHBondContact O-N 3.33Å
152	F	42.3	Very low	43.9	Very low	188 Å²	188	126.2 Å²	126.2	83%	0.825	66%	0.662	S	S	*	*	H	α-helix	trans	-74.9	-15.8	174.1	-152.1	-92.1	0	0	0	113.2	A148 K149	A148-F152 WeakPolarHBondContact O-CB 3.5Å; A148-F152 PolarHBondContact O-N 3.09Å; K149-F152 CarbonylContact O-C 3.59Å; K149-F152 PolarHBondContact O-N 3.06Å; K149-F152 VanDerWaalsContact O-N 3.12Å
153	E	46.3	Very low	43.4	Very low	91 Å²	91	127.1 Å²	127.1	43%	0.425	67%	0.666	S	S	.	*	H	α-helix	trans	-98.3	-14.4	-178.1	-169.6	145.2	164.4	0	0	112.4	K149 E150 R151 R802	K149-E153 VanDerWaalsContact CE-OE2 3.24Å; K149-E153 WeakPolarHBondContact CE-OE2 3.28Å; K149-E153 WeakPolarHBondContact O-CB 3.29Å; K149-E153 PolarHBondContact O-N 3.35Å; E150-E153 CarbonylContact O-C 3.58Å; E150-E153 PolarHBondContact O-N 3.44Å; R151-E153 VanDerWaalsContact C-N 3.27Å; R151-E153 PolarHBondContact O-N 3.33Å; E153-R802 WeakPolarHBondContact OE1-CD 3.38Å; E153-R802 IonicContact OE1-CZ 3.37Å; E153-R802 IonicContact OE1-NE 2.67Å; E153-R802 PolarHBondContact OE1-NE 3.49Å; E153-R802 IonicContact OE1-NH2 2.6Å; E153-R802 IonicContact OE2-CZ 3.42Å; E153-R802 VanDerWaalsContact OE2-CZ 3.23Å; E153-R802 IonicContact OE2-NE 2.68Å; E153-R802 PolarHBondContact OE2-NE 3.49Å; E153-R802 IonicContact OE2-NH2 2.66Å; E153-R802 PolarHBondContact OE2-NH2 3.36Å
154	K	45.8	Very low	42.5	Very low	142 Å²	142	127.7 Å²	127.7	62%	0.617	68%	0.678	S	S	*	*	H	α-helix	trans	-96.8	-15.1	172.5	-87.1	174.2	174.5	161.7	0	115.6	E150 E156	E150-K154 HydrophobicContact CG-CD 4.42Å; E150-K154 PolarHBondContact O-N 3.5Å; E150-K154 IonicContact OE1-NZ 3.62Å; E150-K154 PolarHBondContact OE1-NZ 3.26Å; K154-E156 PolarHBondContact O-N 3.39Å
155	G	41.1	Very low	42	Very low	63 Å²	63	127.6 Å²	127.6	65%	0.649	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.8	30.8	165.4	0	0	0	0	0	116.6	S157	G155-S157 PolarHBondContact O-N 3.44Å
156	E	39.2	Very low	41.1	Very low	187 Å²	187	129 Å²	129	87%	0.874	70%	0.7	S	S	*	*			trans	-85.5	101.2	173.6	-70.6	-180	157.6	0	0	111.1	K154	K154-E156 PolarHBondContact O-N 3.39Å
157	S	32.8	Very low	40.5	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	72%	0.72	S	S	*	*			trans	-146.8	54.2	173.8	73.5	0	0	0	0	113.7	G155	G155-S157 PolarHBondContact O-N 3.44Å
158	D	32.6	Very low	39.6	Very low	154 Å²	154	139 Å²	139	82%	0.824	74%	0.739	S	S	*	*			trans	-108.3	104.9	164.4	-93.2	-40.2	0	0	0	110.5
159	I	33	Very low	39.2	Very low	158 Å²	158	142.7 Å²	142.7	81%	0.81	75%	0.746	S	S	*	*			trans	-132	86.5	155.4	-58.5	-177.5	0	0	0	107.1	V161	I159-V161 HydrophobicContact CG2-CG2 4.48Å
160	V	31.8	Very low	38.8	Very low	119 Å²	119	146.7 Å²	146.7	72%	0.721	76%	0.758	S	S	*	*			trans	-70.9	126.9	160.1	175.8	0	0	0	0	107.5
161	V	33.9	Very low	38.5	Very low	132 Å²	132	146.3 Å²	146.3	80%	0.8	77%	0.766	S	S	*	*			trans	-89.3	108.9	171.9	177.2	0	0	0	0	108.4	I159	I159-V161 HydrophobicContact CG2-CG2 4.48Å
162	E	31.4	Very low	38.6	Very low	182 Å²	182	139.6 Å²	139.6	85%	0.85	76%	0.756	S	S	*	*			trans	-130.8	143.6	167	-164.2	161.1	-128.5	0	0	110.9
163	K	40.6	Very low	39	Very low	198 Å²	198	134.7 Å²	134.7	86%	0.861	74%	0.738	S	S	*	*			trans	-94.6	121.6	-173.5	-70.4	178.1	177.7	176.6	0	111.2
164	T	31.2	Very low	39.4	Very low	146 Å²	146	135.7 Å²	135.7	90%	0.896	75%	0.746	S	S	*	*			trans	-130.2	150.9	144.2	51.7	0	0	0	0	108.8
165	A	40.9	Very low	39.9	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	75%	0.746	S	S	*	*			trans	-121.1	130.2	-172.1	0	0	0	0	0	111.1
166	V	32	Very low	40.9	Very low	137 Å²	137	136.5 Å²	136.5	83%	0.83	74%	0.743	S	S	*	*			trans	-146.1	127.9	164.5	-177.2	0	0	0	0	107.5
167	D	41.1	Very low	41.7	Very low	160 Å²	160	134.1 Å²	134.1	86%	0.856	73%	0.733	S	S	*	*			trans	-86.2	130.1	-178.6	-62.4	-76.1	0	0	0	112.8
168	I	35.2	Very low	43	Very low	165 Å²	165	134.9 Å²	134.9	85%	0.846	72%	0.722	S	S	*	*			trans	-141.9	134.1	157.7	-57.3	-176.7	0	0	0	108.3
169	E	42.3	Very low	44.3	Very low	136 Å²	136	130.6 Å²	130.6	64%	0.636	71%	0.708	S	S	*	*			trans	-87.8	164	-174.5	-56.4	-178.9	90.8	0	0	115.3
170	R	41.7	Very low	45.5	Very low	207 Å²	207	127.3 Å²	127.3	78%	0.781	70%	0.704	S	S	*	*			trans	78.7	149.5	165.5	-55.6	175.5	-173.8	73.5	20.5	114.5
171	S	42.3	Very low	46.1	Very low	89 Å²	89	130.6 Å²	130.6	62%	0.622	71%	0.709	S	S	*	*			cis	-121	176.1	17.7	76.7	0	0	0	0	115.9	D173	S171-D173 PolarHBondContact O-N 3.16Å; S171-D173 PolarHBondContact OG-OD2 3.04Å
172	A	52.6	Low	46.7	Very low	70 Å²	70	131 Å²	131	58%	0.579	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	6.9	-169.3	0	0	0	0	0	115.9
173	D	52.2	Low	47.7	Very low	85 Å²	85	131 Å²	131	46%	0.455	70%	0.702	S	S	.	*	H	α-helix	trans	-86.4	-21.1	-168	-58.5	-64.8	0	0	0	114.1	S171 S175 K176 M177	S171-D173 PolarHBondContact O-N 3.16Å; S171-D173 PolarHBondContact OG-OD2 3.04Å; D173-S175 PolarHBondContact O-N 2.84Å; D173-K176 PolarHBondContact O-N 3.46Å; D173-K176 IonicContact OD1-NZ 3.76Å; D173-K176 PolarHBondContact OD1-NZ 3.16Å; D173-M177 PolarHBondContact O-N 3.27Å
174	L	52.8	Low	48.1	Very low	112 Å²	112	127.9 Å²	127.9	59%	0.586	70%	0.7	S	S	*	*	H	α-helix	trans	-61.1	-32	174.6	-169.7	68.8	0	0	0	112.3	K178	L174-K178 HydrophobicContact CG-CD 4.45Å; L174-K178 WeakPolarHBondContact O-CG 3.46Å; L174-K178 PolarHBondContact O-N 3.26Å
175	S	57.4	Low	48.4	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	69%	0.694	S	S	*	*	H	α-helix	trans	-69.4	-37.2	178.8	-57.4	0	0	0	0	112.4	D173 K178 A179	D173-S175 PolarHBondContact O-N 2.84Å; S175-K178 PolarHBondContact O-N 2.9Å; S175-A179 PolarHBondContact O-N 2.86Å; S175-A179 VanDerWaalsContact O-N 3.15Å
176	K	61.4	Low	48.6	Very low	133 Å²	133	133.3 Å²	133.3	58%	0.578	70%	0.696	S	S	*	*	H	α-helix	trans	-67.4	-44	179	-58	170.6	-169.6	163	0	111	D173 K178 A179 A180	D173-K176 PolarHBondContact O-N 3.46Å; D173-K176 IonicContact OD1-NZ 3.76Å; D173-K176 PolarHBondContact OD1-NZ 3.16Å; K176-K178 VanDerWaalsContact C-N 3.3Å; K176-K178 PolarHBondContact O-N 3.4Å; K176-A179 PolarHBondContact O-N 3.33Å; K176-A180 PolarHBondContact O-N 3.24Å
177	M	56.8	Low	49.5	Very low	137 Å²	137	135.4 Å²	135.4	68%	0.675	70%	0.697	S	S	*	*	H	α-helix	trans	-66.1	-31.8	178.7	-165.8	-176.5	-66.8	0	0	112.6	D173	D173-M177 PolarHBondContact O-N 3.27Å
178	K	60.5	Low	50.5	Low	131 Å²	131	134.4 Å²	134.4	57%	0.57	69%	0.687	S	S	*	*	H	α-helix	trans	-71.1	-40.8	174.2	-75.1	174.1	178	177.9	0	112.8	L174 S175 K176 A180 F181	L174-K178 HydrophobicContact CG-CD 4.45Å; L174-K178 WeakPolarHBondContact O-CG 3.46Å; L174-K178 PolarHBondContact O-N 3.26Å; S175-K178 PolarHBondContact O-N 2.9Å; K176-K178 VanDerWaalsContact C-N 3.3Å; K176-K178 PolarHBondContact O-N 3.4Å; K178-A180 PolarHBondContact O-N 2.59Å; K178-F181 PolarHBondContact O-N 2.86Å
179	A	59.4	Low	51.8	Low	63 Å²	63	134.4 Å²	134.4	52%	0.521	68%	0.681	S	S	.	*	H	α-helix	trans	-61.1	-44.6	177.9	0	0	0	0	0	112.3	S175 K176 F181 Q182	S175-A179 PolarHBondContact O-N 2.86Å; S175-A179 VanDerWaalsContact O-N 3.15Å; K176-A179 PolarHBondContact O-N 3.33Å; A179-F181 PolarHBondContact O-N 2.94Å; A179-Q182 WeakPolarHBondContact O-CB 3.42Å; A179-Q182 PolarHBondContact O-N 3.49Å; A179-Q182 VanDerWaalsContact O-N 3.09Å
180	A	57.1	Low	53.5	Low	89 Å²	89	134.2 Å²	134.2	74%	0.736	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-10	-178.4	0	0	0	0	0	115.2	K176 K178	K176-A180 PolarHBondContact O-N 3.24Å; K178-A180 PolarHBondContact O-N 2.59Å
181	F	45.9	Very low	55.7	Low	188 Å²	188	127.5 Å²	127.5	83%	0.825	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	3.6	176.6	-101.6	-85	0	0	0	113.8	K178 A179	K178-F181 PolarHBondContact O-N 2.86Å; A179-F181 PolarHBondContact O-N 2.94Å
182	Q	46.6	Very low	57.9	Low	141 Å²	141	123.2 Å²	123.2	66%	0.659	63%	0.628	S	S	*	*	S	Bend	trans	-95.5	-10.5	-169.2	-164	152.5	-32.2	0	0	114.5	A179	A179-Q182 WeakPolarHBondContact O-CB 3.42Å; A179-Q182 PolarHBondContact O-N 3.49Å; A179-Q182 VanDerWaalsContact O-N 3.09Å
183	E	50.9	Low	59.5	Low	181 Å²	181	122.5 Å²	122.5	85%	0.846	62%	0.618	S	S	*	*	S	Bend	trans	-113.4	55.6	-171.8	-63.6	-168.7	152.3	0	0	115.1
184	V	49.2	Very low	61.1	Low	133 Å²	133	122.1 Å²	122.1	81%	0.806	62%	0.615	S	S	*	*			trans	-151.3	87.3	130.5	-174.3	0	0	0	0	108
185	K	38.6	Very low	62.7	Low	180 Å²	180	119 Å²	119	78%	0.783	60%	0.602	S	S	*	*			trans	-99	104	158	-86.9	179.8	179.5	167.5	0	108.6	E187	K185-E187 PolarHBondContact O-N 2.95Å
186	Q	43.9	Very low	64.1	Low	175 Å²	175	120.4 Å²	120.4	82%	0.818	60%	0.602	S	S	*	*			trans	-64.2	127.3	150.5	-72.5	-176.4	-18.2	0	0	107.2	E188	Q186-E188 PolarHBondContact O-N 3.38Å
187	E	52.1	Low	65.3	Low	181 Å²	181	121.1 Å²	121.1	85%	0.846	61%	0.605	S	S	*	*			trans	-76.3	78.7	177.2	-64.6	-163.9	137.4	0	0	110.1	K185 K189	K185-E187 PolarHBondContact O-N 2.95Å; E187-K189 PolarHBondContact O-N 2.71Å
188	E	61.8	Low	66.8	Low	138 Å²	138	118 Å²	118	65%	0.645	59%	0.594	S	S	*	*			trans	-51.1	110.8	159.8	-74.6	-173.3	-164.1	0	0	108.1	Q186 K190	Q186-E188 PolarHBondContact O-N 3.38Å; E188-K190 VanDerWaalsContact O-CG 3.23Å; E188-K190 WeakPolarHBondContact O-CG 3.39Å; E188-K190 PolarHBondContact O-N 3.45Å
189	K	62.6	Low	68.2	Low	166 Å²	166	112.4 Å²	112.4	72%	0.722	57%	0.571	S	S	*	*			trans	-62	100.9	177.5	-67.5	-176.3	179.4	-177.7	0	108.9	E187 N191 L211	E187-K189 PolarHBondContact O-N 2.71Å; K189-N191 PolarHBondContact O-N 2.88Å; K189-L211 VanDerWaalsContact O-CD1 3.25Å; K189-L211 WeakPolarHBondContact O-CD1 3.45Å
190	K	76.6	Confident	69.5	Low	131 Å²	131	116.9 Å²	116.9	57%	0.57	58%	0.575	S	S	*	*			trans	-77.1	5.3	-178.3	-54.9	-165.4	179.2	-178.6	0	113.2	E188 V198 V199	E188-K190 VanDerWaalsContact O-CG 3.23Å; E188-K190 WeakPolarHBondContact O-CG 3.39Å; E188-K190 PolarHBondContact O-N 3.45Å; K190-V198 HydrophobicContact CB-CG1 4.35Å; K190-V198 CarbonylContact O-C 3.6Å; K190-V198 WeakPolarHBondContact O-CA 3.35Å; K190-V199 PolarHBondContact O-N 2.68Å
191	N	87.8	Confident	70.8	Confident	66 Å²	66	118.1 Å²	118.1	35%	0.353	58%	0.576	S	S	.	*	B	Isolated β-bridge	trans	-107.1	143.7	-166.6	-60.6	61.9	0	0	0	109.7	K189 C193 D196 K197	K189-N191 PolarHBondContact O-N 2.88Å; N191-C193 PolarHBondContact O-N 2.81Å; N191-D196 WeakPolarHBondContact CB-O 3.32Å; N191-D196 PolarHBondContact ND2-O 3.49Å; N191-K197 CarbonylContact C-O 3.56Å; N191-K197 WeakPolarHBondContact CA-O 3.39Å
192	C	90	Very high	72.7	Confident	0 Å²	0	115.5 Å²	115.5	0%	0	58%	0.575	C	S	.	*			trans	-75	124.5	-179.7	168.9	0	0	0	0	111.3	I194 C195 D196 K197 V199 L211 H213	C192-I194 PolarHBondContact O-N 3.43Å; C192-I194 PolarHBondContact SG-N 3.15Å; C192-C195 PolarHBondContact O-N 3.17Å; C192-C195 VanDerWaalsContact O-N 3.12Å; C192-D196 VanDerWaalsContact O-CA 3.3Å; C192-D196 WeakPolarHBondContact O-CA 3.49Å; C192-D196 PolarHBondContact O-N 2.99Å; C192-K197 PolarHBondContact N-O 3.23Å; C192-V199 HydrophobicContact CB-CG2 3.61Å; C192-L211 VanDerWaalsContact CA-O 3.31Å; C192-L211 WeakPolarHBondContact CA-O 3.42Å; C192-H213 WeakPolarHBondContact CB-CE1 3.41Å; C192-H213 WeakPolarHBondContact CB-ND1 3.47Å
193	C	85	Confident	74.6	Confident	54 Å²	54	111.5 Å²	111.5	37%	0.365	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	19.7	-178.6	-54.8	0	0	0	0	115.5	N191 N210 L211 Y212	N191-C193 PolarHBondContact O-N 2.81Å; C193-N210 HydrophobicContact CB-CB 4.4Å; C193-L211 PolarHBondContact N-O 2.78Å; C193-Y212 HydrophobicContact CB-CE1 3.95Å
194	I	86.1	Confident	76.3	Confident	78 Å²	78	107.2 Å²	107.2	40%	0.4	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-22	175.8	-69.2	174.4	0	0	0	111.8	C192 Y212 C216 L238	C192-I194 PolarHBondContact O-N 3.43Å; C192-I194 PolarHBondContact SG-N 3.15Å; I194-Y212 HydrophobicContact CD1-CD1 3.58Å; I194-Y212 HydrophobicContact CD1-CE1 3.79Å; I194-Y212 HydrophobicContact CG1-CD1 3.84Å; I194-Y212 HydrophobicContact CG1-CE1 3.87Å; I194-C216 HydrophobicContact CB-CB 4.23Å; I194-C216 VanDerWaalsContact CD1-O 3.3Å; I194-C216 WeakPolarHBondContact CD1-O 3.42Å; I194-C216 HydrophobicContact CG2-CB 4.18Å; I194-L238 HydrophobicContact CD1-CD1 3.64Å; I194-L238 HydrophobicContact CD1-CG 4.25Å
195	C	87.8	Confident	78.2	Confident	45 Å²	45	101.6 Å²	101.6	30%	0.304	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.2	4	-179.3	73	0	0	0	0	114.9	C192 K197 C216	C192-C195 PolarHBondContact O-N 3.17Å; C192-C195 VanDerWaalsContact O-N 3.12Å; C195-K197 PolarHBondContact O-N 3.31Å; C195-C216 VanDerWaalsContact SG-SG 3.64Å
196	D	84.9	Confident	80.5	Confident	118 Å²	118	97.9 Å²	97.9	63%	0.631	49%	0.489	S	S	*	.			trans	51.9	8.6	178	-59.3	-58.1	0	0	0	117.1	N191 C192	N191-D196 WeakPolarHBondContact CB-O 3.32Å; N191-D196 PolarHBondContact ND2-O 3.49Å; C192-D196 VanDerWaalsContact O-CA 3.3Å; C192-D196 WeakPolarHBondContact O-CA 3.49Å; C192-D196 PolarHBondContact O-N 2.99Å
197	K	87.1	Confident	82.4	Confident	148 Å²	148	89.8 Å²	89.8	64%	0.643	45%	0.452	S	S	*	.			trans	-76.1	150.2	170.7	-67	169.3	-173.2	179.4	0	110.9	N191 C192 C195 H213	N191-K197 CarbonylContact C-O 3.56Å; N191-K197 WeakPolarHBondContact CA-O 3.39Å; C192-K197 PolarHBondContact N-O 3.23Å; C195-K197 PolarHBondContact O-N 3.31Å; K197-H213 PolarHBondContact O-CE1 3.31Å
198	V	88.4	Confident	83.7	Confident	73 Å²	73	85.6 Å²	85.6	44%	0.442	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-61	136.1	176.5	-179.3	0	0	0	0	110.6	K190 H213	K190-V198 HydrophobicContact CB-CG1 4.35Å; K190-V198 CarbonylContact O-C 3.6Å; K190-V198 WeakPolarHBondContact O-CA 3.35Å; V198-H213 PolarHBondContact O-NE2 3.39Å
199	V	89.3	Confident	84.6	Confident	12 Å²	12	88.9 Å²	88.9	7%	0.073	45%	0.448	C	S	.	.			trans	-98.2	109.9	179.5	-176.7	0	0	0	0	109	K190 C192 K204 L211	K190-V199 PolarHBondContact O-N 2.68Å; C192-V199 HydrophobicContact CB-CG2 3.61Å; V199-K204 VanDerWaalsContact CG1-CA 3.49Å; V199-K204 HydrophobicContact CG1-CB 3.9Å; V199-K204 HydrophobicContact CG1-CG 4.15Å; V199-L211 HydrophobicContact CG2-CB 4.19Å
200	Y	87.9	Confident	85.7	Confident	158 Å²	158	84.1 Å²	84.1	62%	0.62	43%	0.43	S	S	*	.			trans	-72.8	152.6	174.9	-68.3	-82.9	0	0	0	111.1	V202 E203 K204	Y200-V202 PolarHBondContact O-N 3.49Å; Y200-V202 VanDerWaalsContact O-N 3.09Å; Y200-E203 CarbonylContact O-C 3.56Å; Y200-E203 PolarHBondContact O-N 2.98Å; Y200-K204 PolarHBondContact O-N 2.87Å
201	P	83.6	Confident	86.2	Confident	115 Å²	115	78.8 Å²	78.8	75%	0.747	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-54.7	-33.2	-175.6	-28.6	36	0	0	0	115	E203 K204	P201-E203 VanDerWaalsContact C-N 3.3Å; P201-E203 PolarHBondContact O-N 2.83Å; P201-K204 PolarHBondContact O-N 2.82Å
202	V	86.6	Confident	86.4	Confident	133 Å²	133	75.8 Å²	75.8	81%	0.806	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-67.9	-28.3	178	-178.7	0	0	0	0	112.5	Y200 I214	Y200-V202 PolarHBondContact O-N 3.49Å; Y200-V202 VanDerWaalsContact O-N 3.09Å; V202-I214 WeakPolarHBondContact O-CD1 3.49Å
203	E	85.4	Confident	86.3	Confident	57 Å²	57	76.5 Å²	76.5	27%	0.266	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-104.2	7.4	179.7	-61.6	-166.7	123.6	0	0	112.8	Y200 P201 V205 H213 I214 Q215	Y200-E203 CarbonylContact O-C 3.56Å; Y200-E203 PolarHBondContact O-N 2.98Å; P201-E203 VanDerWaalsContact C-N 3.3Å; P201-E203 PolarHBondContact O-N 2.83Å; E203-V205 PolarHBondContact O-N 3.46Å; E203-H213 CarbonylContact O-C 3.44Å; E203-H213 VanDerWaalsContact O-CA 3.29Å; E203-H213 WeakPolarHBondContact O-CA 3.39Å; E203-H213 IonicContact OE2-CD2 2.68Å; E203-H213 PolarHBondContact OE2-CD2 3.33Å; E203-I214 PolarHBondContact O-N 3.3Å; E203-Q215 PolarHBondContact OE1-NE2 3.46Å; E203-Q215 VanDerWaalsContact OE1-NE2 3.16Å
204	K	87.3	Confident	86.5	Confident	91 Å²	91	78.3 Å²	78.3	40%	0.396	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	102.5	-169.3	-170.8	-177.1	-178.4	-178.9	0	113.1	V199 Y200 P201 L211	V199-K204 VanDerWaalsContact CG1-CA 3.49Å; V199-K204 HydrophobicContact CG1-CB 3.9Å; V199-K204 HydrophobicContact CG1-CG 4.15Å; Y200-K204 PolarHBondContact O-N 2.87Å; P201-K204 PolarHBondContact O-N 2.82Å; K204-L211 HydrophobicContact CD-CD2 4.44Å; K204-L211 HydrophobicContact CG-CD2 4.27Å
205	V	88.8	Confident	86.6	Confident	15 Å²	15	81.1 Å²	81.1	9%	0.091	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.3	161.6	-176.1	0	0	0	0	109.4	E203 L211 Y212 I214 F217 P228	E203-V205 PolarHBondContact O-N 3.46Å; V205-L211 WeakPolarHBondContact O-CA 3.4Å; V205-Y212 PolarHBondContact N-O 2.59Å; V205-Y212 PolarHBondContact O-N 3.42Å; V205-I214 HydrophobicContact CG2-CB 4.36Å; V205-I214 HydrophobicContact CG2-CG1 3.68Å; V205-F217 HydrophobicContact CB-CD2 4.44Å; V205-F217 HydrophobicContact CB-CG 4.33Å; V205-F217 HydrophobicContact CG1-CB 4.49Å; V205-F217 HydrophobicContact CG1-CD1 3.9Å; V205-F217 HydrophobicContact CG1-CD2 3.82Å; V205-F217 HydrophobicContact CG1-CE1 4.01Å; V205-F217 HydrophobicContact CG1-CE2 3.94Å; V205-F217 HydrophobicContact CG1-CG 3.8Å; V205-F217 HydrophobicContact CG1-CZ 4.02Å; V205-F217 HydrophobicContact CG2-CB 4.29Å; V205-F217 HydrophobicContact CG2-CG 4.43Å; V205-P228 HydrophobicContact CG1-CG 4.31Å
206	L	87.9	Confident	86.6	Confident	101 Å²	101	80 Å²	80	53%	0.529	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.5	173.1	-106.2	164	0	0	0	108.8	L211	L206-L211 HydrophobicContact CD1-CD2 4.43Å; L206-L211 HydrophobicContact CD2-CD2 3.53Å; L206-L211 HydrophobicContact CG-CD2 3.59Å
207	A	82.8	Confident	86.9	Confident	5 Å²	5	74.5 Å²	74.5	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	133.3	-179	0	0	0	0	0	109.8	K209 N210 Y212 F217 F231	A207-K209 PolarHBondContact O-N 3.22Å; A207-K209 VanDerWaalsContact O-N 3.13Å; A207-N210 PolarHBondContact N-O 3.15Å; A207-N210 VanDerWaalsContact N-O 3.09Å; A207-N210 WeakPolarHBondContact O-CB 3.39Å; A207-N210 PolarHBondContact O-N 3.48Å; A207-Y212 HydrophobicContact CB-CD2 4.09Å; A207-Y212 HydrophobicContact CB-CE2 3.85Å; A207-F217 HydrophobicContact CB-CE2 3.47Å; A207-F217 VanDerWaalsContact CB-CE2 3.47Å; A207-F217 HydrophobicContact CB-CZ 3.7Å; A207-F231 HydrophobicContact CB-CD2 4.43Å; A207-F231 HydrophobicContact CB-CE1 3.95Å; A207-F231 HydrophobicContact CB-CE2 3.83Å; A207-F231 HydrophobicContact CB-CZ 3.57Å
208	N	80.3	Confident	87	Confident	94 Å²	94	72 Å²	72	50%	0.503	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	42.9	-178.1	-68.8	-1.3	0	0	0	114.4	N210 F231 S233	N208-N210 PolarHBondContact O-N 3.39Å; N208-N210 VanDerWaalsContact O-N 3.1Å; N208-F231 WeakPolarHBondContact OD1-CZ 3.42Å; N208-S233 WeakPolarHBondContact ND2-CB 3.49Å; N208-S233 PolarHBondContact ND2-OG 3.05Å
209	K	80.8	Confident	87.2	Confident	207 Å²	207	68.6 Å²	68.6	90%	0.9	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	1.4	-176.9	-51.5	175	-176.7	174.7	0	115.2	A207	A207-K209 PolarHBondContact O-N 3.22Å; A207-K209 VanDerWaalsContact O-N 3.13Å
210	N	84.9	Confident	87	Confident	66 Å²	66	72 Å²	72	35%	0.353	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	159.1	175.8	-74.4	-18.8	0	0	0	111.9	C193 A207 N208 Y212	C193-N210 HydrophobicContact CB-CB 4.4Å; A207-N210 PolarHBondContact N-O 3.15Å; A207-N210 VanDerWaalsContact N-O 3.09Å; A207-N210 WeakPolarHBondContact O-CB 3.39Å; A207-N210 PolarHBondContact O-N 3.48Å; N208-N210 PolarHBondContact O-N 3.39Å; N208-N210 VanDerWaalsContact O-N 3.1Å; N210-Y212 HydrophobicContact CB-CE2 3.62Å; N210-Y212 WeakPolarHBondContact CB-OH 3.49Å; N210-Y212 PolarHBondContact ND2-OH 3.05Å
211	L	88.4	Confident	86.8	Confident	19 Å²	19	69.1 Å²	69.1	10%	0.099	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	145.8	172.9	-58.6	-165.8	0	0	0	111.6	K189 C192 C193 V199 K204 V205 L206	K189-L211 VanDerWaalsContact O-CD1 3.25Å; K189-L211 WeakPolarHBondContact O-CD1 3.45Å; C192-L211 VanDerWaalsContact CA-O 3.31Å; C192-L211 WeakPolarHBondContact CA-O 3.42Å; C193-L211 PolarHBondContact N-O 2.78Å; V199-L211 HydrophobicContact CG2-CB 4.19Å; K204-L211 HydrophobicContact CD-CD2 4.44Å; K204-L211 HydrophobicContact CG-CD2 4.27Å; V205-L211 WeakPolarHBondContact O-CA 3.4Å; L206-L211 HydrophobicContact CD1-CD2 4.43Å; L206-L211 HydrophobicContact CD2-CD2 3.53Å; L206-L211 HydrophobicContact CG-CD2 3.59Å
212	Y	90.9	Very high	87	Confident	3 Å²	3	66 Å²	66	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.1	173.2	-51.3	-91.7	0	0	0	110.6	C193 I194 V205 A207 N210 F217 L238	C193-Y212 HydrophobicContact CB-CE1 3.95Å; I194-Y212 HydrophobicContact CD1-CD1 3.58Å; I194-Y212 HydrophobicContact CD1-CE1 3.79Å; I194-Y212 HydrophobicContact CG1-CD1 3.84Å; I194-Y212 HydrophobicContact CG1-CE1 3.87Å; V205-Y212 PolarHBondContact N-O 2.59Å; V205-Y212 PolarHBondContact O-N 3.42Å; A207-Y212 HydrophobicContact CB-CD2 4.09Å; A207-Y212 HydrophobicContact CB-CE2 3.85Å; N210-Y212 HydrophobicContact CB-CE2 3.62Å; N210-Y212 WeakPolarHBondContact CB-OH 3.49Å; N210-Y212 PolarHBondContact ND2-OH 3.05Å; Y212-F217 HydrophobicContact CD1-CD2 4.39Å; Y212-F217 AromaticContact CD2-CD2 3.78Å; Y212-F217 HydrophobicContact CD2-CD2 3.78Å; Y212-F217 AromaticContact CD2-CE2 3.89Å; Y212-F217 HydrophobicContact CD2-CE2 3.89Å; Y212-F217 HydrophobicContact CE2-CD2 4.48Å; Y212-F217 HydrophobicContact CE2-CE2 4.25Å; Y212-F217 AromaticContact CG-CD2 3.73Å; Y212-F217 HydrophobicContact CG-CD2 3.73Å; Y212-F217 HydrophobicContact CG-CE2 4.3Å; Y212-L238 HydrophobicContact CD1-CD1 4.26Å; Y212-L238 HydrophobicContact CE1-CD1 4.21Å
213	H	89	Confident	86.9	Confident	15 Å²	15	62.7 Å²	62.7	7%	0.069	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	146.9	162.4	-54.2	89.8	0	0	0	109.9	C192 K197 V198 E203 Q215 C216 F217	C192-H213 WeakPolarHBondContact CB-CE1 3.41Å; C192-H213 WeakPolarHBondContact CB-ND1 3.47Å; K197-H213 PolarHBondContact O-CE1 3.31Å; V198-H213 PolarHBondContact O-NE2 3.39Å; E203-H213 CarbonylContact O-C 3.44Å; E203-H213 VanDerWaalsContact O-CA 3.29Å; E203-H213 WeakPolarHBondContact O-CA 3.39Å; E203-H213 IonicContact OE2-CD2 2.68Å; E203-H213 PolarHBondContact OE2-CD2 3.33Å; H213-Q215 PolarHBondContact O-N 3.32Å; H213-Q215 VanDerWaalsContact O-N 3.08Å; H213-C216 HydrophobicContact CB-CB 4.14Å; H213-C216 WeakPolarHBondContact O-CA 3.49Å; H213-C216 PolarHBondContact O-N 2.8Å; H213-F217 PolarHBondContact O-N 3.19Å
214	I	88.4	Confident	86.9	Confident	92 Å²	92	62.9 Å²	62.9	47%	0.472	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-35	171.5	-63.4	169.1	0	0	0	111.9	V202 E203 V205	V202-I214 WeakPolarHBondContact O-CD1 3.49Å; E203-I214 PolarHBondContact O-N 3.3Å; V205-I214 HydrophobicContact CG2-CB 4.36Å; V205-I214 HydrophobicContact CG2-CG1 3.68Å
215	Q	87.1	Confident	86.9	Confident	137 Å²	137	66.6 Å²	66.6	64%	0.64	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-24.4	178.6	-53	-172.5	38.5	0	0	114.1	E203 H213	E203-Q215 PolarHBondContact OE1-NE2 3.46Å; E203-Q215 VanDerWaalsContact OE1-NE2 3.16Å; H213-Q215 PolarHBondContact O-N 3.32Å; H213-Q215 VanDerWaalsContact O-N 3.08Å
216	C	88	Confident	86.9	Confident	21 Å²	21	66.8 Å²	66.8	14%	0.142	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-22.2	176.7	-67.3	0	0	0	0	112.2	I194 C195 H213 K218	I194-C216 HydrophobicContact CB-CB 4.23Å; I194-C216 VanDerWaalsContact CD1-O 3.3Å; I194-C216 WeakPolarHBondContact CD1-O 3.42Å; I194-C216 HydrophobicContact CG2-CB 4.18Å; C195-C216 VanDerWaalsContact SG-SG 3.64Å; H213-C216 HydrophobicContact CB-CB 4.14Å; H213-C216 WeakPolarHBondContact O-CA 3.49Å; H213-C216 PolarHBondContact O-N 2.8Å; C216-K218 VanDerWaalsContact C-N 3.31Å; C216-K218 PolarHBondContact O-N 3.28Å
217	F	90.9	Very high	86.8	Confident	3 Å²	3	64.3 Å²	64.3	1%	0.013	33%	0.329	C	S	.	.			trans	-78.8	74.1	-175.6	-159.3	-107.1	0	0	0	112.3	V205 A207 Y212 H213 L226 F231 L238	V205-F217 HydrophobicContact CB-CD2 4.44Å; V205-F217 HydrophobicContact CB-CG 4.33Å; V205-F217 HydrophobicContact CG1-CB 4.49Å; V205-F217 HydrophobicContact CG1-CD1 3.9Å; V205-F217 HydrophobicContact CG1-CD2 3.82Å; V205-F217 HydrophobicContact CG1-CE1 4.01Å; V205-F217 HydrophobicContact CG1-CE2 3.94Å; V205-F217 HydrophobicContact CG1-CG 3.8Å; V205-F217 HydrophobicContact CG1-CZ 4.02Å; V205-F217 HydrophobicContact CG2-CB 4.29Å; V205-F217 HydrophobicContact CG2-CG 4.43Å; A207-F217 HydrophobicContact CB-CE2 3.47Å; A207-F217 VanDerWaalsContact CB-CE2 3.47Å; A207-F217 HydrophobicContact CB-CZ 3.7Å; Y212-F217 HydrophobicContact CD1-CD2 4.39Å; Y212-F217 AromaticContact CD2-CD2 3.78Å; Y212-F217 HydrophobicContact CD2-CD2 3.78Å; Y212-F217 AromaticContact CD2-CE2 3.89Å; Y212-F217 HydrophobicContact CD2-CE2 3.89Å; Y212-F217 HydrophobicContact CE2-CD2 4.48Å; Y212-F217 HydrophobicContact CE2-CE2 4.25Å; Y212-F217 AromaticContact CG-CD2 3.73Å; Y212-F217 HydrophobicContact CG-CD2 3.73Å; Y212-F217 HydrophobicContact CG-CE2 4.3Å; H213-F217 PolarHBondContact O-N 3.19Å; F217-L226 HydrophobicContact CD1-CB 3.81Å; F217-L226 WeakPolarHBondContact CD1-O 3.43Å; F217-L226 HydrophobicContact CE1-CB 3.73Å; F217-L226 PolarHBondContact O-N 2.88Å; F217-F231 HydrophobicContact CE1-CB 3.9Å; F217-F231 HydrophobicContact CE1-CD1 4.34Å; F217-F231 HydrophobicContact CE1-CG 4.19Å; F217-F231 HydrophobicContact CE2-CD2 4.45Å; F217-F231 HydrophobicContact CE2-CG 4.4Å; F217-F231 HydrophobicContact CZ-CB 3.63Å; F217-F231 AromaticContact CZ-CD1 3.74Å; F217-F231 HydrophobicContact CZ-CD1 3.74Å; F217-F231 AromaticContact CZ-CD2 3.95Å; F217-F231 HydrophobicContact CZ-CD2 3.95Å; F217-F231 HydrophobicContact CZ-CE1 4.39Å; F217-F231 AromaticContact CZ-CG 3.49Å; F217-F231 HydrophobicContact CZ-CG 3.49Å; F217-F231 VanDerWaalsContact CZ-CG 3.49Å; F217-L238 HydrophobicContact CD2-CD1 3.39Å; F217-L238 HydrophobicContact CE2-CD1 3.64Å; F217-L238 HydrophobicContact CE2-CD2 3.94Å; F217-L238 HydrophobicContact CE2-CG 4.47Å; F217-L238 HydrophobicContact CG-CD1 4.14Å
218	K	91.1	Very high	86.7	Confident	95 Å²	95	68.1 Å²	68.1	41%	0.413	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-140.5	156.1	-175.4	66.9	-168.2	176.1	-171	0	111.9	C216 K224	C216-K218 VanDerWaalsContact C-N 3.31Å; C216-K218 PolarHBondContact O-N 3.28Å; K218-K224 WeakPolarHBondContact CA-O 3.29Å
219	C	91.9	Very high	86.7	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.014	37%	0.369	C	S	.	.			trans	-64.1	131.1	179	179.3	0	0	0	0	111.8	K221 C222 A223 K224 L226 L238 C240	C219-K221 VanDerWaalsContact C-N 3.31Å; C219-K221 PolarHBondContact O-N 3.32Å; C219-K221 PolarHBondContact SG-N 2.88Å; C219-C222 VanDerWaalsContact CB-SG 3.58Å; C219-A223 WeakPolarHBondContact O-CA 3.43Å; C219-A223 PolarHBondContact O-N 3.47Å; C219-K224 PolarHBondContact N-O 2.83Å; C219-L226 HydrophobicContact CB-CD1 4.45Å; C219-L226 HydrophobicContact CB-CD2 4.25Å; C219-L238 CarbonylContact C-O 3.56Å; C219-L238 WeakPolarHBondContact CA-O 3.37Å; C219-C240 HydrophobicContact CB-CB 4.45Å; C219-C240 PolarHBondContact SG-N 2.87Å
220	C	85.9	Confident	86.7	Confident	82 Å²	82	63.7 Å²	63.7	55%	0.554	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-27.3	178.7	-63.8	0	0	0	0	113.9	L238	C220-L238 PolarHBondContact N-O 3.41Å; C220-L238 PolarHBondContact SG-O 2.79Å; C220-L238 VanDerWaalsContact SG-O 3.4Å
221	K	83.6	Confident	86.7	Confident	98 Å²	98	62.4 Å²	62.4	43%	0.426	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-43.5	179.7	-67.8	-162.8	-173.2	180	0	113.8	C219 L239 H243 E246	C219-K221 VanDerWaalsContact C-N 3.31Å; C219-K221 PolarHBondContact O-N 3.32Å; C219-K221 PolarHBondContact SG-N 2.88Å; K221-L239 HydrophobicContact CG-CD2 4.04Å; K221-H243 HydrophobicContact CB-CB 4.24Å; K221-H243 HydrophobicContact CD-CB 4.02Å; K221-H243 HydrophobicContact CG-CB 4.38Å; K221-E246 VanDerWaalsContact CD-OE2 3.23Å; K221-E246 WeakPolarHBondContact CD-OE2 3.4Å; K221-E246 IonicContact NZ-OE1 2.86Å; K221-E246 PolarHBondContact NZ-OE1 2.78Å; K221-E246 IonicContact NZ-OE2 2.59Å; K221-E246 PolarHBondContact NZ-OE2 3.12Å
222	C	86.6	Confident	86.6	Confident	51 Å²	51	64.2 Å²	64.2	35%	0.345	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	2.2	-173.5	66.9	0	0	0	0	115.7	C219 K224 H243	C219-C222 VanDerWaalsContact CB-SG 3.58Å; C222-K224 PolarHBondContact O-N 2.79Å; C222-K224 WeakPolarHBondContact SG-CB 3.3Å; C222-H243 WeakPolarHBondContact CB-CE1 3.39Å; C222-H243 PolarHBondContact SG-CE1 3Å; C222-H243 PolarHBondContact SG-ND1 2.98Å
223	A	84.4	Confident	86.3	Confident	62 Å²	62	65.7 Å²	65.7	51%	0.512	36%	0.357	S	S	.	.			trans	55.9	3.3	-175.4	0	0	0	0	0	116.8	C219 K225	C219-A223 WeakPolarHBondContact O-CA 3.43Å; C219-A223 PolarHBondContact O-N 3.47Å; A223-K225 PolarHBondContact O-N 3.17Å
224	K	85.7	Confident	85.8	Confident	61 Å²	61	67 Å²	67	27%	0.265	36%	0.363	S	S	.	.			trans	-55.6	128.6	173.2	-160.6	171.2	-163.9	170.6	0	109	K218 C219 C222 P258 T261 E262	K218-K224 WeakPolarHBondContact CA-O 3.29Å; C219-K224 PolarHBondContact N-O 2.83Å; C222-K224 PolarHBondContact O-N 2.79Å; C222-K224 WeakPolarHBondContact SG-CB 3.3Å; K224-P258 PolarHBondContact NZ-O 3.1Å; K224-T261 PolarHBondContact NZ-OG1 3.48Å; K224-E262 WeakPolarHBondContact CE-OE1 3.37Å; K224-E262 VanDerWaalsContact NZ-CG 3.35Å; K224-E262 IonicContact NZ-OE1 2.9Å; K224-E262 PolarHBondContact NZ-OE1 3.05Å
225	K	88.1	Confident	85.4	Confident	170 Å²	170	69.4 Å²	69.4	74%	0.739	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-58.9	139.3	175.8	-66.8	-179.2	-178.8	176.8	0	108.7	A223	A223-K225 PolarHBondContact O-N 3.17Å
226	L	88.3	Confident	84.8	Confident	18 Å²	18	65.2 Å²	65.2	9%	0.094	37%	0.365	C	S	.	.			trans	-104.9	158	177	-58.3	176.1	0	0	0	109.4	F217 C219 F231 L238 C240	F217-L226 HydrophobicContact CD1-CB 3.81Å; F217-L226 WeakPolarHBondContact CD1-O 3.43Å; F217-L226 HydrophobicContact CE1-CB 3.73Å; F217-L226 PolarHBondContact O-N 2.88Å; C219-L226 HydrophobicContact CB-CD1 4.45Å; C219-L226 HydrophobicContact CB-CD2 4.25Å; L226-F231 HydrophobicContact CB-CB 3.98Å; L226-F231 HydrophobicContact CD1-CB 3.87Å; L226-F231 HydrophobicContact CG-CB 4.45Å; L226-L238 HydrophobicContact CD1-CB 3.85Å; L226-C240 HydrophobicContact CD2-CB 3.61Å
227	T	84.8	Confident	84.6	Confident	49 Å²	49	69.3 Å²	69.3	30%	0.301	38%	0.381	S	S	.	.			trans	-110.5	157.9	170.1	56.2	0	0	0	0	109.3	T229 N230 F231	T227-T229 PolarHBondContact O-N 2.98Å; T227-T229 PolarHBondContact OG1-OG1 3.44Å; T227-N230 PolarHBondContact O-N 2.89Å; T227-N230 VanDerWaalsContact OG1-CB 3.29Å; T227-N230 WeakPolarHBondContact OG1-CB 3.33Å; T227-N230 PolarHBondContact OG1-N 3.11Å; T227-F231 PolarHBondContact O-N 3.3Å
228	P	82.4	Confident	84.5	Confident	86 Å²	86	69.2 Å²	69.2	56%	0.558	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-15.1	177	-25.2	35.3	0	0	0	114.4	V205 F231	V205-P228 HydrophobicContact CG1-CG 4.31Å; P228-F231 WeakPolarHBondContact O-CD1 3.43Å; P228-F231 WeakPolarHBondContact O-CE1 3.49Å
229	T	79.4	Confident	84.4	Confident	135 Å²	135	65.1 Å²	65.1	83%	0.828	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-22.3	175.6	38.1	0	0	0	0	114.5	T227	T227-T229 PolarHBondContact O-N 2.98Å; T227-T229 PolarHBondContact OG1-OG1 3.44Å
230	N	80.9	Confident	84.2	Confident	73 Å²	73	65.6 Å²	65.6	39%	0.39	37%	0.366	S	S	.	.	S	Bend	trans	-121.9	28.8	-173.9	-160.2	-0.1	0	0	0	113.1	T227	T227-N230 PolarHBondContact O-N 2.89Å; T227-N230 VanDerWaalsContact OG1-CB 3.29Å; T227-N230 WeakPolarHBondContact OG1-CB 3.33Å; T227-N230 PolarHBondContact OG1-N 3.11Å
231	F	85.2	Confident	84.2	Confident	39 Å²	39	68.2 Å²	68.2	17%	0.171	37%	0.368	C	S	.	.			trans	-102.8	147.4	171.6	86.2	-80.3	0	0	0	111.2	A207 N208 F217 L226 T227 P228 L238	A207-F231 HydrophobicContact CB-CD2 4.43Å; A207-F231 HydrophobicContact CB-CE1 3.95Å; A207-F231 HydrophobicContact CB-CE2 3.83Å; A207-F231 HydrophobicContact CB-CZ 3.57Å; N208-F231 WeakPolarHBondContact OD1-CZ 3.42Å; F217-F231 HydrophobicContact CE1-CB 3.9Å; F217-F231 HydrophobicContact CE1-CD1 4.34Å; F217-F231 HydrophobicContact CE1-CG 4.19Å; F217-F231 HydrophobicContact CE2-CD2 4.45Å; F217-F231 HydrophobicContact CE2-CG 4.4Å; F217-F231 HydrophobicContact CZ-CB 3.63Å; F217-F231 AromaticContact CZ-CD1 3.74Å; F217-F231 HydrophobicContact CZ-CD1 3.74Å; F217-F231 AromaticContact CZ-CD2 3.95Å; F217-F231 HydrophobicContact CZ-CD2 3.95Å; F217-F231 HydrophobicContact CZ-CE1 4.39Å; F217-F231 AromaticContact CZ-CG 3.49Å; F217-F231 HydrophobicContact CZ-CG 3.49Å; F217-F231 VanDerWaalsContact CZ-CG 3.49Å; L226-F231 HydrophobicContact CB-CB 3.98Å; L226-F231 HydrophobicContact CD1-CB 3.87Å; L226-F231 HydrophobicContact CG-CB 4.45Å; T227-F231 PolarHBondContact O-N 3.3Å; P228-F231 WeakPolarHBondContact O-CD1 3.43Å; P228-F231 WeakPolarHBondContact O-CE1 3.49Å; F231-L238 HydrophobicContact CD2-CD2 4Å
232	N	85.7	Confident	84.2	Confident	57 Å²	57	64.4 Å²	64.4	31%	0.305	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	158.4	166.1	-78	-95.8	0	0	0	108.5	L239 M244	N232-L239 PolarHBondContact N-O 3.28Å; N232-L239 PolarHBondContact O-N 3.11Å; N232-M244 HydrophobicContact CB-CB 3.79Å; N232-M244 HydrophobicContact CB-CE 4.05Å; N232-M244 HydrophobicContact CB-CG 3.65Å; N232-M244 HydrophobicContact CB-SD 3.74Å
233	S	85.2	Confident	84	Confident	34 Å²	34	63 Å²	63	24%	0.238	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	114.7	-173.6	166.2	0	0	0	0	110.1	N208 K237	N208-S233 WeakPolarHBondContact ND2-CB 3.49Å; N208-S233 PolarHBondContact ND2-OG 3.05Å; S233-K237 WeakPolarHBondContact CA-O 3.23Å
234	H	78.8	Confident	83.9	Confident	43 Å²	43	61.4 Å²	61.4	20%	0.199	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.7	175.2	-163.9	-96.1	0	0	0	109.2	G236 K237 L239 M244 F248	H234-G236 PolarHBondContact O-N 3.45Å; H234-K237 PolarHBondContact N-O 2.89Å; H234-K237 WeakPolarHBondContact O-CA 3.38Å; H234-K237 VanDerWaalsContact O-CB 3.28Å; H234-K237 WeakPolarHBondContact O-CB 3.41Å; H234-K237 PolarHBondContact O-N 2.66Å; H234-L239 HydrophobicContact CB-CD1 3.88Å; H234-M244 HydrophobicContact CB-CE 4.27Å; H234-M244 HydrophobicContact CB-SD 4.02Å; H234-F248 AromaticContact CD2-CE2 3.54Å; H234-F248 AromaticContact CD2-CZ 3.44Å; H234-F248 VanDerWaalsContact CD2-CZ 3.44Å; H234-F248 WeakPolarHBondContact CD2-CZ 3.2Å; H234-F248 AromaticContact NE2-CZ 3.54Å
235	E	79.8	Confident	83.7	Confident	141 Å²	141	61.3 Å²	61.3	66%	0.659	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	31.5	-179.7	-57.7	158.4	171.9	0	0	114	K237	E235-K237 VanDerWaalsContact C-N 3.25Å; E235-K237 PolarHBondContact O-N 2.62Å; E235-K237 IonicContact OE2-NZ 2.66Å; E235-K237 PolarHBondContact OE2-NZ 3.37Å
236	G	75.1	Confident	83.3	Confident	49 Å²	49	57 Å²	57	51%	0.505	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-4.3	-174.5	0	0	0	0	0	115.7	H234	H234-G236 PolarHBondContact O-N 3.45Å
237	K	83.2	Confident	82.8	Confident	108 Å²	108	59 Å²	59	47%	0.47	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.7	173.8	-56.2	156	-171.3	162.5	0	109.5	S233 H234 E235	S233-K237 WeakPolarHBondContact CA-O 3.23Å; H234-K237 PolarHBondContact N-O 2.89Å; H234-K237 WeakPolarHBondContact O-CA 3.38Å; H234-K237 VanDerWaalsContact O-CB 3.28Å; H234-K237 WeakPolarHBondContact O-CB 3.41Å; H234-K237 PolarHBondContact O-N 2.66Å; E235-K237 VanDerWaalsContact C-N 3.25Å; E235-K237 PolarHBondContact O-N 2.62Å; E235-K237 IonicContact OE2-NZ 2.66Å; E235-K237 PolarHBondContact OE2-NZ 3.37Å
238	L	88.9	Confident	82.5	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.8	176.6	-63	-179.6	0	0	0	110.7	I194 Y212 F217 C219 C220 L226 F231	I194-L238 HydrophobicContact CD1-CD1 3.64Å; I194-L238 HydrophobicContact CD1-CG 4.25Å; Y212-L238 HydrophobicContact CD1-CD1 4.26Å; Y212-L238 HydrophobicContact CE1-CD1 4.21Å; F217-L238 HydrophobicContact CD2-CD1 3.39Å; F217-L238 HydrophobicContact CE2-CD1 3.64Å; F217-L238 HydrophobicContact CE2-CD2 3.94Å; F217-L238 HydrophobicContact CE2-CG 4.47Å; F217-L238 HydrophobicContact CG-CD1 4.14Å; C219-L238 CarbonylContact C-O 3.56Å; C219-L238 WeakPolarHBondContact CA-O 3.37Å; C220-L238 PolarHBondContact N-O 3.41Å; C220-L238 PolarHBondContact SG-O 2.79Å; C220-L238 VanDerWaalsContact SG-O 3.4Å; L226-L238 HydrophobicContact CD1-CB 3.85Å; F231-L238 HydrophobicContact CD2-CD2 4Å
239	L	87.6	Confident	82.1	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.8	-179.8	-62.3	174	0	0	0	109.9	K221 N232 H234 H243 M244 V247	K221-L239 HydrophobicContact CG-CD2 4.04Å; N232-L239 PolarHBondContact N-O 3.28Å; N232-L239 PolarHBondContact O-N 3.11Å; H234-L239 HydrophobicContact CB-CD1 3.88Å; L239-H243 HydrophobicContact CB-CB 4.4Å; L239-H243 HydrophobicContact CD2-CB 4.15Å; L239-M244 HydrophobicContact CB-CB 4.43Å; L239-M244 HydrophobicContact CB-SD 4.46Å; L239-M244 HydrophobicContact CD1-SD 3.85Å; L239-V247 HydrophobicContact CD1-CG2 4.13Å
240	C	89.3	Confident	81.6	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.081	31%	0.31	C	S	.	.			trans	-80.8	167.8	164.3	80.3	0	0	0	0	110.2	C219 L226 V242 H243 M244	C219-C240 HydrophobicContact CB-CB 4.45Å; C219-C240 PolarHBondContact SG-N 2.87Å; L226-C240 HydrophobicContact CD2-CB 3.61Å; C240-V242 VanDerWaalsContact C-N 3.29Å; C240-V242 PolarHBondContact O-N 3.45Å; C240-H243 PolarHBondContact O-N 3.26Å; C240-H243 VanDerWaalsContact O-N 3.14Å; C240-H243 PolarHBondContact SG-ND1 3.17Å; C240-M244 PolarHBondContact O-N 2.93Å
241	K	84.7	Confident	80.8	Confident	138 Å²	138	64.9 Å²	64.9	60%	0.6	33%	0.33	S	S	*	.	H	α-helix	trans	-48.4	-44.9	-179.8	-169.1	178	179.8	-176.6	0	113.7	M244 L245	K241-M244 PolarHBondContact O-N 3.48Å; K241-L245 WeakPolarHBondContact O-CG 3.11Å; K241-L245 PolarHBondContact O-N 2.8Å
242	V	84.4	Confident	79.8	Confident	17 Å²	17	67 Å²	67	10%	0.103	34%	0.343	C	S	.	.	H	α-helix	trans	-63.7	-50.4	179	-176.8	0	0	0	0	111.7	C240 M244 L245 E246 M256 P258 T261	C240-V242 VanDerWaalsContact C-N 3.29Å; C240-V242 PolarHBondContact O-N 3.45Å; V242-M244 PolarHBondContact O-N 3.49Å; V242-L245 PolarHBondContact O-N 2.79Å; V242-E246 PolarHBondContact O-N 3.28Å; V242-M256 HydrophobicContact CG1-CB 4.28Å; V242-P258 HydrophobicContact CG1-CB 4.49Å; V242-T261 HydrophobicContact CG2-CG2 4.46Å
243	H	81.9	Confident	78.5	Confident	21 Å²	21	64.9 Å²	64.9	10%	0.097	33%	0.333	C	S	.	.	H	α-helix	trans	-73.4	-15.1	-178.8	-63	101.1	0	0	0	113.7	K221 C222 L239 C240 E246 V247	K221-H243 HydrophobicContact CB-CB 4.24Å; K221-H243 HydrophobicContact CD-CB 4.02Å; K221-H243 HydrophobicContact CG-CB 4.38Å; C222-H243 WeakPolarHBondContact CB-CE1 3.39Å; C222-H243 PolarHBondContact SG-CE1 3Å; C222-H243 PolarHBondContact SG-ND1 2.98Å; L239-H243 HydrophobicContact CB-CB 4.4Å; L239-H243 HydrophobicContact CD2-CB 4.15Å; C240-H243 PolarHBondContact O-N 3.26Å; C240-H243 VanDerWaalsContact O-N 3.14Å; C240-H243 PolarHBondContact SG-ND1 3.17Å; H243-E246 IonicContact CD2-OE2 3.6Å; H243-E246 PolarHBondContact CD2-OE2 3.43Å; H243-E246 VanDerWaalsContact CD2-OE2 3.27Å; H243-V247 WeakPolarHBondContact O-CG2 3.48Å
244	M	82.3	Confident	77.2	Confident	30 Å²	30	71.5 Å²	71.5	15%	0.148	36%	0.36	C	S	.	.	H	α-helix	trans	-77.2	-46	167.4	-165.6	70.2	160.3	0	0	110.7	N232 H234 L239 C240 K241 V242 E246 V247 F248	N232-M244 HydrophobicContact CB-CB 3.79Å; N232-M244 HydrophobicContact CB-CE 4.05Å; N232-M244 HydrophobicContact CB-CG 3.65Å; N232-M244 HydrophobicContact CB-SD 3.74Å; H234-M244 HydrophobicContact CB-CE 4.27Å; H234-M244 HydrophobicContact CB-SD 4.02Å; L239-M244 HydrophobicContact CB-CB 4.43Å; L239-M244 HydrophobicContact CB-SD 4.46Å; L239-M244 HydrophobicContact CD1-SD 3.85Å; C240-M244 PolarHBondContact O-N 2.93Å; K241-M244 PolarHBondContact O-N 3.48Å; V242-M244 PolarHBondContact O-N 3.49Å; M244-E246 VanDerWaalsContact C-N 3.26Å; M244-E246 PolarHBondContact O-N 2.88Å; M244-V247 PolarHBondContact O-N 3.29Å; M244-F248 HydrophobicContact CE-CE2 3.76Å; M244-F248 HydrophobicContact CG-CD2 4.37Å; M244-F248 HydrophobicContact CG-CE2 4.42Å; M244-F248 WeakPolarHBondContact O-CD2 3.28Å; M244-F248 PolarHBondContact O-N 3.22Å; M244-F248 HydrophobicContact SD-CD2 4.49Å; M244-F248 HydrophobicContact SD-CE2 4.04Å
245	L	81.8	Confident	76.4	Confident	59 Å²	59	74.5 Å²	74.5	31%	0.309	38%	0.382	S	S	.	.	H	α-helix	trans	-59	-38	173.8	-72.1	166.4	0	0	0	111.7	K241 V242 V247 F248 H249	K241-L245 WeakPolarHBondContact O-CG 3.11Å; K241-L245 PolarHBondContact O-N 2.8Å; V242-L245 PolarHBondContact O-N 2.79Å; L245-V247 PolarHBondContact O-N 3.37Å; L245-F248 PolarHBondContact O-N 3.13Å; L245-H249 CarbonylContact O-C 3.55Å; L245-H249 VanDerWaalsContact O-C 3.28Å; L245-H249 WeakPolarHBondContact O-CA 3.39Å; L245-H249 PolarHBondContact O-N 3.13Å
246	E	78.8	Confident	75.5	Confident	80 Å²	80	72.4 Å²	72.4	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-23.8	174.5	-162	-152.4	145.8	0	0	114.2	K221 V242 H243 M244 A253	K221-E246 VanDerWaalsContact CD-OE2 3.23Å; K221-E246 WeakPolarHBondContact CD-OE2 3.4Å; K221-E246 IonicContact NZ-OE1 2.86Å; K221-E246 PolarHBondContact NZ-OE1 2.78Å; K221-E246 IonicContact NZ-OE2 2.59Å; K221-E246 PolarHBondContact NZ-OE2 3.12Å; V242-E246 PolarHBondContact O-N 3.28Å; H243-E246 IonicContact CD2-OE2 3.6Å; H243-E246 PolarHBondContact CD2-OE2 3.43Å; H243-E246 VanDerWaalsContact CD2-OE2 3.27Å; M244-E246 VanDerWaalsContact C-N 3.26Å; M244-E246 PolarHBondContact O-N 2.88Å; E246-A253 VanDerWaalsContact CA-CB 3.47Å; E246-A253 HydrophobicContact CB-CB 3.68Å; E246-A253 HydrophobicContact CG-CB 3.95Å
247	V	79.4	Confident	74.8	Confident	59 Å²	59	73.5 Å²	73.5	36%	0.358	37%	0.367	S	S	.	.	H	α-helix	trans	-85.3	-30.2	177.6	170.4	0	0	0	0	112	L239 H243 M244 L245	L239-V247 HydrophobicContact CD1-CG2 4.13Å; H243-V247 WeakPolarHBondContact O-CG2 3.48Å; M244-V247 PolarHBondContact O-N 3.29Å; L245-V247 PolarHBondContact O-N 3.37Å
248	F	76.9	Confident	73.4	Confident	110 Å²	110	70.6 Å²	70.6	48%	0.482	36%	0.359	S	S	.	.	H	α-helix	trans	-102.3	-32.7	-177.2	-74.2	-82.2	0	0	0	114.4	H234 M244 L245	H234-F248 AromaticContact CD2-CE2 3.54Å; H234-F248 AromaticContact CD2-CZ 3.44Å; H234-F248 VanDerWaalsContact CD2-CZ 3.44Å; H234-F248 WeakPolarHBondContact CD2-CZ 3.2Å; H234-F248 AromaticContact NE2-CZ 3.54Å; M244-F248 HydrophobicContact CE-CE2 3.76Å; M244-F248 HydrophobicContact CG-CD2 4.37Å; M244-F248 HydrophobicContact CG-CE2 4.42Å; M244-F248 WeakPolarHBondContact O-CD2 3.28Å; M244-F248 PolarHBondContact O-N 3.22Å; M244-F248 HydrophobicContact SD-CD2 4.49Å; M244-F248 HydrophobicContact SD-CE2 4.04Å; L245-F248 PolarHBondContact O-N 3.13Å
249	H	75.3	Confident	72	Confident	106 Å²	106	77.8 Å²	77.8	49%	0.491	39%	0.393	S	S	.	.			trans	-143.2	74.9	-173.5	-60.8	-62.7	0	0	0	110.8	L245 E251 I252 A253	L245-H249 CarbonylContact O-C 3.55Å; L245-H249 VanDerWaalsContact O-C 3.28Å; L245-H249 WeakPolarHBondContact O-CA 3.39Å; L245-H249 PolarHBondContact O-N 3.13Å; H249-E251 VanDerWaalsContact C-N 3.27Å; H249-E251 PolarHBondContact O-N 3.32Å; H249-I252 HydrophobicContact CB-CB 4.36Å; H249-I252 HydrophobicContact CB-CD1 3.92Å; H249-I252 HydrophobicContact CB-CG1 4.17Å; H249-I252 PolarHBondContact O-N 2.9Å; H249-I252 VanDerWaalsContact O-N 3.14Å; H249-A253 PolarHBondContact O-N 2.66Å
250	P	68.4	Low	70.4	Confident	73 Å²	73	83.5 Å²	83.5	47%	0.474	42%	0.424	S	S	.	.	H	α-helix	trans	-58.5	-34.5	-173.9	21.9	-33.4	0	0	0	113.6	I252 A253 H254	P250-I252 VanDerWaalsContact C-N 3.3Å; P250-I252 PolarHBondContact O-N 2.93Å; P250-A253 PolarHBondContact O-N 3.42Å; P250-H254 PolarHBondContact O-CD2 3.4Å; P250-H254 PolarHBondContact O-N 2.92Å
251	E	64.6	Low	68.8	Low	177 Å²	177	86.8 Å²	86.8	83%	0.827	44%	0.443	S	S	*	.	H	α-helix	trans	-61	-36.7	178.7	-60.4	-170.8	150.7	0	0	113	H249	H249-E251 VanDerWaalsContact C-N 3.27Å; H249-E251 PolarHBondContact O-N 3.32Å
252	I	63.3	Low	67.2	Low	85 Å²	85	86 Å²	86	44%	0.436	44%	0.442	S	S	.	.	H	α-helix	trans	-74.3	-39.4	178.9	-57.3	178.4	0	0	0	110.1	H249 P250 H254 T255	H249-I252 HydrophobicContact CB-CB 4.36Å; H249-I252 HydrophobicContact CB-CD1 3.92Å; H249-I252 HydrophobicContact CB-CG1 4.17Å; H249-I252 PolarHBondContact O-N 2.9Å; H249-I252 VanDerWaalsContact O-N 3.14Å; P250-I252 VanDerWaalsContact C-N 3.3Å; P250-I252 PolarHBondContact O-N 2.93Å; I252-H254 VanDerWaalsContact C-N 3.29Å; I252-H254 PolarHBondContact O-N 2.95Å; I252-T255 PolarHBondContact O-N 3.43Å; I252-T255 VanDerWaalsContact O-N 3.07Å; I252-T255 PolarHBondContact O-OG1 3.09Å
253	A	58.7	Low	65.4	Low	12 Å²	12	93.7 Å²	93.7	10%	0.099	48%	0.477	C	S	.	.	H	α-helix	trans	-62.2	-33.1	-174.8	0	0	0	0	0	113.4	E246 H249 P250 T255 M256	E246-A253 VanDerWaalsContact CA-CB 3.47Å; E246-A253 HydrophobicContact CB-CB 3.68Å; E246-A253 HydrophobicContact CG-CB 3.95Å; H249-A253 PolarHBondContact O-N 2.66Å; P250-A253 PolarHBondContact O-N 3.42Å; A253-T255 PolarHBondContact O-N 3.37Å; A253-T255 VanDerWaalsContact O-N 3.1Å; A253-M256 PolarHBondContact O-N 3.18Å; A253-M256 VanDerWaalsContact O-N 3.13Å
254	H	58.8	Low	63.5	Low	172 Å²	172	100 Å²	100	80%	0.796	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-13	176.2	-73.7	-62.7	0	0	0	114.6	P250 I252	P250-H254 PolarHBondContact O-CD2 3.4Å; P250-H254 PolarHBondContact O-N 2.92Å; I252-H254 VanDerWaalsContact C-N 3.29Å; I252-H254 PolarHBondContact O-N 2.95Å
255	T	62.2	Low	61.8	Low	107 Å²	107	105.6 Å²	105.6	66%	0.656	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-5.2	177.2	69.6	0	0	0	0	113.9	I252 A253	I252-T255 PolarHBondContact O-N 3.43Å; I252-T255 VanDerWaalsContact O-N 3.07Å; I252-T255 PolarHBondContact O-OG1 3.09Å; A253-T255 PolarHBondContact O-N 3.37Å; A253-T255 VanDerWaalsContact O-N 3.1Å
256	M	60.1	Low	59.9	Low	97 Å²	97	111.1 Å²	111.1	48%	0.478	56%	0.56	S	S	.	*			trans	-117.7	103.3	-168	-71	-79.7	163.6	0	0	111.6	V242 A253 P258	V242-M256 HydrophobicContact CG1-CB 4.28Å; A253-M256 PolarHBondContact O-N 3.18Å; A253-M256 VanDerWaalsContact O-N 3.13Å; M256-P258 WeakPolarHBondContact O-CD 3.22Å
257	D	59.6	Low	58	Low	71 Å²	71	111.8 Å²	111.8	38%	0.38	58%	0.58	S	S	.	*			trans	-70.4	119.5	177.9	-178.4	-9.8	0	0	0	111.5	Q259 N260	D257-Q259 PolarHBondContact O-N 2.66Å; D257-Q259 VanDerWaalsContact O-N 3.13Å; D257-Q259 WeakPolarHBondContact OD1-CB 3.43Å; D257-Q259 PolarHBondContact OD1-N 2.82Å; D257-N260 HydrophobicContact CB-CB 4.32Å; D257-N260 PolarHBondContact O-N 3.07Å; D257-N260 PolarHBondContact OD2-ND2 2.87Å
258	P	55.5	Low	56.3	Low	47 Å²	47	113.8 Å²	113.8	31%	0.305	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.3	-10	179.3	28.8	-36	0	0	0	114.6	K224 V242 M256 T261	K224-P258 PolarHBondContact NZ-O 3.1Å; V242-P258 HydrophobicContact CG1-CB 4.49Å; M256-P258 WeakPolarHBondContact O-CD 3.22Å; P258-T261 PolarHBondContact O-OG1 2.89Å
259	Q	58	Low	54.8	Low	152 Å²	152	113.1 Å²	113.1	71%	0.71	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-26.9	175.3	-52.2	-161.8	-93.3	0	0	113.3	D257 T261	D257-Q259 PolarHBondContact O-N 2.66Å; D257-Q259 VanDerWaalsContact O-N 3.13Å; D257-Q259 WeakPolarHBondContact OD1-CB 3.43Å; D257-Q259 PolarHBondContact OD1-N 2.82Å; Q259-T261 VanDerWaalsContact C-N 3.32Å; Q259-T261 PolarHBondContact O-N 3.35Å
260	N	54.6	Low	53	Low	129 Å²	129	115.3 Å²	115.3	69%	0.69	63%	0.627	S	S	*	*	S	Bend	trans	-91.4	27.9	-175	-83.4	-59.3	0	0	0	114.3	D257	D257-N260 HydrophobicContact CB-CB 4.32Å; D257-N260 PolarHBondContact O-N 3.07Å; D257-N260 PolarHBondContact OD2-ND2 2.87Å
261	T	56.4	Low	51.7	Low	81 Å²	81	121.1 Å²	121.1	50%	0.497	65%	0.648	S	S	.	*			trans	-117.2	30.5	-175.5	46.9	0	0	0	0	112.9	K224 V242 P258 Q259	K224-T261 PolarHBondContact NZ-OG1 3.48Å; V242-T261 HydrophobicContact CG2-CG2 4.46Å; P258-T261 PolarHBondContact O-OG1 2.89Å; Q259-T261 VanDerWaalsContact C-N 3.32Å; Q259-T261 PolarHBondContact O-N 3.35Å
262	E	51.1	Low	50.7	Low	122 Å²	122	122.2 Å²	122.2	57%	0.57	65%	0.653	S	S	*	*			trans	-116.7	-9.2	-164.2	-56	-168.3	-177.2	0	0	114.6	K224	K224-E262 WeakPolarHBondContact CE-OE1 3.37Å; K224-E262 VanDerWaalsContact NZ-CG 3.35Å; K224-E262 IonicContact NZ-OE1 2.9Å; K224-E262 PolarHBondContact NZ-OE1 3.05Å
263	E	45	Very low	49.5	Very low	178 Å²	178	126.4 Å²	126.4	83%	0.832	67%	0.671	S	S	*	*	S	Bend	trans	-89.6	-13.7	-168	-57.2	-165.9	134.3	0	0	115.1	E265	E263-E265 VanDerWaalsContact C-N 3.3Å; E263-E265 PolarHBondContact O-N 3.27Å
264	D	43.6	Very low	48.2	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	19.7	-168.7	-148.3	16.3	0	0	0	114.4
265	E	45.5	Very low	47.2	Very low	148 Å²	148	131 Å²	131	69%	0.692	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	12.7	178.9	-67.8	-163.1	175.9	0	0	114.1	E263	E263-E265 VanDerWaalsContact C-N 3.3Å; E263-E265 PolarHBondContact O-N 3.27Å
266	H	42.3	Very low	45.8	Very low	175 Å²	175	132.4 Å²	132.4	81%	0.81	71%	0.71	S	S	*	*	S	Bend	trans	-127.8	-0.5	177.4	-91.1	43.3	0	0	0	116.3	A268	H266-A268 PolarHBondContact O-N 3.01Å
267	A	38.7	Very low	44.7	Very low	94 Å²	94	133.4 Å²	133.4	78%	0.777	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	35.3	-177.7	0	0	0	0	0	114.9
268	A	44.6	Very low	43.6	Very low	101 Å²	101	134.9 Å²	134.9	84%	0.835	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.4	17.7	-170	0	0	0	0	0	116.2	H266	H266-A268 PolarHBondContact O-N 3.01Å
269	S	44.5	Very low	43	Very low	97 Å²	97	141.8 Å²	141.8	68%	0.678	77%	0.768	S	S	*	*	S	Bend	trans	-158.3	156.2	157.6	-165.3	0	0	0	0	110.7
270	D	36.5	Very low	42.2	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	77%	0.772	S	S	*	*			trans	86.9	106.1	167.6	-55.8	6	0	0	0	115.8
271	E	42.2	Very low	41.4	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	78%	0.783	S	S	*	*			trans	-92.3	118.7	174.9	-53.7	173.5	138.5	0	0	110.1
272	E	43.9	Very low	40.4	Very low	200 Å²	200	149.9 Å²	149.9	94%	0.935	80%	0.803	S	S	*	*			trans	-143	149.3	153.7	-80	-153.2	163.7	0	0	111.7
273	E	38.4	Very low	39.7	Very low	174 Å²	174	152.3 Å²	152.3	81%	0.813	82%	0.819	S	S	*	*			trans	-77.9	136	-175.6	-60.7	177.6	128.7	0	0	112.1
274	F	31.4	Very low	39.1	Very low	198 Å²	198	153.1 Å²	153.1	87%	0.868	82%	0.823	S	S	*	*			trans	-138.8	119.7	152.1	-149.8	-94.8	0	0	0	113.6
275	A	37.2	Very low	38.6	Very low	83 Å²	83	149.5 Å²	149.5	69%	0.686	82%	0.822	S	S	*	*			trans	-86.6	118.1	-175.9	0	0	0	0	0	112	S277	A275-S277 PolarHBondContact O-N 3.22Å
276	V	32.9	Very low	38	Very low	135 Å²	135	149.6 Å²	149.6	82%	0.818	83%	0.832	S	S	*	*			trans	-72.3	96.7	173.2	-178.3	0	0	0	0	110
277	S	36.9	Very low	37.7	Very low	118 Å²	118	147.4 Å²	147.4	83%	0.825	83%	0.831	S	S	*	*			trans	-94	106.5	176.8	-165.4	0	0	0	0	111.8	A275 K279	A275-S277 PolarHBondContact O-N 3.22Å; S277-K279 PolarHBondContact O-N 3.21Å
278	S	35.7	Very low	37.7	Very low	102 Å²	102	152.4 Å²	152.4	71%	0.713	84%	0.835	S	S	*	*			trans	-82.9	96.7	-173.4	-53.9	0	0	0	0	113.7
279	K	43.6	Very low	37.1	Very low	193 Å²	193	152.7 Å²	152.7	84%	0.839	83%	0.831	S	S	*	*			trans	-165.3	130.8	152.4	-111.5	144.4	-172.3	166	0	114.3	S277	S277-K279 PolarHBondContact O-N 3.21Å
280	P	41.3	Very low	36.5	Very low	125 Å²	125	152.2 Å²	152.2	81%	0.812	84%	0.841	S	S	*	*			trans	-77.4	155.2	173.4	33.2	-35.1	0	0	0	112.1
281	K	37	Very low	36.2	Very low	209 Å²	209	149 Å²	149	91%	0.909	84%	0.844	S	S	*	*			trans	-133.7	158.8	168.1	-78.5	-174.1	176.3	177.1	0	110.9
282	Q	35.9	Very low	35.9	Very low	197 Å²	197	143.4 Å²	143.4	92%	0.921	84%	0.838	S	S	*	*			trans	-77.1	157.3	-161.7	-69	156.8	-84.9	0	0	115
283	L	35.9	Very low	35.9	Very low	173 Å²	173	137.8 Å²	137.8	91%	0.906	83%	0.834	S	S	*	*			trans	-72.5	131.7	172.2	-71.4	165.9	0	0	0	112.9
284	Q	32.8	Very low	36.5	Very low	196 Å²	196	135.6 Å²	135.6	92%	0.916	83%	0.832	S	S	*	*			trans	-144.2	142.3	143.9	-63.2	-174.5	-6.2	0	0	106.8
285	G	34.2	Very low	37.1	Very low	76 Å²	76	134.2 Å²	134.2	78%	0.784	83%	0.828	S	S	*	*			cis	143.9	80.7	-4.4	0	0	0	0	0	112.6
286	V	32.7	Very low	37.7	Very low	150 Å²	150	136.7 Å²	136.7	91%	0.909	83%	0.83	S	S	*	*			trans	-154.2	152.3	165.7	132	0	0	0	0	109.4
287	V	34.5	Very low	38.6	Very low	129 Å²	129	137.9 Å²	137.9	78%	0.782	83%	0.826	S	S	*	*			trans	-126.2	135.3	-165.2	-174	0	0	0	0	112
288	K	38.9	Very low	39.2	Very low	198 Å²	198	138.7 Å²	138.7	86%	0.861	82%	0.821	S	S	*	*			trans	175.7	145.6	149.8	-97.1	151.4	-176.9	179.2	0	109.8
289	S	33.4	Very low	40.1	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	82%	0.819	S	S	*	*			cis	177.3	122.8	-34.7	43.4	0	0	0	0	107.3
290	G	31.1	Very low	40.7	Very low	87 Å²	87	136.2 Å²	136.2	90%	0.897	82%	0.815	S	S	*	*			trans	120.3	125.1	175.6	0	0	0	0	0	113.1
291	G	31.1	Very low	41.1	Very low	85 Å²	85	136.8 Å²	136.8	88%	0.876	81%	0.81	S	S	*	*			cis	162.2	119.1	-11.3	0	0	0	0	0	113.8
292	G	35.5	Very low	41.8	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	80%	0.8	S	S	*	*			trans	134.4	130.4	167.2	0	0	0	0	0	114.9
293	G	43.6	Very low	43.1	Very low	82 Å²	82	128.6 Å²	128.6	85%	0.845	78%	0.781	S	S	*	*			trans	81.5	51	146.4	0	0	0	0	0	120.3
294	V	50.1	Low	43.7	Very low	127 Å²	127	127.5 Å²	127.5	77%	0.77	78%	0.775	S	S	*	*			trans	-141.2	20.9	167.1	-140.7	0	0	0	0	115.2
295	H	45.1	Very low	44.8	Very low	170 Å²	170	128.7 Å²	128.7	79%	0.787	77%	0.771	S	S	*	*	S	Bend	trans	-109.7	-18.7	-174.8	-161.7	-75.4	0	0	0	115.2
296	D	48.8	Very low	45.7	Very low	134 Å²	134	130 Å²	130	72%	0.717	76%	0.757	S	S	*	*	S	Bend	trans	-84.7	-27.7	-177.8	-96.5	-27.7	0	0	0	114.1	A299	D296-A299 PolarHBondContact O-N 2.9Å
297	E	51.7	Low	46.9	Very low	160 Å²	160	129.7 Å²	129.7	75%	0.748	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-74.1	-29.2	-177.9	-61.3	-170.8	148	0	0	112.5	A299 Q300	E297-A299 PolarHBondContact O-N 3.19Å; E297-Q300 PolarHBondContact O-N 3.43Å
298	L	51.2	Low	48	Very low	135 Å²	135	130.4 Å²	130.4	71%	0.707	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-71.8	-18.5	177.1	-167.8	58.7	0	0	0	112.8	Q300 L301	L298-Q300 VanDerWaalsContact C-N 3.33Å; L298-L301 HydrophobicContact CD1-CD1 4.22Å
299	A	54.6	Low	49.1	Very low	81 Å²	81	122.6 Å²	122.6	67%	0.669	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-79	-12.6	177.1	0	0	0	0	0	113.8	D296 E297	D296-A299 PolarHBondContact O-N 2.9Å; E297-A299 PolarHBondContact O-N 3.19Å
300	Q	55.3	Low	50.1	Low	163 Å²	163	122.6 Å²	122.6	76%	0.762	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-91.9	-10.2	-177.8	-59.5	-169.4	14	0	0	113.8	E297 L298 K302	E297-Q300 PolarHBondContact O-N 3.43Å; L298-Q300 VanDerWaalsContact C-N 3.33Å; Q300-K302 PolarHBondContact O-N 2.81Å; Q300-K302 VanDerWaalsContact O-N 3.09Å
301	L	50.3	Low	50.7	Low	137 Å²	137	126 Å²	126	72%	0.717	69%	0.694	S	S	*	*			trans	-78.2	94.8	177.2	-67.8	178	0	0	0	111.2	L298	L298-L301 HydrophobicContact CD1-CD1 4.22Å
302	K	51.3	Low	51.6	Low	160 Å²	160	126.7 Å²	126.7	70%	0.696	67%	0.674	S	S	*	*			trans	-50.1	143.4	170.6	-76.2	-171.9	170.7	-160.2	0	112.3	Q300 E306	Q300-K302 PolarHBondContact O-N 2.81Å; Q300-K302 VanDerWaalsContact O-N 3.09Å; K302-E306 WeakPolarHBondContact CB-OE2 3.27Å
303	S	63.5	Low	52.4	Low	74 Å²	74	126.6 Å²	126.6	52%	0.517	66%	0.661	S	S	.	*			trans	-61.1	138.5	-169.7	-171.4	0	0	0	0	112.9	R305 E306	S303-R305 PolarHBondContact O-N 3.05Å; S303-R305 PolarHBondContact OG-N 2.93Å; S303-E306 PolarHBondContact O-N 3.34Å
304	L	48.7	Very low	52.9	Low	150 Å²	150	126.2 Å²	126.2	79%	0.785	65%	0.646	S	S	*	*	H	α-helix	trans	-55.3	-13.6	170.6	-74.4	165.5	0	0	0	113.9	K308	L304-K308 PolarHBondContact O-N 3.34Å
305	R	55.5	Low	52.8	Low	220 Å²	220	123.6 Å²	123.6	83%	0.83	63%	0.632	S	S	*	*	H	α-helix	trans	-73	-31.8	172.8	-170.3	170	-68.2	-141.2	-0.7	113.5	S303	S303-R305 PolarHBondContact O-N 3.05Å; S303-R305 PolarHBondContact OG-N 2.93Å
306	E	53.6	Low	52.9	Low	104 Å²	104	120.8 Å²	120.8	49%	0.486	62%	0.618	S	S	.	*	H	α-helix	trans	-70.4	-50.5	175.4	-68.7	-177.2	125.3	0	0	110.3	K302 S303 K308 G309 D310	K302-E306 WeakPolarHBondContact CB-OE2 3.27Å; S303-E306 PolarHBondContact O-N 3.34Å; E306-K308 PolarHBondContact O-N 3.16Å; E306-G309 WeakPolarHBondContact O-CA 3.44Å; E306-G309 PolarHBondContact O-N 2.88Å; E306-D310 PolarHBondContact O-N 2.89Å
307	K	57.8	Low	52.8	Low	143 Å²	143	121.6 Å²	121.6	62%	0.622	62%	0.617	S	S	*	*	H	α-helix	trans	-59.1	-22.1	179.4	-70.5	-171.3	174.5	-175.6	0	114.7	D310 F311	K307-D310 WeakPolarHBondContact CA-OD2 3.35Å; K307-F311 PolarHBondContact O-N 2.91Å
308	K	56.4	Low	52.8	Low	145 Å²	145	118.5 Å²	118.5	63%	0.63	61%	0.609	S	S	*	*	H	α-helix	trans	-72	-39.8	169.8	-172	-179.8	176	-173.8	0	111.8	L304 E306 E312	L304-K308 PolarHBondContact O-N 3.34Å; E306-K308 PolarHBondContact O-N 3.16Å; K308-E312 WeakPolarHBondContact O-CB 3.34Å; K308-E312 PolarHBondContact O-N 3.26Å
309	G	63.3	Low	52.5	Low	34 Å²	34	117 Å²	117	35%	0.351	60%	0.602	S	S	.	*	H	α-helix	trans	-65	-37.9	177.2	0	0	0	0	0	112.8	E306 E312 S313	E306-G309 WeakPolarHBondContact O-CA 3.44Å; E306-G309 PolarHBondContact O-N 2.88Å; G309-E312 PolarHBondContact O-N 2.98Å; G309-S313 WeakPolarHBondContact O-CB 3.44Å; G309-S313 PolarHBondContact O-N 3.44Å; G309-S313 PolarHBondContact O-OG 3.46Å
310	D	53.8	Low	52.1	Low	107 Å²	107	118.2 Å²	118.2	57%	0.572	60%	0.597	S	S	*	*	H	α-helix	trans	-62.2	-48.3	176.9	-57.3	-37.4	0	0	0	111.3	E306 K307 S313 S314	E306-D310 PolarHBondContact O-N 2.89Å; K307-D310 WeakPolarHBondContact CA-OD2 3.35Å; D310-S313 PolarHBondContact O-N 3.08Å; D310-S314 PolarHBondContact O-N 2.99Å
311	F	43.6	Very low	51.7	Low	159 Å²	159	115.9 Å²	115.9	70%	0.697	59%	0.594	S	S	*	*	H	α-helix	trans	-64.5	-42	177.9	-158.6	-93.5	0	0	0	111.9	K307 S313 S314 C315	K307-F311 PolarHBondContact O-N 2.91Å; F311-S313 PolarHBondContact O-N 3.14Å; F311-S314 PolarHBondContact O-N 2.88Å; F311-C315 PolarHBondContact O-N 3.26Å; F311-C315 PolarHBondContact O-SG 3.47Å
312	E	50.7	Low	51.4	Low	100 Å²	100	117.3 Å²	117.3	47%	0.467	60%	0.597	S	S	.	*	H	α-helix	trans	-73.6	-10.3	178	-142.1	-160.9	111.2	0	0	113.7	K308 G309 K316	K308-E312 WeakPolarHBondContact O-CB 3.34Å; K308-E312 PolarHBondContact O-N 3.26Å; G309-E312 PolarHBondContact O-N 2.98Å; E312-K316 WeakPolarHBondContact O-CG 3.41Å; E312-K316 PolarHBondContact O-NZ 2.88Å; E312-K316 IonicContact OE1-NZ 2.63Å; E312-K316 PolarHBondContact OE1-NZ 3.36Å
313	S	51.7	Low	51.1	Low	73 Å²	73	116.5 Å²	116.5	51%	0.51	59%	0.593	S	S	.	*	H	α-helix	trans	-91.1	-43.7	171.6	-57.8	0	0	0	0	111.1	G309 D310 F311 C315 K316 E317	G309-S313 WeakPolarHBondContact O-CB 3.44Å; G309-S313 PolarHBondContact O-N 3.44Å; G309-S313 PolarHBondContact O-OG 3.46Å; D310-S313 PolarHBondContact O-N 3.08Å; F311-S313 PolarHBondContact O-N 3.14Å; S313-C315 VanDerWaalsContact C-N 3.28Å; S313-C315 PolarHBondContact O-N 2.59Å; S313-K316 PolarHBondContact O-N 2.96Å; S313-E317 PolarHBondContact O-N 3.03Å
314	S	54.2	Low	50.3	Low	74 Å²	74	121.8 Å²	121.8	52%	0.517	61%	0.607	S	S	.	*	H	α-helix	trans	-56.9	-38.9	178.1	-174.7	0	0	0	0	112.7	D310 F311 K316 E317	D310-S314 PolarHBondContact O-N 2.99Å; F311-S314 PolarHBondContact O-N 2.88Å; S314-K316 PolarHBondContact O-N 3.5Å; S314-E317 PolarHBondContact O-N 2.85Å
315	C	46.8	Very low	50.2	Low	72 Å²	72	119.7 Å²	119.7	49%	0.486	60%	0.601	S	S	.	*	H	α-helix	trans	-66	-21.2	174.7	-62.6	0	0	0	0	114.2	F311 S313	F311-C315 PolarHBondContact O-N 3.26Å; F311-C315 PolarHBondContact O-SG 3.47Å; S313-C315 VanDerWaalsContact C-N 3.28Å; S313-C315 PolarHBondContact O-N 2.59Å
316	K	48.4	Very low	49.7	Very low	111 Å²	111	115.1 Å²	115.1	48%	0.483	59%	0.588	S	S	.	*	H	α-helix	trans	-94.8	-8.7	-177.8	-60.8	-174.8	-174.2	98.3	0	113.6	E312 S313 S314	E312-K316 WeakPolarHBondContact O-CG 3.41Å; E312-K316 PolarHBondContact O-NZ 2.88Å; E312-K316 IonicContact OE1-NZ 2.63Å; E312-K316 PolarHBondContact OE1-NZ 3.36Å; S313-K316 PolarHBondContact O-N 2.96Å; S314-K316 PolarHBondContact O-N 3.5Å
317	E	45.8	Very low	49.4	Very low	151 Å²	151	116.7 Å²	116.7	71%	0.706	60%	0.599	S	S	*	*	H	α-helix	trans	-79.5	-29	170.2	-91.8	-175.7	129.9	0	0	112.7	S313 S314 D319 N320	S313-E317 PolarHBondContact O-N 3.03Å; S314-E317 PolarHBondContact O-N 2.85Å; E317-D319 PolarHBondContact O-N 3.5Å; E317-N320 PolarHBondContact O-N 3.41Å
318	V	52.1	Low	48.9	Very low	96 Å²	96	117 Å²	117	58%	0.582	60%	0.602	S	S	*	*	H	α-helix	trans	-63.6	-42.8	-178.6	-157.6	0	0	0	0	111.6	N320 V321	V318-N320 PolarHBondContact O-N 2.89Å; V318-V321 PolarHBondContact O-N 2.87Å; V318-V321 VanDerWaalsContact O-N 3.15Å
319	D	44.7	Very low	48.5	Very low	103 Å²	103	117.6 Å²	117.6	55%	0.551	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-11.6	179.6	-73.9	-23.6	0	0	0	114.8	E317 K323	E317-D319 PolarHBondContact O-N 3.5Å; D319-K323 PolarHBondContact O-NZ 3.45Å
320	N	46	Very low	47.8	Very low	107 Å²	107	122.4 Å²	122.4	57%	0.572	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-8.4	-179.5	-81.4	-41.1	0	0	0	114.6	E317 V318	E317-N320 PolarHBondContact O-N 3.41Å; V318-N320 PolarHBondContact O-N 2.89Å
321	V	46.5	Very low	47.7	Very low	114 Å²	114	124.4 Å²	124.4	69%	0.691	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-36.4	175.1	-177.9	0	0	0	0	111.1	V318 K323 K324	V318-V321 PolarHBondContact O-N 2.87Å; V318-V321 VanDerWaalsContact O-N 3.15Å; V321-K323 PolarHBondContact O-N 2.99Å; V321-K323 VanDerWaalsContact O-N 3.11Å; V321-K324 PolarHBondContact O-N 3.39Å
322	E	45.6	Very low	47.9	Very low	166 Å²	166	124.2 Å²	124.2	78%	0.776	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-66.3	-12.7	-179.7	-61	-163.6	143.6	0	0	114.6	K324	E322-K324 VanDerWaalsContact C-N 3.33Å; E322-K324 PolarHBondContact O-N 3.45Å
323	K	45.2	Very low	47.9	Very low	143 Å²	143	123.9 Å²	123.9	62%	0.622	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-90.1	13.9	-176.9	-60.7	-170.2	-176.2	79.5	0	114.2	D319 V321	D319-K323 PolarHBondContact O-NZ 3.45Å; V321-K323 PolarHBondContact O-N 2.99Å; V321-K323 VanDerWaalsContact O-N 3.11Å
324	K	46.3	Very low	47.5	Very low	186 Å²	186	124.8 Å²	124.8	81%	0.809	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-120.3	13.7	-173.4	-121.4	177	-176.6	178.3	0	117.2	V321 E322	V321-K324 PolarHBondContact O-N 3.39Å; E322-K324 VanDerWaalsContact C-N 3.33Å; E322-K324 PolarHBondContact O-N 3.45Å
325	T	46.4	Very low	46.8	Very low	106 Å²	106	124.5 Å²	124.5	65%	0.65	67%	0.673	S	S	*	*			trans	-110.8	8.3	171.6	50.2	0	0	0	0	114	I327	T325-I327 PolarHBondContact O-N 2.6Å
326	Q	44.2	Very low	46.8	Very low	123 Å²	123	131 Å²	131	58%	0.575	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	55.2	177	-171.4	55.7	40.9	0	0	112.3
327	I	48.2	Very low	46.4	Very low	138 Å²	138	132.4 Å²	132.4	71%	0.708	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	-32.6	173.8	-63.3	-177.4	0	0	0	111	T325 K329	T325-I327 PolarHBondContact O-N 2.6Å; I327-K329 VanDerWaalsContact C-N 3.28Å; I327-K329 PolarHBondContact O-N 3.38Å
328	E	47.6	Very low	46.6	Very low	148 Å²	148	132.9 Å²	132.9	69%	0.692	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-75.6	-14.7	-178	-62.2	-171.8	132.3	0	0	113.9	D330 L331	E328-D330 VanDerWaalsContact C-N 3.33Å; E328-D330 PolarHBondContact O-N 3.23Å; E328-L331 PolarHBondContact O-N 2.66Å
329	K	48.3	Very low	46.2	Very low	158 Å²	158	132.2 Å²	132.2	69%	0.687	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-71.8	-23.2	-173.9	-131	166.5	-169.4	165	0	114.4	I327	I327-K329 VanDerWaalsContact C-N 3.28Å; I327-K329 PolarHBondContact O-N 3.38Å
330	D	46.8	Very low	46.1	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-92.3	-8	-178.1	-64.3	-18.8	0	0	0	113	E328	E328-D330 VanDerWaalsContact C-N 3.33Å; E328-D330 PolarHBondContact O-N 3.23Å
331	L	52	Low	45.9	Very low	150 Å²	150	132.9 Å²	132.9	79%	0.785	73%	0.729	S	S	*	*	S	Bend	trans	-94.2	-7.9	-177.7	-128.6	147.2	0	0	0	113.5	E328	E328-L331 PolarHBondContact O-N 2.66Å
332	L	47.9	Very low	45.6	Very low	154 Å²	154	132.6 Å²	132.6	81%	0.806	72%	0.72	S	S	*	*	S	Bend	trans	-100.5	9	179.3	-82	161.6	0	0	0	114.3
333	A	51.8	Low	45.8	Very low	94 Å²	94	133.3 Å²	133.3	78%	0.777	72%	0.72	S	S	*	*			trans	-83.2	-3.7	179.1	0	0	0	0	0	114.7
334	A	42.8	Very low	45.7	Very low	92 Å²	92	135.6 Å²	135.6	76%	0.76	73%	0.731	S	S	*	*	S	Bend	trans	-102.9	120.3	175.9	0	0	0	0	0	110.7
335	G	38.9	Very low	45.7	Very low	67 Å²	67	134.4 Å²	134.4	69%	0.691	73%	0.732	S	S	*	*			trans	-98.1	177.3	-166.3	0	0	0	0	0	117
336	K	46.7	Very low	45.3	Very low	208 Å²	208	134.3 Å²	134.3	90%	0.904	74%	0.735	S	S	*	*			trans	72.7	112.2	-174.7	-47.8	166.9	-174.9	175	0	111.3
337	V	40.4	Very low	44.7	Very low	142 Å²	142	132.1 Å²	132.1	86%	0.861	75%	0.746	S	S	*	*			cis	-132.6	117.9	34.9	177.6	0	0	0	0	111
338	K	50.4	Low	43.9	Very low	161 Å²	161	130.2 Å²	130.2	70%	0.7	75%	0.751	S	S	*	*			trans	-116.8	93.7	-174.8	-171.2	177.9	169.7	94.3	0	110.7	E342	K338-E342 WeakPolarHBondContact CE-OE2 3.44Å; K338-E342 WeakPolarHBondContact CG-OE2 3.48Å; K338-E342 IonicContact NZ-OE1 3.91Å; K338-E342 PolarHBondContact NZ-OE1 3.38Å; K338-E342 IonicContact NZ-OE2 3.28Å; K338-E342 PolarHBondContact NZ-OE2 2.68Å
339	A	44.1	Very low	43.1	Very low	81 Å²	81	127.7 Å²	127.7	67%	0.669	76%	0.755	S	S	*	*	S	Bend	trans	-161.1	-38.1	175.8	0	0	0	0	0	114.4
340	N	41.2	Very low	42.3	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	76%	0.76	S	S	*	*	S	Bend	trans	-124.6	14.8	-161.9	-147	30.8	0	0	0	115.6
341	A	42.8	Very low	41.4	Very low	76 Å²	76	128 Å²	128	63%	0.628	76%	0.759	S	S	*	*	S	Bend	trans	-119	-30.7	178.6	0	0	0	0	0	113.4	K343	A341-K343 PolarHBondContact O-N 2.83Å; A341-K343 VanDerWaalsContact O-N 3.17Å
342	E	39.2	Very low	40.2	Very low	108 Å²	108	127 Å²	127	51%	0.505	75%	0.754	S	S	.	*	G	3₁₀ helix	trans	-72.7	-7.1	-177.2	-62.8	-178	134.1	0	0	113.7	K338 F344	K338-E342 WeakPolarHBondContact CE-OE2 3.44Å; K338-E342 WeakPolarHBondContact CG-OE2 3.48Å; K338-E342 IonicContact NZ-OE1 3.91Å; K338-E342 PolarHBondContact NZ-OE1 3.38Å; K338-E342 IonicContact NZ-OE2 3.28Å; K338-E342 PolarHBondContact NZ-OE2 2.68Å; E342-F344 VanDerWaalsContact C-N 3.27Å; E342-F344 PolarHBondContact O-N 2.68Å
343	K	50.4	Low	39.6	Very low	181 Å²	181	123.8 Å²	123.8	79%	0.787	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-74.5	-5	177.5	-97.5	-169.9	173.8	-173.4	0	115.6	A341	A341-K343 PolarHBondContact O-N 2.83Å; A341-K343 VanDerWaalsContact O-N 3.17Å
344	F	44.4	Very low	38.5	Very low	192 Å²	192	126.8 Å²	126.8	84%	0.842	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-122.1	-3	-170.9	-92.7	-78	0	0	0	116.3	E342	E342-F344 VanDerWaalsContact C-N 3.27Å; E342-F344 PolarHBondContact O-N 2.68Å
345	I	45.4	Very low	38	Very low	161 Å²	161	129.7 Å²	129.7	83%	0.826	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	-21.1	-172.3	-60.6	-176.9	0	0	0	114.2
346	S	37.4	Very low	37.6	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	76%	0.756	S	S	*	*			trans	-111.8	86.7	178.8	62	0	0	0	0	112.9
347	G	31.8	Very low	36.9	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	75%	0.746	S	S	*	*			trans	-129.3	116.8	166.4	0	0	0	0	0	110.1
348	A	32.2	Very low	36.5	Very low	98 Å²	98	131.6 Å²	131.6	81%	0.81	75%	0.746	S	S	*	*			trans	-151	128	179.6	0	0	0	0	0	110.8
349	A	31	Very low	35.4	Very low	95 Å²	95	129.8 Å²	129.8	79%	0.785	75%	0.754	S	S	*	*			trans	60.9	153.3	173.6	0	0	0	0	0	116.7
350	L	29.9	Very low	34.9	Very low	149 Å²	149	129.9 Å²	129.9	78%	0.78	76%	0.755	S	S	*	*			cis	-157.9	154.4	-27.8	-87.5	168.2	0	0	0	102.2
351	E	27.7	Very low	34.9	Very low	149 Å²	149	130.2 Å²	130.2	70%	0.696	76%	0.757	S	S	*	*			cis	-163.3	176.1	13.9	-132.4	171.9	-105.9	0	0	106.9
352	N	28	Very low	34.7	Very low	130 Å²	130	138.6 Å²	138.6	70%	0.695	77%	0.772	S	S	*	*			cis	-145.3	-128.4	1.9	-163.9	-58	0	0	0	107.9
353	S	35.5	Very low	34.8	Very low	86 Å²	86	140.6 Å²	140.6	60%	0.601	79%	0.786	S	S	*	*			trans	-67.9	166.9	170.1	69.1	0	0	0	0	112.5
354	D	27.3	Very low	34.8	Very low	157 Å²	157	137.5 Å²	137.5	84%	0.84	79%	0.785	S	S	*	*			cis	-129.4	162.1	42.4	-67.3	-36.3	0	0	0	115.9
355	D	34.2	Very low	34.8	Very low	153 Å²	153	132.5 Å²	132.5	82%	0.818	77%	0.766	S	S	*	*			trans	-108.2	118.8	-171.4	-170.8	-62.9	0	0	0	110.9
356	E	30.3	Very low	34.6	Very low	175 Å²	175	131.8 Å²	131.8	82%	0.818	76%	0.763	S	S	*	*			trans	-157.1	109	168.3	-84.9	-60.6	174.9	0	0	110.2
357	S	31	Very low	34.4	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	76%	0.763	S	S	*	*				163.4	101.3	122.6	47	0	0	0	0	116.1
358	E	32	Very low	34.6	Very low	182 Å²	182	140.6 Å²	140.6	85%	0.85	77%	0.765	S	S	*	*			trans	76.9	147	131.5	-58.6	-164.9	151.9	0	0	124.7
359	S	27.2	Very low	34.7	Very low	123 Å²	123	139.7 Å²	139.7	86%	0.86	77%	0.765	S	S	*	*			trans	76.3	123.5	168.1	75.2	0	0	0	0	117.7
360	A	34.6	Very low	34.8	Very low	84 Å²	84	140.4 Å²	140.4	69%	0.694	77%	0.765	S	S	*	*			cis	-153.2	170.7	-2.9	0	0	0	0	0	113.6
361	D	41	Very low	35.2	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	77%	0.771	S	S	*	*			trans	62.4	90.8	161.6	-61.3	-28.8	0	0	0	120.1
362	R	37.9	Very low	35.7	Very low	252 Å²	252	146 Å²	146	95%	0.951	78%	0.78	S	S	*	*			trans	-147.1	164.4	135.9	-77	-142.9	172.4	-133.6	-10.3	113.5
363	D	40.8	Very low	36	Very low	149 Å²	149	144.7 Å²	144.7	80%	0.797	79%	0.788	S	S	*	*			trans	-68.3	125.7	-158.8	-152	-38.2	0	0	0	115.2	N365	D363-N365 PolarHBondContact O-N 2.9Å; D363-N365 VanDerWaalsContact O-N 3.17Å
364	P	52.3	Low	35.9	Very low	117 Å²	117	149.1 Å²	149.1	76%	0.76	80%	0.799	S	S	*	*			trans	-90.9	67.2	-167.1	37.1	-38.6	0	0	0	114.3
365	N	42.8	Very low	36.1	Very low	86 Å²	86	150.2 Å²	150.2	46%	0.46	80%	0.796	S	S	.	*			trans	-150.3	35.9	179.6	-156.6	16.8	0	0	0	117.4	D363	D363-N365 PolarHBondContact O-N 2.9Å; D363-N365 VanDerWaalsContact O-N 3.17Å
366	I	41.2	Very low	36.4	Very low	146 Å²	146	148.4 Å²	148.4	75%	0.749	79%	0.79	S	S	*	*			trans	-138.8	109.1	163.9	-57.6	-178.5	0	0	0	110.1
367	I	34.1	Very low	36.9	Very low	140 Å²	140	147.4 Å²	147.4	72%	0.718	79%	0.786	S	S	*	*			trans	-97.4	131.1	172.8	-60.1	174.3	0	0	0	109.9
368	R	35.6	Very low	37.3	Very low	226 Å²	226	149.4 Å²	149.4	85%	0.853	79%	0.788	S	S	*	*			trans	-140.6	118.1	157	-70.8	-166.8	178.4	104.1	-0.4	109
369	G	33.7	Very low	37.9	Very low	79 Å²	79	147.5 Å²	147.5	81%	0.814	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.5	143.7	-170.2	0	0	0	0	0	115
370	S	34.3	Very low	39	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88.5	129.7	177	55	0	0	0	0	112.6
371	K	38.9	Very low	40	Very low	209 Å²	209	154.2 Å²	154.2	91%	0.909	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.2	129.6	162.9	-76.2	-176.1	174.8	-179	0	109.7
372	K	36.7	Very low	40.6	Very low	205 Å²	205	151.9 Å²	151.9	89%	0.891	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-73.4	142.7	167.8	-70	-175.7	175.6	-178.4	0	110
373	A	34.2	Very low	41.7	Very low	103 Å²	103	144 Å²	144	85%	0.851	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-100.4	151.5	172.5	0	0	0	0	0	110.8
374	E	34.4	Very low	42.6	Very low	180 Å²	180	139 Å²	139	84%	0.841	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-90.4	133.6	-178.4	-172.5	174	175.7	0	0	110.5	V376	E374-V376 PolarHBondContact O-N 3.19Å
375	K	32.1	Very low	43.1	Very low	180 Å²	180	137.1 Å²	137.1	78%	0.783	72%	0.719	S	S	*	*			trans	-89.1	105.6	-176.5	-174.8	-179.8	177.9	-176.2	0	110.7
376	V	39.6	Very low	43.8	Very low	114 Å²	114	137.9 Å²	137.9	69%	0.691	72%	0.721	S	S	*	*			trans	-93	128.6	168.8	-179.9	0	0	0	0	109.3	E374 L378	E374-V376 PolarHBondContact O-N 3.19Å; V376-L378 HydrophobicContact CG1-CD2 4.39Å
377	E	41.3	Very low	44.5	Very low	155 Å²	155	137.9 Å²	137.9	72%	0.724	72%	0.716	S	S	*	*			trans	-85.9	141.1	174.6	-59.5	-171.9	146.7	0	0	110.6
378	L	39.5	Very low	45.7	Very low	142 Å²	142	135 Å²	135	74%	0.743	70%	0.702	S	S	*	*			trans	-120.9	126.5	-178.7	-63.4	178.9	0	0	0	110.5	V376	V376-L378 HydrophobicContact CG1-CD2 4.39Å
379	N	44.8	Very low	46.9	Very low	142 Å²	142	130.7 Å²	130.7	76%	0.759	69%	0.69	S	S	*	*			trans	-80.2	138.2	-176.8	-68.9	-26.4	0	0	0	112.1	E381	N379-E381 VanDerWaalsContact C-N 3.34Å; N379-E381 PolarHBondContact O-N 3.39Å
380	F	49.2	Very low	47.8	Very low	177 Å²	177	136.1 Å²	136.1	78%	0.776	69%	0.686	S	S	*	*			trans	-84.8	7.3	-172.3	-80.7	-92.1	0	0	0	115.5	N382 V383	F380-N382 PolarHBondContact O-N 3.4Å; F380-V383 HydrophobicContact CD1-CG2 4.32Å; F380-V383 WeakPolarHBondContact O-CG2 3.35Å
381	E	55.6	Low	48.8	Very low	171 Å²	171	138.6 Å²	138.6	80%	0.799	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-32.1	-167.8	-59.9	-171.2	135.1	0	0	113.8	N379 V383	N379-E381 VanDerWaalsContact C-N 3.34Å; N379-E381 PolarHBondContact O-N 3.39Å; E381-V383 VanDerWaalsContact C-N 3.32Å; E381-V383 PolarHBondContact O-N 2.9Å
382	N	54.7	Low	49.4	Very low	106 Å²	106	136 Å²	136	57%	0.567	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	4.9	-176.2	-64.7	105.7	0	0	0	115.6	F380 G384 D385 I386	F380-N382 PolarHBondContact O-N 3.4Å; N382-G384 PolarHBondContact O-N 3.08Å; N382-D385 PolarHBondContact ND2-OD2 3.06Å; N382-D385 PolarHBondContact O-N 3.16Å; N382-D385 VanDerWaalsContact O-N 3.1Å; N382-I386 PolarHBondContact O-N 3.09Å
383	V	60.4	Low	50.1	Low	86 Å²	86	129.2 Å²	129.2	52%	0.521	66%	0.662	S	S	.	*	H	α-helix	trans	-62.6	-25.8	177.8	177.9	0	0	0	0	111.9	F380 E381 K387	F380-V383 HydrophobicContact CD1-CG2 4.32Å; F380-V383 WeakPolarHBondContact O-CG2 3.35Å; E381-V383 VanDerWaalsContact C-N 3.32Å; E381-V383 PolarHBondContact O-N 2.9Å; V383-K387 PolarHBondContact O-N 3.2Å
384	G	59.4	Low	51	Low	43 Å²	43	130.6 Å²	130.6	44%	0.443	66%	0.655	S	S	.	*	H	α-helix	trans	-63.5	-42.2	171.9	0	0	0	0	0	113.6	N382 K387 N388	N382-G384 PolarHBondContact O-N 3.08Å; G384-K387 PolarHBondContact O-N 3.41Å; G384-N388 PolarHBondContact O-N 2.89Å
385	D	61.7	Low	52	Low	79 Å²	79	125.9 Å²	125.9	42%	0.422	64%	0.639	S	S	.	*	H	α-helix	trans	-67.7	-40.3	-176.4	-56.5	-44.8	0	0	0	111.7	N382 K387 N388 K389	N382-D385 PolarHBondContact ND2-OD2 3.06Å; N382-D385 PolarHBondContact O-N 3.16Å; N382-D385 VanDerWaalsContact O-N 3.1Å; D385-K387 VanDerWaalsContact C-N 3.28Å; D385-K387 PolarHBondContact O-N 3.46Å; D385-N388 PolarHBondContact O-N 3.37Å; D385-N388 VanDerWaalsContact O-N 3.16Å; D385-K389 PolarHBondContact O-N 2.9Å
386	I	57.9	Low	53.1	Low	101 Å²	101	124.4 Å²	124.4	52%	0.518	63%	0.634	S	S	.	*	H	α-helix	trans	-60.1	-41.8	176.3	-60.7	171.7	0	0	0	110	N382 N388 K389 W390	N382-I386 PolarHBondContact O-N 3.09Å; I386-N388 VanDerWaalsContact C-N 3.28Å; I386-N388 PolarHBondContact O-N 2.98Å; I386-K389 PolarHBondContact O-N 2.92Å; I386-W390 PolarHBondContact O-N 2.89Å; I386-W390 VanDerWaalsContact O-N 3.15Å
387	K	56.2	Low	54.2	Low	147 Å²	147	123.1 Å²	123.1	64%	0.639	63%	0.627	S	S	*	*	H	α-helix	trans	-69.9	-22.4	179	-162.6	167.4	-171.3	168.3	0	113.6	V383 G384 D385 K391	V383-K387 PolarHBondContact O-N 3.2Å; G384-K387 PolarHBondContact O-N 3.41Å; D385-K387 VanDerWaalsContact C-N 3.28Å; D385-K387 PolarHBondContact O-N 3.46Å; K387-K391 WeakPolarHBondContact O-CG 3.44Å
388	N	59.5	Low	54.8	Low	80 Å²	80	119.4 Å²	119.4	43%	0.428	62%	0.623	S	S	.	*	H	α-helix	trans	-82.5	-43.5	171.9	-70.3	-22	0	0	0	111.6	G384 D385 I386 W390 K391 E392	G384-N388 PolarHBondContact O-N 2.89Å; D385-N388 PolarHBondContact O-N 3.37Å; D385-N388 VanDerWaalsContact O-N 3.16Å; I386-N388 VanDerWaalsContact C-N 3.28Å; I386-N388 PolarHBondContact O-N 2.98Å; N388-W390 VanDerWaalsContact C-N 3.26Å; N388-W390 PolarHBondContact O-N 3.48Å; N388-K391 WeakPolarHBondContact O-CA 3.49Å; N388-K391 WeakPolarHBondContact O-CB 3.36Å; N388-K391 PolarHBondContact O-N 2.82Å; N388-E392 PolarHBondContact O-N 3.13Å
389	K	61.3	Low	55.6	Low	134 Å²	134	119.7 Å²	119.7	58%	0.583	62%	0.62	S	S	*	*	H	α-helix	trans	-57.1	-36.8	175.5	-72.2	177	178.8	177.9	0	113.2	D385 I386 E392	D385-K389 PolarHBondContact O-N 2.9Å; I386-K389 PolarHBondContact O-N 2.92Å; K389-E392 PolarHBondContact O-N 2.67Å
390	W	51.3	Low	56.2	Low	194 Å²	194	115.5 Å²	115.5	74%	0.735	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-29.1	172.1	-89.2	29.8	0	0	0	114.1	I386 N388 V395	I386-W390 PolarHBondContact O-N 2.89Å; I386-W390 VanDerWaalsContact O-N 3.15Å; N388-W390 VanDerWaalsContact C-N 3.26Å; N388-W390 PolarHBondContact O-N 3.48Å; W390-V395 VanDerWaalsContact CD1-CG2 3.5Å; W390-V395 HydrophobicContact CG-CG2 4.25Å
391	K	55.9	Low	56.8	Low	162 Å²	162	113.4 Å²	113.4	70%	0.704	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-28.5	176.1	-74.4	175.6	174.3	-178	0	113.1	K387 N388 G393	K387-K391 WeakPolarHBondContact O-CG 3.44Å; N388-K391 WeakPolarHBondContact O-CA 3.49Å; N388-K391 WeakPolarHBondContact O-CB 3.36Å; N388-K391 PolarHBondContact O-N 2.82Å; K391-G393 PolarHBondContact O-N 2.81Å
392	E	52.2	Low	57.2	Low	154 Å²	154	111.5 Å²	111.5	72%	0.72	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	1.5	179.1	-68.2	174.7	168.1	0	0	112.9	N388 K389 N394	N388-E392 PolarHBondContact O-N 3.13Å; K389-E392 PolarHBondContact O-N 2.67Å; E392-N394 PolarHBondContact O-N 2.85Å
393	G	50.1	Low	57.6	Low	64 Å²	64	109.4 Å²	109.4	66%	0.66	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.3	-0.6	171.9	0	0	0	0	0	115.3	K391 V395	K391-G393 PolarHBondContact O-N 2.81Å; G393-V395 VanDerWaalsContact C-N 3.31Å; G393-V395 PolarHBondContact O-N 3.01Å; G393-V395 VanDerWaalsContact O-N 3.09Å
394	N	54.5	Low	57.8	Low	132 Å²	132	107.9 Å²	107.9	71%	0.706	58%	0.581	S	S	*	*			trans	-88.7	65.6	-178.9	-162.8	100.5	0	0	0	111.7	E392	E392-N394 PolarHBondContact O-N 2.85Å
395	V	53.9	Low	58	Low	81 Å²	81	111.7 Å²	111.7	49%	0.491	59%	0.587	S	S	.	*			trans	-105.6	120.3	167.2	178.3	0	0	0	0	108	W390 G393 T397	W390-V395 VanDerWaalsContact CD1-CG2 3.5Å; W390-V395 HydrophobicContact CG-CG2 4.25Å; G393-V395 VanDerWaalsContact C-N 3.31Å; G393-V395 PolarHBondContact O-N 3.01Å; G393-V395 VanDerWaalsContact O-N 3.09Å; V395-T397 PolarHBondContact O-N 3.26Å
396	E	56.9	Low	58.2	Low	148 Å²	148	117.3 Å²	117.3	69%	0.692	60%	0.602	S	S	*	*			trans	-62.8	123.8	174.7	-63.9	179.6	148.3	0	0	109.7
397	T	61.3	Low	58.8	Low	88 Å²	88	119.8 Å²	119.8	54%	0.54	61%	0.61	S	S	.	*			trans	-72.4	151.1	178.6	53.2	0	0	0	0	110.9	V395 E399 A400	V395-T397 PolarHBondContact O-N 3.26Å; T397-E399 PolarHBondContact O-N 3.28Å; T397-A400 WeakPolarHBondContact O-CB 3.37Å; T397-A400 PolarHBondContact O-N 2.78Å
398	A	54.7	Low	59.2	Low	76 Å²	76	119.4 Å²	119.4	63%	0.628	61%	0.61	S	S	*	*	H	α-helix	trans	-55.7	-36.9	-177.1	0	0	0	0	0	113	A400 K401 E402	A398-A400 PolarHBondContact O-N 3.33Å; A398-K401 PolarHBondContact O-N 2.79Å; A398-E402 PolarHBondContact O-N 3.05Å
399	E	55.3	Low	59.2	Low	149 Å²	149	121 Å²	121	70%	0.696	62%	0.618	S	S	*	*	H	α-helix	trans	-55.5	-31.9	174.5	-66.3	-179.6	110.9	0	0	113.3	T397 A403	T397-E399 PolarHBondContact O-N 3.28Å; E399-A403 WeakPolarHBondContact O-CB 3.25Å; E399-A403 PolarHBondContact O-N 3.06Å
400	A	57.3	Low	59	Low	54 Å²	54	121.5 Å²	121.5	45%	0.446	62%	0.622	S	S	.	*	H	α-helix	trans	-71.5	-33.1	178.2	0	0	0	0	0	112.2	T397 A398 A404	T397-A400 WeakPolarHBondContact O-CB 3.37Å; T397-A400 PolarHBondContact O-N 2.78Å; A398-A400 PolarHBondContact O-N 3.33Å; A400-A404 PolarHBondContact O-N 3.36Å
401	K	62.9	Low	59.4	Low	133 Å²	133	116 Å²	116	58%	0.578	62%	0.618	S	S	*	*	H	α-helix	trans	-75.6	-46.1	172.9	-77.9	-168.3	171.8	-172.7	0	112	A398 A403 A404 E405	A398-K401 PolarHBondContact O-N 2.79Å; K401-A403 VanDerWaalsContact C-N 3.26Å; K401-A403 PolarHBondContact O-N 3.36Å; K401-A404 WeakPolarHBondContact O-CB 3.18Å; K401-A404 PolarHBondContact O-N 3.25Å; K401-E405 PolarHBondContact O-N 3.3Å
402	E	62.8	Low	59.4	Low	130 Å²	130	115 Å²	115	61%	0.607	62%	0.62	S	S	*	*	H	α-helix	trans	-57.9	-40.3	172.9	-80.3	-169.1	100.9	0	0	111.4	A398 A404 R406	A398-E402 PolarHBondContact O-N 3.05Å; E402-A404 VanDerWaalsContact C-N 3.29Å; E402-A404 PolarHBondContact O-N 3.47Å; E402-R406 WeakPolarHBondContact O-CB 3.26Å; E402-R406 PolarHBondContact O-N 3.04Å
403	A	63.7	Low	59.4	Low	63 Å²	63	116 Å²	116	52%	0.521	62%	0.622	S	S	.	*	H	α-helix	trans	-66	-28.4	175.9	0	0	0	0	0	113.5	E399 K401 K407	E399-A403 WeakPolarHBondContact O-CB 3.25Å; E399-A403 PolarHBondContact O-N 3.06Å; K401-A403 VanDerWaalsContact C-N 3.26Å; K401-A403 PolarHBondContact O-N 3.36Å; A403-K407 WeakPolarHBondContact O-CB 3.44Å; A403-K407 PolarHBondContact O-N 3.15Å
404	A	65.5	Low	59.4	Low	54 Å²	54	116.6 Å²	116.6	45%	0.446	63%	0.628	S	S	.	*	H	α-helix	trans	-75.3	-53	173.7	0	0	0	0	0	111.4	A400 K401 E402 R406 K407 E408	A400-A404 PolarHBondContact O-N 3.36Å; K401-A404 WeakPolarHBondContact O-CB 3.18Å; K401-A404 PolarHBondContact O-N 3.25Å; E402-A404 VanDerWaalsContact C-N 3.29Å; E402-A404 PolarHBondContact O-N 3.47Å; A404-R406 VanDerWaalsContact C-N 3.31Å; A404-R406 PolarHBondContact O-N 3.03Å; A404-K407 WeakPolarHBondContact O-CA 3.49Å; A404-K407 WeakPolarHBondContact O-CB 3.16Å; A404-K407 PolarHBondContact O-N 2.93Å; A404-E408 PolarHBondContact O-N 2.84Å
405	E	63.7	Low	59.3	Low	122 Å²	122	113.3 Å²	113.3	57%	0.57	63%	0.626	S	S	*	*	H	α-helix	trans	-60.7	-40.1	179.1	-68.8	-179.3	144.9	0	0	111.6	K401 K407 E408 L409	K401-E405 PolarHBondContact O-N 3.3Å; E405-K407 PolarHBondContact O-N 3.47Å; E405-E408 PolarHBondContact O-N 2.85Å; E405-L409 WeakPolarHBondContact O-CB 3.3Å; E405-L409 WeakPolarHBondContact O-CG 3.34Å; E405-L409 PolarHBondContact O-N 3.33Å
406	R	66.1	Low	59.1	Low	197 Å²	197	116.2 Å²	116.2	74%	0.743	64%	0.643	S	S	*	*	H	α-helix	trans	-64.8	-28.3	176.2	-162.3	178	-154.7	-155.9	7.8	112.7	E402 A404 E410	E402-R406 WeakPolarHBondContact O-CB 3.26Å; E402-R406 PolarHBondContact O-N 3.04Å; A404-R406 VanDerWaalsContact C-N 3.31Å; A404-R406 PolarHBondContact O-N 3.03Å; R406-E410 WeakPolarHBondContact O-CB 3.44Å; R406-E410 PolarHBondContact O-N 3.46Å
407	K	69.4	Low	58.4	Low	154 Å²	154	112 Å²	112	67%	0.67	63%	0.63	S	S	*	*	H	α-helix	trans	-79.5	-33.7	176.5	-170.6	178.1	-178.4	-177.3	0	112.1	A403 A404 E405 E410 A411	A403-K407 WeakPolarHBondContact O-CB 3.44Å; A403-K407 PolarHBondContact O-N 3.15Å; A404-K407 WeakPolarHBondContact O-CA 3.49Å; A404-K407 WeakPolarHBondContact O-CB 3.16Å; A404-K407 PolarHBondContact O-N 2.93Å; E405-K407 PolarHBondContact O-N 3.47Å; K407-E410 PolarHBondContact O-N 3.49Å; K407-A411 PolarHBondContact O-N 2.91Å
408	E	65.5	Low	57.4	Low	138 Å²	138	113.3 Å²	113.3	65%	0.645	64%	0.638	S	S	*	*	H	α-helix	trans	-68.6	-42.2	168.7	-67.2	-165.6	129.7	0	0	111.7	A404 E405 E410 A411 L412	A404-E408 PolarHBondContact O-N 2.84Å; E405-E408 PolarHBondContact O-N 2.85Å; E408-E410 PolarHBondContact O-N 2.87Å; E408-A411 WeakPolarHBondContact O-CB 3.39Å; E408-A411 PolarHBondContact O-N 2.94Å; E408-L412 WeakPolarHBondContact O-CG 3.19Å; E408-L412 PolarHBondContact O-N 3.26Å
409	L	58	Low	56.9	Low	113 Å²	113	117.3 Å²	117.3	59%	0.592	64%	0.641	S	S	*	*	H	α-helix	trans	-64.2	-26.6	173.5	-72.6	169.5	0	0	0	113.2	E405	E405-L409 WeakPolarHBondContact O-CB 3.3Å; E405-L409 WeakPolarHBondContact O-CG 3.34Å; E405-L409 PolarHBondContact O-N 3.33Å
410	E	57.3	Low	56.4	Low	145 Å²	145	116 Å²	116	68%	0.678	64%	0.639	S	S	*	*	H	α-helix	trans	-77.8	-37.2	172.2	-170.6	159.1	-131.7	0	0	112	R406 K407 E408 L412 K413	R406-E410 WeakPolarHBondContact O-CB 3.44Å; R406-E410 PolarHBondContact O-N 3.46Å; K407-E410 PolarHBondContact O-N 3.49Å; E408-E410 PolarHBondContact O-N 2.87Å; E410-L412 VanDerWaalsContact C-N 3.33Å; E410-L412 PolarHBondContact O-N 3.41Å; E410-K413 PolarHBondContact O-N 2.78Å
411	A	60.1	Low	56	Low	78 Å²	78	123.7 Å²	123.7	65%	0.645	66%	0.656	S	S	*	*	H	α-helix	trans	-63.5	-38	170.9	0	0	0	0	0	112.3	K407 E408 K413 G414	K407-A411 PolarHBondContact O-N 2.91Å; E408-A411 WeakPolarHBondContact O-CB 3.39Å; E408-A411 PolarHBondContact O-N 2.94Å; A411-K413 PolarHBondContact O-N 3.47Å; A411-G414 PolarHBondContact O-N 2.93Å
412	L	56.9	Low	54.7	Low	142 Å²	142	126.3 Å²	126.3	74%	0.743	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-7.3	177.2	-73.9	166	0	0	0	114.3	E408 E410 G414	E408-L412 WeakPolarHBondContact O-CG 3.19Å; E408-L412 PolarHBondContact O-N 3.26Å; E410-L412 VanDerWaalsContact C-N 3.33Å; E410-L412 PolarHBondContact O-N 3.41Å; L412-G414 PolarHBondContact O-N 3.33Å
413	K	51	Low	53.7	Low	174 Å²	174	128.6 Å²	128.6	76%	0.757	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	2.8	171	-79.6	177.7	178.2	177.4	0	114.3	E410 A411 G415	E410-K413 PolarHBondContact O-N 2.78Å; A411-K413 PolarHBondContact O-N 3.47Å; K413-G415 PolarHBondContact O-N 3.3Å
414	G	50.2	Low	52.5	Low	78 Å²	78	135.2 Å²	135.2	80%	0.804	70%	0.696	S	S	*	*			trans	-68.3	36.5	174.2	0	0	0	0	0	116.1	A411 L412	A411-G414 PolarHBondContact O-N 2.93Å; L412-G414 PolarHBondContact O-N 3.33Å
415	G	51.9	Low	51	Low	63 Å²	63	143.5 Å²	143.5	65%	0.649	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-103	130.1	178.7	0	0	0	0	0	112.5	K413 S417	K413-G415 PolarHBondContact O-N 3.3Å; G415-S417 PolarHBondContact O-N 3.29Å
416	V	51.4	Low	49.6	Very low	141 Å²	141	140.6 Å²	140.6	86%	0.855	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-66	129.1	-178.8	179.3	0	0	0	0	111.3
417	S	41	Very low	48.4	Very low	61 Å²	61	139 Å²	139	43%	0.427	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-60	134.1	-179.3	-179.4	0	0	0	0	113	G415 K419 D420	G415-S417 PolarHBondContact O-N 3.29Å; S417-K419 PolarHBondContact O-N 2.86Å; S417-K419 PolarHBondContact OG-N 2.61Å; S417-K419 VanDerWaalsContact OG-N 3.12Å; S417-D420 PolarHBondContact O-N 2.68Å
418	V	40.1	Very low	47.2	Very low	114 Å²	114	138.2 Å²	138.2	69%	0.691	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-61.2	-27	170.5	-179.6	0	0	0	0	111.3	D420 R421	V418-D420 PolarHBondContact O-N 2.86Å; V418-R421 WeakPolarHBondContact O-CB 3.37Å; V418-R421 PolarHBondContact O-N 2.83Å
419	K	44.4	Very low	45.7	Very low	160 Å²	160	138.3 Å²	138.3	70%	0.696	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-73.2	-12.1	-177	-146.2	157	-172.1	164	0	113.7	S417	S417-K419 PolarHBondContact O-N 2.86Å; S417-K419 PolarHBondContact OG-N 2.61Å; S417-K419 VanDerWaalsContact OG-N 3.12Å
420	D	46.1	Very low	45.1	Very low	122 Å²	122	142.5 Å²	142.5	65%	0.652	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-95.5	-4.4	168.4	-67.8	-61.4	0	0	0	113.1	S417 V418	S417-D420 PolarHBondContact O-N 2.68Å; V418-D420 PolarHBondContact O-N 2.86Å
421	R	48	Very low	44.2	Very low	216 Å²	216	144.4 Å²	144.4	82%	0.815	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-14.1	179.4	-160.4	168.3	-178.4	158.8	-2.1	113.6	V418	V418-R421 WeakPolarHBondContact O-CB 3.37Å; V418-R421 PolarHBondContact O-N 2.83Å
422	F	34.8	Very low	43.3	Very low	187 Å²	187	146.9 Å²	146.9	82%	0.82	77%	0.765	S	S	*	*			trans	-122.8	83.3	172.1	-94.6	-91.4	0	0	0	110.7
423	K	42.9	Very low	42.1	Very low	178 Å²	178	146.3 Å²	146.3	77%	0.774	77%	0.767	S	S	*	*			trans	-121.8	137	157.6	-118.1	168	-174.6	161.6	0	107.5	R425	K423-R425 PolarHBondContact O-N 2.94Å
424	E	38.4	Very low	41.4	Very low	202 Å²	202	146.3 Å²	146.3	94%	0.944	77%	0.77	S	S	*	*			trans	-61.4	127.4	-169.7	-61.6	173.2	132.4	0	0	111.1
425	R	33.4	Very low	40.6	Very low	228 Å²	228	153 Å²	153	86%	0.86	77%	0.771	S	S	*	*			trans	-98.4	105.8	168.9	-175.7	-173.3	-69.3	-144.8	-0.8	107.9	K423	K423-R425 PolarHBondContact O-N 2.94Å
426	G	35.3	Very low	39.8	Very low	61 Å²	61	155.4 Å²	155.4	63%	0.629	78%	0.778	S	S	*	*			trans	-75.5	167.4	169	0	0	0	0	0	112.3	N428	G426-N428 PolarHBondContact O-N 2.93Å
427	D	39.3	Very low	39	Very low	165 Å²	165	159.2 Å²	159.2	88%	0.882	78%	0.777	S	S	*	*	S	Bend	trans	-63.8	94.1	178.6	-74.5	-94.1	0	0	0	113.7
428	N	45.2	Very low	39.1	Very low	137 Å²	137	162.9 Å²	162.9	73%	0.733	79%	0.792	S	S	*	*			trans	-168.8	-177.5	133.7	-115.5	-69.2	0	0	0	113.9	G426	G426-N428 PolarHBondContact O-N 2.93Å
429	D	34.1	Very low	39.4	Very low	139 Å²	139	166 Å²	166	74%	0.743	80%	0.797	S	S	*	*			trans	75.8	91.1	165.6	-57.8	-23.9	0	0	0	117.1	Q431	D429-Q431 PolarHBondContact O-N 2.83Å
430	E	44.4	Very low	40	Very low	202 Å²	202	165.4 Å²	165.4	94%	0.944	80%	0.801	S	S	*	*			trans	-67.8	111.9	155.4	-65.7	-177.5	111.7	0	0	110.2
431	Q	38.4	Very low	40.5	Very low	184 Å²	184	167.9 Å²	167.9	86%	0.86	81%	0.808	S	S	*	*			trans	-145.9	124.7	155.9	-136.1	173.6	42	0	0	112.8	D429	D429-Q431 PolarHBondContact O-N 2.83Å
432	V	41.5	Very low	40.7	Very low	130 Å²	130	164.3 Å²	164.3	79%	0.788	81%	0.805	S	S	*	*			trans	-86.2	123.4	178.4	178.5	0	0	0	0	109.5	E434	V432-E434 HydrophobicContact CG1-CG 4.31Å
433	V	32.2	Very low	41.2	Very low	131 Å²	131	160.3 Å²	160.3	79%	0.794	80%	0.8	S	S	*	*			trans	-133.4	110.8	159.9	-177.9	0	0	0	0	107.9
434	E	36.9	Very low	42.1	Very low	174 Å²	174	156 Å²	156	81%	0.813	79%	0.789	S	S	*	*			trans	-69.4	149.1	176.9	-61.4	-176.6	125.2	0	0	111.1	V432	V432-E434 HydrophobicContact CG1-CG 4.31Å
435	R	32	Very low	43.2	Very low	217 Å²	217	149.9 Å²	149.9	82%	0.819	77%	0.768	S	S	*	*			trans	-109.8	109.3	166.6	-112.9	178	-74.6	148.2	-2.8	108.6
436	S	35.1	Very low	44.3	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	76%	0.756	S	S	*	*			trans	-66.1	139.1	174.1	43.5	0	0	0	0	111
437	W	34.7	Very low	45.6	Very low	221 Å²	221	142.1 Å²	142.1	84%	0.837	75%	0.747	S	S	*	*			trans	-122.3	133.3	165.9	-68.3	84.7	0	0	0	107.1	K439	W437-K439 PolarHBondContact O-N 3.39Å
438	N	44.8	Very low	46.7	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	72%	0.721	S	S	*	*			trans	-65.1	126.9	178.8	-77.7	-15.7	0	0	0	109.6
439	K	46.6	Very low	47.3	Very low	180 Å²	180	136 Å²	136	78%	0.783	72%	0.716	S	S	*	*	S	Bend	trans	-89.3	-13.1	-168.6	-167.7	166.2	-179.5	172.5	0	113.3	W437	W437-K439 PolarHBondContact O-N 3.39Å
440	D	56.7	Low	48.6	Very low	147 Å²	147	132.4 Å²	132.4	79%	0.786	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-8.2	-164.3	-50.3	-57.8	0	0	0	113.9
441	E	56.5	Low	49.6	Very low	173 Å²	173	131.8 Å²	131.8	81%	0.808	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-12.1	177.1	-67.2	-176.9	178.8	0	0	113.6
442	L	51.8	Low	50.9	Low	142 Å²	142	130.3 Å²	130.3	74%	0.743	69%	0.685	S	S	*	*	S	Bend	trans	-102.2	86.4	170.1	-94.7	74.5	0	0	0	110.7	T444	L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 2.76Å
443	S	45	Very low	52	Low	103 Å²	103	127.2 Å²	127.2	72%	0.72	67%	0.669	S	S	*	*			trans	-70.2	80.9	174.6	-169.9	0	0	0	0	111.9	S445	S443-S445 PolarHBondContact O-N 2.79Å; S443-S445 PolarHBondContact OG-OG 3.24Å
444	T	61.4	Low	53.1	Low	88 Å²	88	128.2 Å²	128.2	54%	0.54	66%	0.663	S	S	.	*			trans	-87.2	20.7	170.7	62.4	0	0	0	0	112.3	L442 A447 A448	L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 2.76Å; T444-A447 PolarHBondContact O-N 3.48Å; T444-A448 WeakPolarHBondContact O-CB 3.42Å; T444-A448 PolarHBondContact O-N 2.93Å
445	S	61.1	Low	54.4	Low	73 Å²	73	127.5 Å²	127.5	51%	0.51	66%	0.662	S	S	.	*	H	α-helix	trans	-56.3	-55.9	-172.6	53.5	0	0	0	0	112.1	S443 A447 A448 E449	S443-S445 PolarHBondContact O-N 2.79Å; S443-S445 PolarHBondContact OG-OG 3.24Å; S445-A447 VanDerWaalsContact C-N 3.3Å; S445-A447 PolarHBondContact O-N 3.49Å; S445-A448 CarbonylContact O-C 3.6Å; S445-A448 PolarHBondContact O-N 3.46Å; S445-A448 VanDerWaalsContact O-N 3.11Å; S445-E449 VanDerWaalsContact O-CB 3.27Å; S445-E449 WeakPolarHBondContact O-CB 3.4Å; S445-E449 PolarHBondContact O-N 3.31Å
446	A	57.5	Low	55.9	Low	72 Å²	72	120.9 Å²	120.9	60%	0.595	65%	0.653	S	S	*	*	H	α-helix	trans	-58	-39.2	178.6	0	0	0	0	0	112.9	A450	A446-A450 VanDerWaalsContact O-CB 3.3Å; A446-A450 WeakPolarHBondContact O-CB 3.08Å; A446-A450 PolarHBondContact O-N 3.27Å
447	A	62.9	Low	56.7	Low	53 Å²	53	116.9 Å²	116.9	44%	0.438	63%	0.63	S	S	.	*	H	α-helix	trans	-71.1	-35.5	177.5	0	0	0	0	0	112.6	T444 S445 R451	T444-A447 PolarHBondContact O-N 3.48Å; S445-A447 VanDerWaalsContact C-N 3.3Å; S445-A447 PolarHBondContact O-N 3.49Å; A447-R451 VanDerWaalsContact O-CB 3.29Å; A447-R451 WeakPolarHBondContact O-CB 3.37Å; A447-R451 WeakPolarHBondContact O-CD 3.36Å; A447-R451 WeakPolarHBondContact O-CG 3.22Å; A447-R451 PolarHBondContact O-N 3.44Å; A447-R451 VanDerWaalsContact O-N 3.16Å
448	A	62.1	Low	57.4	Low	42 Å²	42	110.9 Å²	110.9	35%	0.347	62%	0.622	S	S	.	*	H	α-helix	trans	-75.1	-32.7	175.7	0	0	0	0	0	112.2	T444 S445 K452	T444-A448 WeakPolarHBondContact O-CB 3.42Å; T444-A448 PolarHBondContact O-N 2.93Å; S445-A448 CarbonylContact O-C 3.6Å; S445-A448 PolarHBondContact O-N 3.46Å; S445-A448 VanDerWaalsContact O-N 3.11Å; A448-K452 WeakPolarHBondContact O-CB 3.29Å; A448-K452 VanDerWaalsContact O-CG 3.24Å; A448-K452 WeakPolarHBondContact O-CG 3.48Å; A448-K452 PolarHBondContact O-N 3.24Å
449	E	58.5	Low	57.6	Low	133 Å²	133	107.9 Å²	107.9	62%	0.621	62%	0.616	S	S	*	*	H	α-helix	trans	-73.9	-47.3	178	-168.1	155.6	-126.8	0	0	111.1	S445 R451 K452 S453	S445-E449 VanDerWaalsContact O-CB 3.27Å; S445-E449 WeakPolarHBondContact O-CB 3.4Å; S445-E449 PolarHBondContact O-N 3.31Å; E449-R451 VanDerWaalsContact C-N 3.31Å; E449-R451 PolarHBondContact O-N 3.43Å; E449-K452 WeakPolarHBondContact O-CB 3.02Å; E449-K452 PolarHBondContact O-N 3.11Å; E449-K452 VanDerWaalsContact O-N 3.08Å; E449-S453 PolarHBondContact O-N 2.82Å; E449-S453 PolarHBondContact O-OG 2.72Å
450	A	61.2	Low	57.5	Low	63 Å²	63	109.1 Å²	109.1	52%	0.521	62%	0.617	S	S	.	*	H	α-helix	trans	-57.1	-43.2	170.5	0	0	0	0	0	112.2	A446 S453 F454	A446-A450 VanDerWaalsContact O-CB 3.3Å; A446-A450 WeakPolarHBondContact O-CB 3.08Å; A446-A450 PolarHBondContact O-N 3.27Å; A450-S453 PolarHBondContact O-N 3.31Å; A450-F454 WeakPolarHBondContact O-CB 3.31Å; A450-F454 PolarHBondContact O-N 2.82Å
451	R	65.2	Low	56.6	Low	188 Å²	188	109.6 Å²	109.6	71%	0.709	62%	0.62	S	S	*	*	H	α-helix	trans	-67.5	-31.9	175.4	-74.4	173.6	-176.6	-153.8	-0.7	113.2	A447 E449 M455	A447-R451 VanDerWaalsContact O-CB 3.29Å; A447-R451 WeakPolarHBondContact O-CB 3.37Å; A447-R451 WeakPolarHBondContact O-CD 3.36Å; A447-R451 WeakPolarHBondContact O-CG 3.22Å; A447-R451 PolarHBondContact O-N 3.44Å; A447-R451 VanDerWaalsContact O-N 3.16Å; E449-R451 VanDerWaalsContact C-N 3.31Å; E449-R451 PolarHBondContact O-N 3.43Å; R451-M455 VanDerWaalsContact O-CB 3.25Å; R451-M455 WeakPolarHBondContact O-CB 3.24Å; R451-M455 WeakPolarHBondContact O-CG 3.46Å; R451-M455 PolarHBondContact O-N 3Å
452	K	66.3	Low	55.7	Low	154 Å²	154	106 Å²	106	67%	0.67	62%	0.62	S	S	*	*	H	α-helix	trans	-68.5	-47.3	172.6	-82.2	171.6	179.1	-179.6	0	111.4	A448 E449 F454 M455 A456	A448-K452 WeakPolarHBondContact O-CB 3.29Å; A448-K452 VanDerWaalsContact O-CG 3.24Å; A448-K452 WeakPolarHBondContact O-CG 3.48Å; A448-K452 PolarHBondContact O-N 3.24Å; E449-K452 WeakPolarHBondContact O-CB 3.02Å; E449-K452 PolarHBondContact O-N 3.11Å; E449-K452 VanDerWaalsContact O-N 3.08Å; K452-F454 VanDerWaalsContact C-N 3.28Å; K452-F454 PolarHBondContact O-N 3.24Å; K452-M455 PolarHBondContact O-N 2.89Å; K452-A456 WeakPolarHBondContact O-CB 3.21Å; K452-A456 PolarHBondContact O-N 2.81Å
453	S	62.9	Low	54.8	Low	65 Å²	65	103.5 Å²	103.5	46%	0.455	62%	0.62	S	S	.	*	H	α-helix	trans	-60.1	-38.7	176.4	-58	0	0	0	0	112.1	E449 A450	E449-S453 PolarHBondContact O-N 2.82Å; E449-S453 PolarHBondContact O-OG 2.72Å; A450-S453 PolarHBondContact O-N 3.31Å
454	F	56.1	Low	54.3	Low	152 Å²	152	106 Å²	106	67%	0.667	63%	0.625	S	S	*	*	H	α-helix	trans	-67.9	-46.4	174.8	-169.8	-100.8	0	0	0	112.8	A450 K452 A456 G457	A450-F454 WeakPolarHBondContact O-CB 3.31Å; A450-F454 PolarHBondContact O-N 2.82Å; K452-F454 VanDerWaalsContact C-N 3.28Å; K452-F454 PolarHBondContact O-N 3.24Å; F454-A456 VanDerWaalsContact C-N 3.33Å; F454-A456 PolarHBondContact O-N 3.13Å; F454-G457 PolarHBondContact O-N 3.15Å
455	M	65.3	Low	53.4	Low	159 Å²	159	106.7 Å²	106.7	78%	0.783	63%	0.631	S	S	*	*	H	α-helix	trans	-74.8	-18.2	179.9	-71.3	-73.9	167.3	0	0	114.1	R451 K452 G457	R451-M455 VanDerWaalsContact O-CB 3.25Å; R451-M455 WeakPolarHBondContact O-CB 3.24Å; R451-M455 WeakPolarHBondContact O-CG 3.46Å; R451-M455 PolarHBondContact O-N 3Å; K452-M455 PolarHBondContact O-N 2.89Å; M455-G457 VanDerWaalsContact C-N 3.27Å; M455-G457 PolarHBondContact O-N 3.48Å
456	A	62.1	Low	51.9	Low	77 Å²	77	108.9 Å²	108.9	64%	0.636	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	1.3	176.5	0	0	0	0	0	113.8	K452 F454 S458	K452-A456 WeakPolarHBondContact O-CB 3.21Å; K452-A456 PolarHBondContact O-N 2.81Å; F454-A456 VanDerWaalsContact C-N 3.33Å; F454-A456 PolarHBondContact O-N 3.13Å; A456-S458 PolarHBondContact O-N 2.89Å; A456-S458 VanDerWaalsContact O-N 3.13Å
457	G	51.8	Low	51	Low	31 Å²	31	112.7 Å²	112.7	32%	0.32	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	74.4	-2.9	172.5	0	0	0	0	0	116	F454 M455 A459 Y460	F454-G457 PolarHBondContact O-N 3.15Å; M455-G457 VanDerWaalsContact C-N 3.27Å; M455-G457 PolarHBondContact O-N 3.48Å; G457-A459 PolarHBondContact O-N 2.9Å; G457-Y460 PolarHBondContact O-N 2.87Å
458	S	50	Low	49.7	Very low	95 Å²	95	118.8 Å²	118.8	66%	0.664	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	20.4	-172.8	70.8	0	0	0	0	115.6	A456	A456-S458 PolarHBondContact O-N 2.89Å; A456-S458 VanDerWaalsContact O-N 3.13Å
459	A	49.6	Very low	48.7	Very low	75 Å²	75	122 Å²	122	62%	0.62	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-5.8	174.8	0	0	0	0	0	113.2	G457	G457-A459 PolarHBondContact O-N 2.9Å
460	Y	44.3	Very low	48	Very low	207 Å²	207	122.2 Å²	122.2	81%	0.812	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	-5.7	-174.8	-76.7	-74	0	0	0	116.2	G457 A462	G457-Y460 PolarHBondContact O-N 2.87Å; Y460-A462 PolarHBondContact O-N 3.41Å
461	D	36.6	Very low	47.1	Very low	156 Å²	156	127.1 Å²	127.1	83%	0.834	70%	0.698	S	S	*	*			trans	-84.5	77.8	172	-82.7	-37.7	0	0	0	112.5
462	A	37.8	Very low	46.1	Very low	99 Å²	99	124.3 Å²	124.3	82%	0.818	70%	0.697	S	S	*	*			trans	-165.4	68.6	162.5	0	0	0	0	0	115.9	Y460	Y460-A462 PolarHBondContact O-N 3.41Å
463	A	34.2	Very low	45	Very low	89 Å²	89	124.6 Å²	124.6	74%	0.736	71%	0.705	S	S	*	*			trans	-154.4	116.5	150.7	0	0	0	0	0	107.7
464	N	33.4	Very low	44.1	Very low	155 Å²	155	127.5 Å²	127.5	83%	0.829	72%	0.716	S	S	*	*	S	Bend	cis	-159.2	171.3	12.5	-103.8	-43.4	0	0	0	107.7
465	P	43.4	Very low	43.8	Very low	103 Å²	103	127.3 Å²	127.3	67%	0.669	72%	0.722	S	S	*	*			cis	-136.7	-166.6	-15.6	41.7	-24	0	0	0	113.4
466	V	29.9	Very low	42.5	Very low	118 Å²	118	127 Å²	127	72%	0.715	72%	0.722	S	S	*	*			trans	76.6	119.8	153	168.8	0	0	0	0	119.9
467	E	36.7	Very low	41.7	Very low	152 Å²	152	132.9 Å²	132.9	71%	0.71	73%	0.734	S	S	*	*			trans	72.6	132.2	154.8	-80.8	171.2	-141.8	0	0	122.8
468	K	35.6	Very low	40.8	Very low	182 Å²	182	138.9 Å²	138.9	79%	0.791	75%	0.751	S	S	*	*			trans	75.6	125.8	174.3	-54.4	137.4	-169.8	157.2	0	113.4
469	T	41	Very low	41	Very low	110 Å²	110	137.3 Å²	137.3	68%	0.675	75%	0.75	S	S	*	*			cis	-137.3	111.1	9.3	44.7	0	0	0	0	112.9	K471	T469-K471 PolarHBondContact O-N 3.47Å
470	V	44.1	Very low	40.8	Very low	137 Å²	137	142.6 Å²	142.6	83%	0.83	76%	0.762	S	S	*	*			trans	-91	75.2	170.6	-174.6	0	0	0	0	109
471	K	42.2	Very low	41.1	Very low	165 Å²	165	139.2 Å²	139.2	72%	0.717	76%	0.757	S	S	*	*	S	Bend	trans	-145.9	-29.9	-178.7	-75	-157.5	171.2	-170.7	0	118.1	T469	T469-K471 PolarHBondContact O-N 3.47Å
472	D	45.2	Very low	41.4	Very low	130 Å²	130	138.1 Å²	138.1	70%	0.695	75%	0.745	S	S	*	*	S	Bend	trans	-112.9	14.4	-158.4	-55.6	-72.9	0	0	0	116.2
473	L	43.4	Very low	42.1	Very low	160 Å²	160	135.4 Å²	135.4	84%	0.838	73%	0.727	S	S	*	*	S	Bend	trans	-134.3	-2	178.6	-76.9	177.5	0	0	0	116.9	D475	L473-D475 VanDerWaalsContact C-N 3.34Å
474	D	42.5	Very low	42.8	Very low	125 Å²	125	139.5 Å²	139.5	67%	0.668	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-16.9	175.7	-83	-50.9	0	0	0	113.9
475	D	49.8	Very low	43.5	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-1.8	-166.8	-86.6	-43.3	0	0	0	116	L473	L473-D475 VanDerWaalsContact C-N 3.34Å
476	L	38.8	Very low	44	Very low	153 Å²	153	136.3 Å²	136.3	80%	0.801	70%	0.7	S	S	*	*	S	Bend	trans	-110.2	93.5	-177.6	-73.3	172.2	0	0	0	113.4
477	K	44.6	Very low	45.4	Very low	201 Å²	201	139.4 Å²	139.4	87%	0.874	70%	0.704	S	S	*	*	S	Bend	trans	96	11	168.2	-56.7	-177.3	179.2	176.8	0	119.5	G479	K477-G479 PolarHBondContact O-N 3.41Å
478	F	34.7	Very low	46	Very low	156 Å²	156	140.3 Å²	140.3	68%	0.684	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-71	-12.1	153.8	-105.5	-82.2	0	0	0	113.4	Q480 L481 K482	F478-Q480 VanDerWaalsContact C-N 3.3Å; F478-Q480 PolarHBondContact O-N 2.69Å; F478-Q480 VanDerWaalsContact O-N 3.14Å; F478-L481 PolarHBondContact O-N 3Å; F478-K482 PolarHBondContact O-N 3.12Å
479	G	53.1	Low	47.5	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-64.7	-14.2	-170.7	0	0	0	0	0	117.7	K477	K477-G479 PolarHBondContact O-N 3.41Å
480	Q	45.6	Very low	48.5	Very low	186 Å²	186	139.7 Å²	139.7	87%	0.869	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-97.5	-10.7	-180	-75.4	-174.1	-50.3	0	0	115	F478	F478-Q480 VanDerWaalsContact C-N 3.3Å; F478-Q480 PolarHBondContact O-N 2.69Å; F478-Q480 VanDerWaalsContact O-N 3.14Å
481	L	50.4	Low	48.4	Very low	135 Å²	135	136.5 Å²	136.5	71%	0.707	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-25.7	173.3	-75.9	165.2	0	0	0	112.8	F478 G483 F484 K485	F478-L481 PolarHBondContact O-N 3Å; L481-G483 VanDerWaalsContact C-N 3.26Å; L481-G483 PolarHBondContact O-N 3.05Å; L481-F484 PolarHBondContact O-N 3.39Å; L481-F484 VanDerWaalsContact O-N 3.08Å; L481-K485 PolarHBondContact O-N 3.2Å
482	K	43.8	Very low	48.2	Very low	133 Å²	133	137.9 Å²	137.9	58%	0.578	70%	0.7	S	S	*	*	H	α-helix	trans	-57.1	-38	177.4	-159.4	168.8	-176.4	173.9	0	112.5	F478 F484 K485 D486	F478-K482 PolarHBondContact O-N 3.12Å; K482-F484 VanDerWaalsContact C-N 3.26Å; K482-F484 PolarHBondContact O-N 3.33Å; K482-K485 PolarHBondContact O-N 2.84Å; K482-K485 VanDerWaalsContact O-N 3.16Å; K482-D486 WeakPolarHBondContact O-CB 3.44Å; K482-D486 PolarHBondContact O-N 2.9Å
483	G	52.1	Low	47.7	Very low	42 Å²	42	141.3 Å²	141.3	43%	0.433	71%	0.712	S	S	.	*	H	α-helix	trans	-68	-11.9	177.2	0	0	0	0	0	116.7	L481 K487	L481-G483 VanDerWaalsContact C-N 3.26Å; L481-G483 PolarHBondContact O-N 3.05Å; G483-K487 WeakPolarHBondContact O-CG 3.49Å
484	F	48.4	Very low	47.2	Very low	175 Å²	175	137.2 Å²	137.2	77%	0.768	71%	0.708	S	S	*	*	H	α-helix	trans	-92.5	-36.6	168.6	-103.4	-91.3	0	0	0	111.7	L481 K482 K487 F488	L481-F484 PolarHBondContact O-N 3.39Å; L481-F484 VanDerWaalsContact O-N 3.08Å; K482-F484 VanDerWaalsContact C-N 3.26Å; K482-F484 PolarHBondContact O-N 3.33Å; F484-K487 PolarHBondContact O-N 2.9Å; F484-F488 PolarHBondContact O-N 3.27Å
485	K	47.6	Very low	46.7	Very low	115 Å²	115	137.4 Å²	137.4	50%	0.5	71%	0.713	S	S	.	*	H	α-helix	trans	-66.8	-48.1	176.1	-171.1	59.1	159.3	161.3	0	111.8	L481 K482 K487 F488 E489	L481-K485 PolarHBondContact O-N 3.2Å; K482-K485 PolarHBondContact O-N 2.84Å; K482-K485 VanDerWaalsContact O-N 3.16Å; K485-K487 PolarHBondContact O-N 2.86Å; K485-K487 VanDerWaalsContact O-N 3.17Å; K485-F488 PolarHBondContact O-N 3.34Å; K485-E489 HydrophobicContact CD-CG 4.2Å; K485-E489 WeakPolarHBondContact CD-OE2 3.5Å; K485-E489 WeakPolarHBondContact CE-OE1 3.36Å; K485-E489 VanDerWaalsContact CE-OE2 3.24Å; K485-E489 WeakPolarHBondContact CE-OE2 3.33Å; K485-E489 WeakPolarHBondContact CG-OE2 3.37Å; K485-E489 VanDerWaalsContact NZ-CD 3.35Å; K485-E489 IonicContact NZ-OE1 3.27Å; K485-E489 PolarHBondContact NZ-OE1 2.98Å; K485-E489 IonicContact NZ-OE2 2.69Å; K485-E489 PolarHBondContact O-N 2.98Å
486	D	54.8	Low	46	Very low	76 Å²	76	138.4 Å²	138.4	41%	0.406	71%	0.713	S	S	.	*	H	α-helix	trans	-65.5	-15.7	177	-82.4	-40.9	0	0	0	114	K482	K482-D486 WeakPolarHBondContact O-CB 3.44Å; K482-D486 PolarHBondContact O-N 2.9Å
487	K	58.4	Low	45.8	Very low	183 Å²	183	138 Å²	138	80%	0.796	72%	0.717	S	S	*	*	H	α-helix	trans	-91	-13.2	171.6	-76.7	-174.3	176.4	-175.3	0	113.8	G483 F484 K485	G483-K487 WeakPolarHBondContact O-CG 3.49Å; F484-K487 PolarHBondContact O-N 2.9Å; K485-K487 PolarHBondContact O-N 2.86Å; K485-K487 VanDerWaalsContact O-N 3.17Å
488	F	50.6	Low	45.2	Very low	171 Å²	171	136.5 Å²	136.5	75%	0.75	71%	0.713	S	S	*	*	H	α-helix	trans	-96.7	-33.5	176.3	-169.6	-96.9	0	0	0	111.5	F484 K485	F484-F488 PolarHBondContact O-N 3.27Å; K485-F488 PolarHBondContact O-N 3.34Å
489	E	66.1	Low	45.5	Very low	120 Å²	120	138.9 Å²	138.9	56%	0.561	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	2.1	-174.8	-64.2	-174.3	144.2	0	0	114.9	K485	K485-E489 HydrophobicContact CD-CG 4.2Å; K485-E489 WeakPolarHBondContact CD-OE2 3.5Å; K485-E489 WeakPolarHBondContact CE-OE1 3.36Å; K485-E489 VanDerWaalsContact CE-OE2 3.24Å; K485-E489 WeakPolarHBondContact CE-OE2 3.33Å; K485-E489 WeakPolarHBondContact CG-OE2 3.37Å; K485-E489 VanDerWaalsContact NZ-CD 3.35Å; K485-E489 IonicContact NZ-OE1 3.27Å; K485-E489 PolarHBondContact NZ-OE1 2.98Å; K485-E489 IonicContact NZ-OE2 2.69Å; K485-E489 PolarHBondContact O-N 2.98Å
490	K	62.7	Low	44.6	Very low	159 Å²	159	142.8 Å²	142.8	69%	0.691	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	29.5	177.5	-87	-176.8	172.1	172.5	0	114.1	E492	K490-E492 PolarHBondContact O-N 3.04Å; K490-E492 VanDerWaalsContact O-N 3.1Å
491	G	42.3	Very low	44.1	Very low	71 Å²	71	141.1 Å²	141.1	73%	0.732	73%	0.727	S	S	*	*			trans	-38.8	110.7	-169	0	0	0	0	0	116
492	E	37.3	Very low	43.1	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	74%	0.736	S	S	*	*			trans	-97.9	140.7	158.1	-68.2	-175.3	139.2	0	0	108.2	K490	K490-E492 PolarHBondContact O-N 3.04Å; K490-E492 VanDerWaalsContact O-N 3.1Å
493	E	34.2	Very low	42.7	Very low	202 Å²	202	140.8 Å²	140.8	94%	0.944	74%	0.737	S	S	*	*			trans	-75.6	145.6	-168.1	-61.4	172.7	103.1	0	0	112.9
494	G	33.4	Very low	42	Very low	74 Å²	74	147 Å²	147	76%	0.763	76%	0.76	S	S	*	*			trans	-162.1	44.3	-168.3	0	0	0	0	0	117.4
495	V	31.7	Very low	41.2	Very low	128 Å²	128	142 Å²	142	78%	0.776	76%	0.758	S	S	*	*			trans	32.5	108.2	153.2	-175.4	0	0	0	0	119
496	E	35.9	Very low	40.8	Very low	169 Å²	169	146.3 Å²	146.3	79%	0.79	78%	0.78	S	S	*	*			trans	39.9	109.4	136.8	-167.4	173.6	-134	0	0	120.3
497	V	34.8	Very low	40.3	Very low	146 Å²	146	146 Å²	146	89%	0.885	79%	0.794	S	S	*	*			trans	-131.7	149.3	154.9	-178	0	0	0	0	109.7
498	Q	32.1	Very low	39.5	Very low	168 Å²	168	143.7 Å²	143.7	79%	0.785	80%	0.795	S	S	*	*			trans	-92.5	172.9	-159.7	-62.6	167.2	-3.1	0	0	114.3
499	K	40	Very low	39.2	Very low	206 Å²	206	144.5 Å²	144.5	90%	0.896	80%	0.801	S	S	*	*			trans	-57.9	133.5	162.2	-70.9	179.6	175.7	-179	0	110.7
500	T	34.9	Very low	38.4	Very low	146 Å²	146	145 Å²	145	90%	0.896	81%	0.807	S	S	*	*			trans	-140.3	130.2	146.5	15.6	0	0	0	0	110.9
501	Q	34.1	Very low	37.7	Very low	150 Å²	150	139.9 Å²	139.9	70%	0.701	80%	0.799	S	S	*	*			trans	-89.1	140.5	177.3	161.7	-169.4	-4.9	0	0	109.5	D503	Q501-D503 WeakPolarHBondContact CG-OD2 3.38Å; Q501-D503 PolarHBondContact NE2-OD2 3.21Å
502	V	30.7	Very low	38	Very low	147 Å²	147	143.1 Å²	143.1	89%	0.891	80%	0.8	S	S	*	*			trans	-140.4	125.9	148.5	-174.9	0	0	0	0	107.5
503	D	35.3	Very low	38.6	Very low	114 Å²	114	139.5 Å²	139.5	61%	0.61	79%	0.785	S	S	*	*			trans	-83.8	165.3	179.6	-60.9	-88.8	0	0	0	113.1	Q501	Q501-D503 WeakPolarHBondContact CG-OD2 3.38Å; Q501-D503 PolarHBondContact NE2-OD2 3.21Å
504	L	37.3	Very low	38.7	Very low	173 Å²	173	136 Å²	136	91%	0.906	77%	0.767	S	S	*	*				-175	125.1	128.3	-90.3	171.4	0	0	0	104.1
505	G	30.8	Very low	39.5	Very low	71 Å²	71	135.2 Å²	135.2	73%	0.732	75%	0.753	S	S	*	*			cis	89.2	117.1	40.8	0	0	0	0	0	107.8
506	E	39	Very low	40.1	Very low	205 Å²	205	134.1 Å²	134.1	96%	0.958	75%	0.747	S	S	*	*			cis	-161.2	159	5.2	-175.1	172.3	-176.5	0	0	108.7
507	G	44	Very low	40.4	Very low	68 Å²	68	134.9 Å²	134.9	70%	0.701	75%	0.748	S	S	*	*			trans	112.4	28.8	157.4	0	0	0	0	0	121.8
508	V	41.3	Very low	41	Very low	135 Å²	135	134.5 Å²	134.5	82%	0.818	74%	0.737	S	S	*	*			trans	-120.3	114.9	163.5	-176.4	0	0	0	0	111.2	L510	V508-L510 PolarHBondContact O-N 3.31Å
509	Q	45.5	Very low	41.6	Very low	188 Å²	188	135.2 Å²	135.2	88%	0.879	74%	0.737	S	S	*	*			trans	-83.6	95.8	-171.2	-66.4	179.2	-8.3	0	0	112.8	G511	Q509-G511 PolarHBondContact O-N 3.4Å
510	L	49.2	Very low	41.4	Very low	131 Å²	131	128.2 Å²	128.2	69%	0.686	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	17.1	176.6	-70.6	169.5	0	0	0	115.1	V508 N512 I513	V508-L510 PolarHBondContact O-N 3.31Å; L510-N512 PolarHBondContact O-N 3.29Å; L510-I513 HydrophobicContact CD2-CD1 4.18Å
511	G	48.6	Very low	41.4	Very low	52 Å²	52	127.9 Å²	127.9	54%	0.536	72%	0.716	S	S	.	*	H	α-helix	trans	-65.1	-38.8	-175.6	0	0	0	0	0	114.4	Q509 I513	Q509-G511 PolarHBondContact O-N 3.4Å; G511-I513 PolarHBondContact O-N 3.08Å
512	N	48.5	Very low	41.9	Very low	138 Å²	138	125.6 Å²	125.6	74%	0.738	72%	0.723	S	S	*	*	H	α-helix	trans	-72.9	-29.4	-170.9	-67.7	-6.7	0	0	0	113.6	L510 T516	L510-N512 PolarHBondContact O-N 3.29Å; N512-T516 PolarHBondContact O-N 3.47Å; N512-T516 PolarHBondContact O-OG1 3.48Å
513	I	48.8	Very low	42.3	Very low	118 Å²	118	123 Å²	123	61%	0.605	71%	0.707	S	S	*	*	H	α-helix	trans	-76.4	-30.1	-173.7	-59	176.9	0	0	0	111.5	L510 G511 T516	L510-I513 HydrophobicContact CD2-CD1 4.18Å; G511-I513 PolarHBondContact O-N 3.08Å; I513-T516 PolarHBondContact O-OG1 3.26Å
514	K	37.3	Very low	42.6	Very low	130 Å²	130	122.6 Å²	122.6	57%	0.565	71%	0.705	S	S	*	*	H	α-helix	trans	-73	-42.1	176	-163.2	-180	-177.6	-143.4	0	112	T516 F517 E518	K514-T516 PolarHBondContact O-N 3.27Å; K514-F517 PolarHBondContact O-N 2.98Å; K514-E518 WeakPolarHBondContact CE-OE1 3.22Å; K514-E518 IonicContact NZ-OE1 3.63Å; K514-E518 PolarHBondContact NZ-OE1 3.35Å; K514-E518 IonicContact NZ-OE2 3.99Å; K514-E518 PolarHBondContact O-N 3.02Å; K514-E518 VanDerWaalsContact O-N 3.15Å
515	A	49.1	Very low	43.1	Very low	56 Å²	56	121.1 Å²	121.1	46%	0.463	69%	0.693	S	S	.	*	H	α-helix	trans	-63.1	-25.1	178.5	0	0	0	0	0	113.7
516	T	45.7	Very low	44	Very low	106 Å²	106	122 Å²	122	65%	0.65	69%	0.688	S	S	*	*	H	α-helix	trans	-79.3	-20.6	172.7	43.4	0	0	0	0	114.2	N512 I513 K514	N512-T516 PolarHBondContact O-N 3.47Å; N512-T516 PolarHBondContact O-OG1 3.48Å; I513-T516 PolarHBondContact O-OG1 3.26Å; K514-T516 PolarHBondContact O-N 3.27Å
517	F	40.7	Very low	44.7	Very low	184 Å²	184	120.8 Å²	120.8	81%	0.807	68%	0.683	S	S	*	*	H	α-helix	trans	-89.6	-40.5	179.5	-142.9	-92.4	0	0	0	111.7	K514 K519 G520	K514-F517 PolarHBondContact O-N 2.98Å; F517-K519 PolarHBondContact O-N 3.28Å; F517-G520 PolarHBondContact O-N 3.36Å; F517-G520 VanDerWaalsContact O-N 3.11Å
518	E	48	Very low	44.9	Very low	139 Å²	139	119.9 Å²	119.9	65%	0.65	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-5	176.2	-72.2	170.7	164.6	0	0	113.5	K514	K514-E518 WeakPolarHBondContact CE-OE1 3.22Å; K514-E518 IonicContact NZ-OE1 3.63Å; K514-E518 PolarHBondContact NZ-OE1 3.35Å; K514-E518 IonicContact NZ-OE2 3.99Å; K514-E518 PolarHBondContact O-N 3.02Å; K514-E518 VanDerWaalsContact O-N 3.15Å
519	K	43.8	Very low	46.3	Very low	182 Å²	182	117.2 Å²	117.2	79%	0.791	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	10.4	168.5	-74.1	-172.2	175.7	-177.5	0	114.3	F517 N521	F517-K519 PolarHBondContact O-N 3.28Å; K519-N521 PolarHBondContact O-N 3.47Å
520	G	36.4	Very low	47.2	Very low	59 Å²	59	112.6 Å²	112.6	61%	0.608	64%	0.639	S	S	*	*			trans	-67.9	82.4	161.3	0	0	0	0	0	109.8	F517 A522	F517-G520 PolarHBondContact O-N 3.36Å; F517-G520 VanDerWaalsContact O-N 3.11Å; G520-A522 PolarHBondContact O-N 3.18Å
521	N	35.8	Very low	48.3	Very low	140 Å²	140	114.4 Å²	114.4	75%	0.749	64%	0.644	S	S	*	*			trans	-70.8	92.1	-175.9	-158.7	67.4	0	0	0	109.9	K519 V523	K519-N521 PolarHBondContact O-N 3.47Å; N521-V523 VanDerWaalsContact C-N 3.28Å; N521-V523 PolarHBondContact O-N 2.86Å
522	A	44.8	Very low	49.4	Very low	101 Å²	101	116.8 Å²	116.8	84%	0.835	64%	0.641	S	S	*	*			trans	-67	87.8	172.7	0	0	0	0	0	109.2	G520	G520-A522 PolarHBondContact O-N 3.18Å
523	V	38.9	Very low	50.5	Low	93 Å²	93	114.4 Å²	114.4	56%	0.564	62%	0.622	S	S	*	*			trans	-68.8	129.8	170	179.6	0	0	0	0	107.9	N521 E525	N521-V523 VanDerWaalsContact C-N 3.28Å; N521-V523 PolarHBondContact O-N 2.86Å; V523-E525 PolarHBondContact O-N 3.32Å
524	D	40.8	Very low	51.6	Low	106 Å²	106	111.4 Å²	111.4	57%	0.567	61%	0.614	S	S	*	*			trans	-60.6	131.7	-176	-164.5	-51.8	0	0	0	111.2	S526 E527	D524-S526 VanDerWaalsContact CG-OG 3.24Å; D524-S526 PolarHBondContact O-N 3.42Å; D524-S526 VanDerWaalsContact OD1-CB 3.3Å; D524-S526 WeakPolarHBondContact OD1-CB 3.41Å; D524-S526 PolarHBondContact OD1-N 2.94Å; D524-S526 PolarHBondContact OD1-OG 3.14Å; D524-E527 PolarHBondContact O-N 3.19Å
525	E	48.9	Very low	53.4	Low	141 Å²	141	111.2 Å²	111.2	66%	0.659	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-1.8	-179.1	-92.3	-147.6	100.4	0	0	114	V523 R533	V523-E525 PolarHBondContact O-N 3.32Å; E525-R533 VanDerWaalsContact CD-NH2 3.29Å; E525-R533 VanDerWaalsContact O-CZ 3.29Å; E525-R533 PolarHBondContact O-NH1 3.44Å; E525-R533 PolarHBondContact O-NH2 3.25Å; E525-R533 IonicContact OE1-CZ 3.05Å; E525-R533 IonicContact OE1-NE 2.62Å; E525-R533 IonicContact OE1-NH2 2.66Å; E525-R533 PolarHBondContact OE1-NH2 3.34Å
526	S	48.7	Very low	54.5	Low	90 Å²	90	113.5 Å²	113.5	63%	0.629	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-17.5	-179.8	61.8	0	0	0	0	116.2	D524	D524-S526 VanDerWaalsContact CG-OG 3.24Å; D524-S526 PolarHBondContact O-N 3.42Å; D524-S526 VanDerWaalsContact OD1-CB 3.3Å; D524-S526 WeakPolarHBondContact OD1-CB 3.41Å; D524-S526 PolarHBondContact OD1-N 2.94Å; D524-S526 PolarHBondContact OD1-OG 3.14Å
527	E	54.3	Low	56	Low	179 Å²	179	114.5 Å²	114.5	84%	0.836	62%	0.615	S	S	*	*	S	Bend	trans	-114.3	6.1	-179.6	-65.9	-161.3	149.4	0	0	115.3	D524	D524-E527 PolarHBondContact O-N 3.19Å
528	M	48.8	Very low	57.9	Low	50 Å²	50	112 Å²	112	25%	0.246	60%	0.603	C	S	.	*			trans	-70.3	127.4	170.1	-71.8	-73.2	-70.4	0	0	111.5	E532 L536	M528-E532 HydrophobicContact CE-CB 4.11Å; M528-E532 HydrophobicContact CE-CG 3.6Å; M528-L536 HydrophobicContact CE-CD1 4.47Å
529	T	69.8	Low	59.3	Low	78 Å²	78	114.6 Å²	114.6	48%	0.479	61%	0.608	S	S	.	*			trans	-65.1	153.4	177.9	69.4	0	0	0	0	112	E531 E532 R533	T529-E531 PolarHBondContact O-N 2.81Å; T529-E532 PolarHBondContact O-N 2.97Å; T529-E532 WeakPolarHBondContact OG1-CB 3.25Å; T529-E532 PolarHBondContact OG1-N 2.89Å; T529-R533 WeakPolarHBondContact O-CB 3.3Å; T529-R533 PolarHBondContact O-N 2.83Å
530	A	65.3	Low	61.3	Low	91 Å²	91	112.1 Å²	112.1	75%	0.752	60%	0.599	S	S	*	*	H	α-helix	trans	-61.4	-29.6	-178.4	0	0	0	0	0	113.2	A534	A530-A534 WeakPolarHBondContact O-CB 3.24Å; A530-A534 PolarHBondContact O-N 3.24Å; A530-A534 VanDerWaalsContact O-N 3.14Å
531	E	71.2	Confident	63.3	Low	169 Å²	169	114.6 Å²	114.6	79%	0.79	60%	0.597	S	S	*	*	H	α-helix	trans	-73.1	-46.8	178.3	-169.8	159.4	-146.2	0	0	111.2	T529 R533 A534 E535	T529-E531 PolarHBondContact O-N 2.81Å; E531-R533 VanDerWaalsContact C-N 3.35Å; E531-R533 PolarHBondContact O-N 2.74Å; E531-A534 WeakPolarHBondContact O-CA 3.2Å; E531-A534 WeakPolarHBondContact O-CB 3.36Å; E531-A534 PolarHBondContact O-N 2.85Å; E531-A534 VanDerWaalsContact O-N 3.08Å; E531-E535 PolarHBondContact O-N 3.35Å
532	E	71.4	Confident	65.2	Low	103 Å²	103	113.3 Å²	113.3	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-65.7	-37	177.4	-158.7	173.6	-169.7	0	0	112	M528 T529 A534 E535 L536	M528-E532 HydrophobicContact CE-CB 4.11Å; M528-E532 HydrophobicContact CE-CG 3.6Å; T529-E532 PolarHBondContact O-N 2.97Å; T529-E532 WeakPolarHBondContact OG1-CB 3.25Å; T529-E532 PolarHBondContact OG1-N 2.89Å; E532-A534 VanDerWaalsContact C-N 3.3Å; E532-A534 PolarHBondContact O-N 3.03Å; E532-E535 PolarHBondContact O-N 2.75Å; E532-L536 WeakPolarHBondContact O-CB 3.42Å; E532-L536 PolarHBondContact O-N 2.97Å
533	R	73.1	Confident	66.9	Low	87 Å²	87	110.9 Å²	110.9	33%	0.328	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-25.9	172.7	-150.3	-177.8	-147.8	128.1	-1.9	112.9	E525 T529 E531 K537	E525-R533 VanDerWaalsContact CD-NH2 3.29Å; E525-R533 VanDerWaalsContact O-CZ 3.29Å; E525-R533 PolarHBondContact O-NH1 3.44Å; E525-R533 PolarHBondContact O-NH2 3.25Å; E525-R533 IonicContact OE1-CZ 3.05Å; E525-R533 IonicContact OE1-NE 2.62Å; E525-R533 IonicContact OE1-NH2 2.66Å; E525-R533 PolarHBondContact OE1-NH2 3.34Å; T529-R533 WeakPolarHBondContact O-CB 3.3Å; T529-R533 PolarHBondContact O-N 2.83Å; E531-R533 VanDerWaalsContact C-N 3.35Å; E531-R533 PolarHBondContact O-N 2.74Å; R533-K537 WeakPolarHBondContact O-CG 3.36Å
534	A	70.1	Confident	68.7	Low	55 Å²	55	113 Å²	113	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-78.2	-39.1	172.1	0	0	0	0	0	111.6	A530 E531 E532 K537 K538	A530-A534 WeakPolarHBondContact O-CB 3.24Å; A530-A534 PolarHBondContact O-N 3.24Å; A530-A534 VanDerWaalsContact O-N 3.14Å; E531-A534 WeakPolarHBondContact O-CA 3.2Å; E531-A534 WeakPolarHBondContact O-CB 3.36Å; E531-A534 PolarHBondContact O-N 2.85Å; E531-A534 VanDerWaalsContact O-N 3.08Å; E532-A534 VanDerWaalsContact C-N 3.3Å; E532-A534 PolarHBondContact O-N 3.03Å; A534-K537 PolarHBondContact O-N 3.28Å; A534-K538 WeakPolarHBondContact O-CB 3.37Å; A534-K538 PolarHBondContact O-N 3.43Å
535	E	76.2	Confident	70.4	Confident	127 Å²	127	114.7 Å²	114.7	59%	0.593	57%	0.572	S	S	*	*	H	α-helix	trans	-67.7	-38.9	177	-175.6	151.2	-115.8	0	0	112.6	E531 E532 K537 K538 R539	E531-E535 PolarHBondContact O-N 3.35Å; E532-E535 PolarHBondContact O-N 2.75Å; E535-K537 PolarHBondContact O-N 3.28Å; E535-K538 WeakPolarHBondContact O-CB 3.44Å; E535-K538 PolarHBondContact O-N 2.75Å; E535-R539 WeakPolarHBondContact O-CB 3.1Å; E535-R539 PolarHBondContact O-N 3.48Å
536	L	71.9	Confident	71.3	Confident	103 Å²	103	113.4 Å²	113.4	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-61.5	-44.4	174.4	-148.8	168.3	0	0	0	111	M528 E532 R539 E540	M528-L536 HydrophobicContact CE-CD1 4.47Å; E532-L536 WeakPolarHBondContact O-CB 3.42Å; E532-L536 PolarHBondContact O-N 2.97Å; L536-R539 PolarHBondContact O-N 3.46Å; L536-E540 PolarHBondContact O-N 2.69Å
537	K	77.2	Confident	72.7	Confident	128 Å²	128	118.5 Å²	118.5	56%	0.557	57%	0.572	S	S	*	*	H	α-helix	trans	-64.7	-39.9	173.7	-75.1	-178.6	176.6	-176.2	0	113.3	R533 A534 E535 R539 E540 I541	R533-K537 WeakPolarHBondContact O-CG 3.36Å; A534-K537 PolarHBondContact O-N 3.28Å; E535-K537 PolarHBondContact O-N 3.28Å; K537-R539 VanDerWaalsContact C-N 3.33Å; K537-R539 PolarHBondContact O-N 3.17Å; K537-E540 PolarHBondContact O-N 3.32Å; K537-I541 WeakPolarHBondContact O-CD1 3.47Å; K537-I541 VanDerWaalsContact O-CG1 3.27Å; K537-I541 WeakPolarHBondContact O-CG1 3.4Å; K537-I541 PolarHBondContact O-N 2.78Å
538	K	81.5	Confident	73.9	Confident	130 Å²	130	117 Å²	117	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-60.4	-43.4	174.7	177.9	-172.9	169.8	-163.5	0	111	A534 E535 I541 E542	A534-K538 WeakPolarHBondContact O-CB 3.37Å; A534-K538 PolarHBondContact O-N 3.43Å; E535-K538 WeakPolarHBondContact O-CB 3.44Å; E535-K538 PolarHBondContact O-N 2.75Å; K538-I541 PolarHBondContact O-N 3.49Å; K538-E542 WeakPolarHBondContact O-CB 3.36Å; K538-E542 PolarHBondContact O-N 2.75Å
539	R	76.6	Confident	75.2	Confident	195 Å²	195	120.9 Å²	120.9	74%	0.736	58%	0.575	S	S	*	*	H	α-helix	trans	-66.3	-35.7	175.4	177.5	176.7	168	177.4	-4.7	112.6	E535 L536 K537 A543	E535-R539 WeakPolarHBondContact O-CB 3.1Å; E535-R539 PolarHBondContact O-N 3.48Å; L536-R539 PolarHBondContact O-N 3.46Å; K537-R539 VanDerWaalsContact C-N 3.33Å; K537-R539 PolarHBondContact O-N 3.17Å; R539-A543 WeakPolarHBondContact O-CB 3.32Å; R539-A543 PolarHBondContact O-N 3.49Å
540	E	86.1	Confident	75.1	Confident	130 Å²	130	122.6 Å²	122.6	61%	0.607	58%	0.581	S	S	*	*	H	α-helix	trans	-66.6	-47.2	174.1	-173.8	168.7	-144.7	0	0	111.7	L536 K537 E542 A543 E544	L536-E540 PolarHBondContact O-N 2.69Å; K537-E540 PolarHBondContact O-N 3.32Å; E540-E542 VanDerWaalsContact C-N 3.33Å; E540-E542 PolarHBondContact O-N 3.46Å; E540-A543 PolarHBondContact O-N 2.74Å; E540-E544 PolarHBondContact O-N 3.31Å
541	I	77.5	Confident	75.9	Confident	110 Å²	110	120.8 Å²	120.8	56%	0.564	57%	0.566	S	S	*	*	H	α-helix	trans	-59.5	-42.2	174.1	-68.2	163	0	0	0	111.1	K537 K538 E544 F545	K537-I541 WeakPolarHBondContact O-CD1 3.47Å; K537-I541 VanDerWaalsContact O-CG1 3.27Å; K537-I541 WeakPolarHBondContact O-CG1 3.4Å; K537-I541 PolarHBondContact O-N 2.78Å; K538-I541 PolarHBondContact O-N 3.49Å; I541-E544 PolarHBondContact O-N 3.44Å; I541-F545 WeakPolarHBondContact O-CB 3.46Å; I541-F545 PolarHBondContact O-N 2.72Å
542	E	77.1	Confident	76.2	Confident	114 Å²	114	121.3 Å²	121.3	53%	0.533	56%	0.56	S	S	.	*	H	α-helix	trans	-68	-36.6	177.4	-174.1	161.7	-165.6	0	0	112.3	K538 E540 F545 Q546	K538-E542 WeakPolarHBondContact O-CB 3.36Å; K538-E542 PolarHBondContact O-N 2.75Å; E540-E542 VanDerWaalsContact C-N 3.33Å; E540-E542 PolarHBondContact O-N 3.46Å; E542-F545 PolarHBondContact O-N 3.27Å; E542-Q546 WeakPolarHBondContact O-CG 2.95Å; E542-Q546 PolarHBondContact O-N 3.46Å
543	A	79.4	Confident	76	Confident	50 Å²	50	123.4 Å²	123.4	41%	0.413	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-39.2	173.1	0	0	0	0	0	112.5	R539 E540 Q546 R547	R539-A543 WeakPolarHBondContact O-CB 3.32Å; R539-A543 PolarHBondContact O-N 3.49Å; E540-A543 PolarHBondContact O-N 2.74Å; A543-Q546 PolarHBondContact O-N 3.33Å; A543-R547 WeakPolarHBondContact O-CG 3.36Å; A543-R547 PolarHBondContact O-N 2.87Å
544	E	77.2	Confident	75.7	Confident	138 Å²	138	122.4 Å²	122.4	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-63	-45.4	171.6	-174.3	178.8	-148.4	0	0	111	E540 I541 Q546 R547 Y548	E540-E544 PolarHBondContact O-N 3.31Å; I541-E544 PolarHBondContact O-N 3.44Å; E544-Q546 VanDerWaalsContact C-N 3.29Å; E544-Q546 PolarHBondContact O-N 2.66Å; E544-R547 CarbonylContact O-C 3.56Å; E544-R547 WeakPolarHBondContact O-CA 3.39Å; E544-R547 WeakPolarHBondContact O-CB 3.38Å; E544-R547 PolarHBondContact O-N 2.94Å; E544-Y548 PolarHBondContact O-N 2.87Å
545	F	75.6	Confident	75.6	Confident	140 Å²	140	122.3 Å²	122.3	61%	0.614	57%	0.574	S	S	*	*	H	α-helix	trans	-62.5	-36.3	178.2	-157.5	-97.1	0	0	0	112.1	I541 E542 K549	I541-F545 WeakPolarHBondContact O-CB 3.46Å; I541-F545 PolarHBondContact O-N 2.72Å; E542-F545 PolarHBondContact O-N 3.27Å; F545-K549 WeakPolarHBondContact O-CB 3.34Å; F545-K549 PolarHBondContact O-N 2.94Å
546	Q	69.1	Low	75.3	Confident	115 Å²	115	121.6 Å²	121.6	54%	0.537	57%	0.569	S	S	.	*	H	α-helix	trans	-67.2	-40.8	171.1	-71.9	-168	33	0	0	112.5	E542 A543 E544 K549 L550	E542-Q546 WeakPolarHBondContact O-CG 2.95Å; E542-Q546 PolarHBondContact O-N 3.46Å; A543-Q546 PolarHBondContact O-N 3.33Å; E544-Q546 VanDerWaalsContact C-N 3.29Å; E544-Q546 PolarHBondContact O-N 2.66Å; Q546-K549 PolarHBondContact O-N 3.35Å; Q546-L550 WeakPolarHBondContact O-CG 2.98Å; Q546-L550 PolarHBondContact O-N 2.97Å
547	R	76.5	Confident	75	Confident	197 Å²	197	119.1 Å²	119.1	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-61.6	-44.9	173.3	-74.4	179.5	177	-138	0.1	112	A543 E544 K549 L550 A551	A543-R547 WeakPolarHBondContact O-CG 3.36Å; A543-R547 PolarHBondContact O-N 2.87Å; E544-R547 CarbonylContact O-C 3.56Å; E544-R547 WeakPolarHBondContact O-CA 3.39Å; E544-R547 WeakPolarHBondContact O-CB 3.38Å; E544-R547 PolarHBondContact O-N 2.94Å; R547-K549 PolarHBondContact O-N 3Å; R547-L550 PolarHBondContact O-N 3.38Å; R547-A551 WeakPolarHBondContact O-CB 3.35Å; R547-A551 PolarHBondContact O-N 3.38Å
548	Y	79.8	Confident	74	Confident	146 Å²	146	119.8 Å²	119.8	57%	0.573	57%	0.568	S	S	*	*	H	α-helix	trans	-61.8	-41.9	175.5	-177.1	-98.1	0	0	0	111.9	E544 L550 A551 R552	E544-Y548 PolarHBondContact O-N 2.87Å; Y548-L550 VanDerWaalsContact C-N 3.33Å; Y548-L550 PolarHBondContact O-N 2.87Å; Y548-A551 PolarHBondContact O-N 3.15Å; Y548-R552 WeakPolarHBondContact O-CB 3.27Å; Y548-R552 PolarHBondContact O-N 3.44Å
549	K	77.3	Confident	72.7	Confident	133 Å²	133	120.3 Å²	120.3	58%	0.578	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-32.8	175.8	-170.8	173.6	-174.5	174.9	0	113	F545 Q546 R547 K553	F545-K549 WeakPolarHBondContact O-CB 3.34Å; F545-K549 PolarHBondContact O-N 2.94Å; Q546-K549 PolarHBondContact O-N 3.35Å; R547-K549 PolarHBondContact O-N 3Å; K549-K553 PolarHBondContact O-N 3.2Å
550	L	68	Low	71.6	Confident	114 Å²	114	117 Å²	117	60%	0.597	57%	0.565	S	S	*	*	H	α-helix	trans	-72.7	-45.1	171.6	-72.4	168.8	0	0	0	111.5	Q546 R547 Y548 R552 K553 S554	Q546-L550 WeakPolarHBondContact O-CG 2.98Å; Q546-L550 PolarHBondContact O-N 2.97Å; R547-L550 PolarHBondContact O-N 3.38Å; Y548-L550 VanDerWaalsContact C-N 3.33Å; Y548-L550 PolarHBondContact O-N 2.87Å; L550-R552 VanDerWaalsContact C-N 3.33Å; L550-R552 PolarHBondContact O-N 3.42Å; L550-K553 WeakPolarHBondContact O-CA 3.28Å; L550-K553 WeakPolarHBondContact O-CB 3.49Å; L550-K553 PolarHBondContact O-N 2.92Å; L550-S554 PolarHBondContact O-N 3.32Å; L550-S554 PolarHBondContact O-OG 3.43Å
551	A	80.6	Confident	69.9	Low	52 Å²	52	116.8 Å²	116.8	43%	0.43	57%	0.573	S	S	.	*	H	α-helix	trans	-59.8	-40.9	176.3	0	0	0	0	0	112.4	R547 Y548 K553 S554 A555	R547-A551 WeakPolarHBondContact O-CB 3.35Å; R547-A551 PolarHBondContact O-N 3.38Å; Y548-A551 PolarHBondContact O-N 3.15Å; A551-K553 VanDerWaalsContact C-N 3.32Å; A551-K553 PolarHBondContact O-N 2.83Å; A551-S554 WeakPolarHBondContact CA-OG 3.39Å; A551-S554 PolarHBondContact O-N 3.11Å; A551-S554 PolarHBondContact O-OG 3.3Å; A551-A555 WeakPolarHBondContact O-CB 3.45Å; A551-A555 PolarHBondContact O-N 2.87Å
552	R	77.5	Confident	68.5	Low	180 Å²	180	117.2 Å²	117.2	68%	0.679	58%	0.58	S	S	*	*	H	α-helix	trans	-67.1	-31.3	174.2	-169.3	172.3	-178.3	175.9	2	112.6	Y548 L550 K556	Y548-R552 WeakPolarHBondContact O-CB 3.27Å; Y548-R552 PolarHBondContact O-N 3.44Å; L550-R552 VanDerWaalsContact C-N 3.33Å; L550-R552 PolarHBondContact O-N 3.42Å; R552-K556 WeakPolarHBondContact O-CB 3.14Å; R552-K556 PolarHBondContact O-N 2.74Å; R552-K556 VanDerWaalsContact O-N 3.14Å
553	K	68.3	Low	66.8	Low	148 Å²	148	114.6 Å²	114.6	64%	0.643	58%	0.583	S	S	*	*	H	α-helix	trans	-69.8	-44.3	171.5	-85.1	-173.1	170.3	-167.8	0	112.3	K549 L550 A551 K556 A557	K549-K553 PolarHBondContact O-N 3.2Å; L550-K553 WeakPolarHBondContact O-CA 3.28Å; L550-K553 WeakPolarHBondContact O-CB 3.49Å; L550-K553 PolarHBondContact O-N 2.92Å; A551-K553 VanDerWaalsContact C-N 3.32Å; A551-K553 PolarHBondContact O-N 2.83Å; K553-K556 PolarHBondContact O-N 2.74Å; K553-A557 WeakPolarHBondContact O-CB 3.31Å; K553-A557 PolarHBondContact O-N 2.7Å
554	S	66	Low	64.9	Low	66 Å²	66	121.3 Å²	121.3	46%	0.462	61%	0.606	S	S	.	*	H	α-helix	trans	-68.1	-37.6	177.9	53.6	0	0	0	0	112.2	L550 A551 A557 Q558	L550-S554 PolarHBondContact O-N 3.32Å; L550-S554 PolarHBondContact O-OG 3.43Å; A551-S554 WeakPolarHBondContact CA-OG 3.39Å; A551-S554 PolarHBondContact O-N 3.11Å; A551-S554 PolarHBondContact O-OG 3.3Å; S554-A557 PolarHBondContact O-N 3.33Å; S554-Q558 WeakPolarHBondContact O-CG 3.31Å; S554-Q558 PolarHBondContact O-N 3.27Å
555	A	67.8	Low	63	Low	53 Å²	53	123.2 Å²	123.2	44%	0.438	62%	0.615	S	S	.	*	H	α-helix	trans	-60.2	-49.4	172.9	0	0	0	0	0	111.4	A551 A557 Q558 E559	A551-A555 WeakPolarHBondContact O-CB 3.45Å; A551-A555 PolarHBondContact O-N 2.87Å; A555-A557 VanDerWaalsContact C-N 3.32Å; A555-A557 PolarHBondContact O-N 3.5Å; A555-Q558 PolarHBondContact O-N 2.74Å; A555-Q558 VanDerWaalsContact O-N 3.16Å; A555-E559 WeakPolarHBondContact O-CB 3.39Å; A555-E559 PolarHBondContact O-N 3.45Å
556	K	70.2	Confident	60.9	Low	112 Å²	112	125.6 Å²	125.6	49%	0.487	63%	0.628	S	S	.	*	H	α-helix	trans	-64	-34.2	176.5	-171.1	168.9	-165.9	-81.8	0	113.1	R552 K553 E559 E560	R552-K556 WeakPolarHBondContact O-CB 3.14Å; R552-K556 PolarHBondContact O-N 2.74Å; R552-K556 VanDerWaalsContact O-N 3.14Å; K553-K556 PolarHBondContact O-N 2.74Å; K556-E559 WeakPolarHBondContact O-CB 3.15Å; K556-E559 PolarHBondContact O-N 3.36Å; K556-E560 IonicContact NZ-OE1 2.68Å; K556-E560 PolarHBondContact NZ-OE1 3.17Å; K556-E560 WeakPolarHBondContact O-CG 3.35Å; K556-E560 PolarHBondContact O-N 3.17Å
557	A	65.9	Low	59	Low	50 Å²	50	125.5 Å²	125.5	41%	0.413	65%	0.647	S	S	.	*	H	α-helix	trans	-68.3	-34.2	174.7	0	0	0	0	0	112.3	K553 S554 A555 V561	K553-A557 WeakPolarHBondContact O-CB 3.31Å; K553-A557 PolarHBondContact O-N 2.7Å; S554-A557 PolarHBondContact O-N 3.33Å; A555-A557 VanDerWaalsContact C-N 3.32Å; A555-A557 PolarHBondContact O-N 3.5Å; A557-V561 VanDerWaalsContact O-CG2 3.28Å; A557-V561 WeakPolarHBondContact O-CG2 3.09Å; A557-V561 PolarHBondContact O-N 2.75Å
558	Q	56.5	Low	57.1	Low	142 Å²	142	123.3 Å²	123.3	66%	0.664	65%	0.65	S	S	*	*	H	α-helix	trans	-71.2	-36.2	171.6	-73	176.9	-32.7	0	0	111.9	S554 A555 V561 V562	S554-Q558 WeakPolarHBondContact O-CG 3.31Å; S554-Q558 PolarHBondContact O-N 3.27Å; A555-Q558 PolarHBondContact O-N 2.74Å; A555-Q558 VanDerWaalsContact O-N 3.16Å; Q558-V561 PolarHBondContact O-N 3.44Å; Q558-V562 WeakPolarHBondContact O-CG2 3.22Å; Q558-V562 PolarHBondContact O-N 3.01Å
559	E	54.6	Low	54.8	Low	141 Å²	141	126.3 Å²	126.3	66%	0.659	67%	0.666	S	S	*	*	H	α-helix	trans	-64.2	-40.9	174.3	-162.3	172.3	-141.2	0	0	111.9	A555 K556 V561 V562	A555-E559 WeakPolarHBondContact O-CB 3.39Å; A555-E559 PolarHBondContact O-N 3.45Å; K556-E559 WeakPolarHBondContact O-CB 3.15Å; K556-E559 PolarHBondContact O-N 3.36Å; E559-V561 VanDerWaalsContact C-N 3.35Å; E559-V561 PolarHBondContact O-N 2.78Å; E559-V562 PolarHBondContact O-N 2.78Å
560	E	53.3	Low	53.2	Low	125 Å²	125	123.8 Å²	123.8	58%	0.584	68%	0.678	S	S	*	*	H	α-helix	trans	-68.3	-28.7	174.3	-75.8	175	-178.5	0	0	113.2	K556 V562 G563	K556-E560 IonicContact NZ-OE1 2.68Å; K556-E560 PolarHBondContact NZ-OE1 3.17Å; K556-E560 WeakPolarHBondContact O-CG 3.35Å; K556-E560 PolarHBondContact O-N 3.17Å; E560-V562 VanDerWaalsContact C-N 3.35Å; E560-G563 PolarHBondContact O-N 2.74Å
561	V	49.4	Very low	51.5	Low	127 Å²	127	128.8 Å²	128.8	77%	0.77	69%	0.69	S	S	*	*	H	α-helix	trans	-77.7	-17.2	176.7	168.1	0	0	0	0	113.3	A557 Q558 E559 G563	A557-V561 VanDerWaalsContact O-CG2 3.28Å; A557-V561 WeakPolarHBondContact O-CG2 3.09Å; A557-V561 PolarHBondContact O-N 2.75Å; Q558-V561 PolarHBondContact O-N 3.44Å; E559-V561 VanDerWaalsContact C-N 3.35Å; E559-V561 PolarHBondContact O-N 2.78Å; V561-G563 VanDerWaalsContact C-N 3.35Å
562	V	47.6	Very low	49.7	Very low	118 Å²	118	132.8 Å²	132.8	72%	0.715	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	0.6	172.6	-179.7	0	0	0	0	111.5	Q558 E559 E560 E564	Q558-V562 WeakPolarHBondContact O-CG2 3.22Å; Q558-V562 PolarHBondContact O-N 3.01Å; E559-V562 PolarHBondContact O-N 2.78Å; E560-V562 VanDerWaalsContact C-N 3.35Å; V562-E564 PolarHBondContact O-N 3.24Å
563	G	42	Very low	48.1	Very low	59 Å²	59	129 Å²	129	61%	0.608	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-2.5	-173.7	0	0	0	0	0	117.3	E560 V561	E560-G563 PolarHBondContact O-N 2.74Å; V561-G563 VanDerWaalsContact C-N 3.35Å
564	E	39.2	Very low	47.2	Very low	191 Å²	191	128 Å²	128	89%	0.893	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	34.1	-175.9	-66.9	-158.7	140.9	0	0	115	V562	V562-E564 PolarHBondContact O-N 3.24Å
565	E	37.7	Very low	46.1	Very low	178 Å²	178	130 Å²	130	83%	0.832	71%	0.709	S	S	*	*	S	Bend	trans	-152.6	155.9	152.4	-118	165.1	-156.4	0	0	112.7
566	E	31.9	Very low	45	Very low	191 Å²	191	132.2 Å²	132.2	89%	0.893	72%	0.717	S	S	*	*			trans	57.2	65.9	173.4	-57.8	-146.1	136.6	0	0	120.7	N568	E566-N568 PolarHBondContact O-N 3.09Å
567	A	29.5	Very low	44	Very low	112 Å²	112	133.9 Å²	133.9	93%	0.926	73%	0.727	S	S	*	*			trans	-85.9	65.6	170.9	0	0	0	0	0	115.4
568	N	35.8	Very low	43.3	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	74%	0.737	S	S	*	*			trans	-158.2	82.4	163.5	-162	-3.1	0	0	0	117.6	E566	E566-N568 PolarHBondContact O-N 3.09Å
569	K	32.6	Very low	42.8	Very low	209 Å²	209	135.5 Å²	135.5	91%	0.909	73%	0.731	S	S	*	*			trans	-168.5	145.1	141.9	-110.2	162.7	-174.5	172.8	0	110.9
570	G	43.5	Very low	42.3	Very low	80 Å²	80	135.9 Å²	135.9	83%	0.825	74%	0.735	S	S	*	*			trans	-91.5	132	-177.1	0	0	0	0	0	113.9
571	Y	32.7	Very low	42	Very low	219 Å²	219	132.9 Å²	132.9	86%	0.859	73%	0.731	S	S	*	*			trans	-149.3	141.6	164.7	-159.1	-97.8	0	0	0	109.1
572	N	42.2	Very low	41.8	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	71%	0.714	S	S	*	*			trans	-102.4	119.7	-174	-88.5	-43.8	0	0	0	111.6	L574	N572-L574 PolarHBondContact O-N 2.79Å
573	P	43.8	Very low	41.8	Very low	100 Å²	100	131.4 Å²	131.4	65%	0.649	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-20.6	-175.7	-22.4	34.6	0	0	0	116.3	D575 V576	P573-D575 PolarHBondContact O-N 2.76Å; P573-D575 VanDerWaalsContact O-N 3.08Å; P573-V576 PolarHBondContact O-N 2.95Å
574	L	48.4	Very low	41.8	Very low	127 Å²	127	131.2 Å²	131.2	67%	0.665	71%	0.708	S	S	*	*	H	α-helix	trans	-65.2	-17.9	-164.1	-63.6	175.3	0	0	0	115.3	N572 V576	N572-L574 PolarHBondContact O-N 2.79Å; L574-V576 VanDerWaalsContact C-N 3.3Å; L574-V576 PolarHBondContact O-N 2.66Å
575	D	43.1	Very low	42.2	Very low	107 Å²	107	132.1 Å²	132.1	57%	0.572	70%	0.704	S	S	*	*	H	α-helix	trans	-83.7	1.6	-173.4	-164.4	39.8	0	0	0	114.3	P573 K579	P573-D575 PolarHBondContact O-N 2.76Å; P573-D575 VanDerWaalsContact O-N 3.08Å; D575-K579 PolarHBondContact O-NZ 2.97Å; D575-K579 IonicContact OD1-NZ 3.73Å; D575-K579 PolarHBondContact OD1-NZ 2.83Å; D575-K579 IonicContact OD2-NZ 2.67Å; D575-K579 PolarHBondContact OD2-NZ 3.34Å
576	V	45.2	Very low	42.6	Very low	100 Å²	100	127.8 Å²	127.8	61%	0.606	68%	0.684	S	S	*	*	H	α-helix	trans	-95.8	-46.1	175.9	-178.8	0	0	0	0	112	P573 L574 V578 K579	P573-V576 PolarHBondContact O-N 2.95Å; L574-V576 VanDerWaalsContact C-N 3.3Å; L574-V576 PolarHBondContact O-N 2.66Å; V576-V578 PolarHBondContact O-N 2.91Å; V576-K579 PolarHBondContact O-N 3.44Å
577	E	48.9	Very low	43.2	Very low	148 Å²	148	126.1 Å²	126.1	69%	0.692	67%	0.673	S	S	*	*	H	α-helix	trans	-66.9	-38.1	-173.8	-62.7	-169.1	127	0	0	112.5	K579 M580 A581	E577-K579 PolarHBondContact O-N 3.35Å; E577-M580 PolarHBondContact O-N 3.23Å; E577-M580 VanDerWaalsContact O-N 3.1Å; E577-A581 PolarHBondContact O-N 3.26Å
578	V	51.2	Low	43.9	Very low	101 Å²	101	127.7 Å²	127.7	61%	0.612	66%	0.66	S	S	*	*	H	α-helix	trans	-54.8	-39.5	175.7	177.4	0	0	0	0	111.7	V576 M580 G582	V576-V578 PolarHBondContact O-N 2.91Å; V578-M580 VanDerWaalsContact C-N 3.32Å; V578-M580 PolarHBondContact O-N 3.47Å; V578-G582 PolarHBondContact O-N 3.25Å
579	K	45.6	Very low	44.4	Very low	125 Å²	125	129 Å²	129	54%	0.543	65%	0.653	S	S	.	*	H	α-helix	trans	-74.8	-19.1	-177.1	-64	-173.6	-179.1	67.5	0	113.6	D575 V576 E577	D575-K579 PolarHBondContact O-NZ 2.97Å; D575-K579 IonicContact OD1-NZ 3.73Å; D575-K579 PolarHBondContact OD1-NZ 2.83Å; D575-K579 IonicContact OD2-NZ 2.67Å; D575-K579 PolarHBondContact OD2-NZ 3.34Å; V576-K579 PolarHBondContact O-N 3.44Å; E577-K579 PolarHBondContact O-N 3.35Å
580	M	44.9	Very low	45	Very low	149 Å²	149	125.8 Å²	125.8	73%	0.734	64%	0.641	S	S	*	*	H	α-helix	trans	-92.7	-38.6	173.5	-64.7	-131.2	-84	0	0	112.2	E577 V578 G582 K583	E577-M580 PolarHBondContact O-N 3.23Å; E577-M580 VanDerWaalsContact O-N 3.1Å; V578-M580 VanDerWaalsContact C-N 3.32Å; V578-M580 PolarHBondContact O-N 3.47Å; M580-G582 PolarHBondContact O-N 3.09Å; M580-K583 PolarHBondContact O-N 3.08Å
581	A	46.9	Very low	45.3	Very low	61 Å²	61	127.7 Å²	127.7	50%	0.504	63%	0.631	S	S	.	*	H	α-helix	trans	-61.4	-41.3	176.8	0	0	0	0	0	113.1	E577 K583 A584 R585	E577-A581 PolarHBondContact O-N 3.26Å; A581-K583 PolarHBondContact O-N 3.1Å; A581-A584 PolarHBondContact O-N 3.15Å; A581-R585 PolarHBondContact O-N 3.03Å
582	G	44.9	Very low	45.7	Very low	41 Å²	41	123.9 Å²	123.9	42%	0.423	63%	0.626	S	S	.	*	H	α-helix	trans	-58.7	-33.3	179.3	0	0	0	0	0	113.8	V578 M580 A584 R585 E586	V578-G582 PolarHBondContact O-N 3.25Å; M580-G582 PolarHBondContact O-N 3.09Å; G582-A584 VanDerWaalsContact C-N 3.28Å; G582-A584 PolarHBondContact O-N 3.07Å; G582-R585 PolarHBondContact O-N 2.78Å; G582-E586 PolarHBondContact O-N 3.1Å
583	K	47.6	Very low	45.6	Very low	174 Å²	174	121.4 Å²	121.4	76%	0.757	62%	0.624	S	S	*	*	H	α-helix	trans	-76.1	-12.9	-176.8	-134.6	167.5	-171	170.9	0	114	M580 A581	M580-K583 PolarHBondContact O-N 3.08Å; A581-K583 PolarHBondContact O-N 3.1Å
584	A	43	Very low	45.6	Very low	54 Å²	54	122 Å²	122	45%	0.446	63%	0.631	S	S	.	*	H	α-helix	trans	-87.4	-48.6	170.9	0	0	0	0	0	111.7	A581 G582 E586 K587	A581-A584 PolarHBondContact O-N 3.15Å; G582-A584 VanDerWaalsContact C-N 3.28Å; G582-A584 PolarHBondContact O-N 3.07Å; A584-E586 PolarHBondContact O-N 2.96Å; A584-K587 PolarHBondContact O-N 2.9Å; A584-K587 VanDerWaalsContact O-N 3.14Å
585	R	46.5	Very low	44.7	Very low	210 Å²	210	119.2 Å²	119.2	79%	0.792	63%	0.633	S	S	*	*	H	α-helix	trans	-58.1	-33.8	179.2	-81.9	-173.7	167.1	-167.4	-4.2	113	A581 G582 K587 R589	A581-R585 PolarHBondContact O-N 3.03Å; G582-R585 PolarHBondContact O-N 2.78Å; R585-K587 VanDerWaalsContact C-N 3.27Å; R585-K587 PolarHBondContact O-N 3.13Å; R585-R589 PolarHBondContact O-N 2.86Å
586	E	47	Very low	44.2	Very low	88 Å²	88	119.1 Å²	119.1	41%	0.411	65%	0.647	S	S	.	*	H	α-helix	trans	-59.8	-32.9	178.2	-166.6	67.8	171.8	0	0	113.7	G582 A584 R589	G582-E586 PolarHBondContact O-N 3.1Å; A584-E586 PolarHBondContact O-N 2.96Å; E586-R589 IonicContact OE2-CZ 2.81Å; E586-R589 IonicContact OE2-NE 2.61Å; E586-R589 IonicContact OE2-NH2 3.6Å; E586-R589 PolarHBondContact OE2-NH2 3.2Å
587	K	45	Very low	43.5	Very low	156 Å²	156	119.4 Å²	119.4	68%	0.678	65%	0.654	S	S	*	*	H	α-helix	trans	-80	-33.9	-176.2	-74.1	-170.4	173	-173.5	0	114.1	A584 R585	A584-K587 PolarHBondContact O-N 2.9Å; A584-K587 VanDerWaalsContact O-N 3.14Å; R585-K587 VanDerWaalsContact C-N 3.27Å; R585-K587 PolarHBondContact O-N 3.13Å
588	F	43	Very low	43.1	Very low	145 Å²	145	118.7 Å²	118.7	64%	0.636	66%	0.662	S	S	*	*	H	α-helix	trans	-71.2	-42.3	177.4	-72.8	-80.4	0	0	0	111.1	Q590 I591	F588-Q590 PolarHBondContact O-N 3.18Å; F588-I591 PolarHBondContact O-N 3.05Å
589	R	46.9	Very low	42.1	Very low	177 Å²	177	119.8 Å²	119.8	67%	0.668	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-16.6	180	-176.8	164.1	60.2	175.1	-0.9	115	R585 E586	R585-R589 PolarHBondContact O-N 2.86Å; E586-R589 IonicContact OE2-CZ 2.81Å; E586-R589 IonicContact OE2-NE 2.61Å; E586-R589 IonicContact OE2-NH2 3.6Å; E586-R589 PolarHBondContact OE2-NH2 3.2Å
590	Q	45.6	Very low	41.5	Very low	142 Å²	142	121.6 Å²	121.6	66%	0.664	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-7.4	176.5	-69.7	-177.6	-2.2	0	0	114	F588	F588-Q590 PolarHBondContact O-N 3.18Å
591	I	49.1	Very low	41.5	Very low	120 Å²	120	118.5 Å²	118.5	62%	0.615	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-39.8	-178.2	-60.5	176.8	0	0	0	111.2	F588 A593	F588-I591 PolarHBondContact O-N 3.05Å; I591-A593 PolarHBondContact O-N 3.29Å
592	D	40.7	Very low	40.9	Very low	139 Å²	139	123.8 Å²	123.8	74%	0.743	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	0.4	-175.9	-54.7	-48.9	0	0	0	114.2	S594	D592-S594 PolarHBondContact O-N 3.44Å
593	A	40.8	Very low	40.4	Very low	85 Å²	85	130.3 Å²	130.3	70%	0.702	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	7.5	-169.9	0	0	0	0	0	115.5	I591	I591-A593 PolarHBondContact O-N 3.29Å
594	S	43.6	Very low	39.5	Very low	113 Å²	113	125.9 Å²	125.9	79%	0.79	70%	0.699	S	S	*	*			trans	-122.6	70.1	-177.7	63.3	0	0	0	0	112.9	D592	D592-S594 PolarHBondContact O-N 3.44Å
595	G	29.9	Very low	39.1	Very low	68 Å²	68	131.6 Å²	131.6	70%	0.701	71%	0.714	S	S	*	*			trans	-152.8	45.2	-166.3	0	0	0	0	0	118.9
596	A	31.1	Very low	38.4	Very low	105 Å²	105	131 Å²	131	87%	0.868	72%	0.717	S	S	*	*			trans	64.3	157.9	164.9	0	0	0	0	0	119.4
597	S	31.4	Very low	37.6	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	73%	0.73	S	S	*	*			trans	-129.7	165.2	-179	-47	0	0	0	0	111.8
598	P	41.3	Very low	36.9	Very low	133 Å²	133	130.4 Å²	130.4	86%	0.864	74%	0.737	S	S	*	*				-129.5	179.1	114.9	38.7	-32.6	0	0	0	113.3
599	V	30.2	Very low	36.6	Very low	123 Å²	123	131 Å²	131	75%	0.745	74%	0.741	S	S	*	*			trans	-147.5	151.8	-175.1	166.4	0	0	0	0	109.4
600	L	32.3	Very low	36.2	Very low	164 Å²	164	127.6 Å²	127.6	86%	0.859	74%	0.742	S	S	*	*			trans	178.9	160.6	145.8	-92.8	167.4	0	0	0	110.3
601	P	44.3	Very low	35.7	Very low	84 Å²	84	125.5 Å²	125.5	55%	0.545	74%	0.743	S	S	.	*				-148.4	175.3	-122.9	45.6	-26.1	0	0	0	120.8
602	Q	35.2	Very low	34.8	Very low	171 Å²	171	127.1 Å²	127.1	80%	0.799	75%	0.746	S	S	*	*			trans	66.8	137.3	142.8	-80	169.6	-61.7	0	0	122.7
603	Q	33.3	Very low	34.2	Very low	178 Å²	178	130 Å²	130	83%	0.832	75%	0.746	S	S	*	*				-171.5	-135.4	105.5	-91.5	-158	78.3	0	0	116.3
604	S	30	Very low	33.9	Very low	81 Å²	81	131 Å²	131	57%	0.566	74%	0.74	S	S	*	*			trans	-177.4	166.5	-142	29.5	0	0	0	0	117.5
605	K	35	Very low	33.5	Very low	174 Å²	174	132.5 Å²	132.5	76%	0.757	73%	0.732	S	S	*	*			cis	-174.9	153.7	-14.6	-98.5	157.1	-162.4	158.7	0	110.6
606	K	31.8	Very low	33.6	Very low	199 Å²	199	137 Å²	137	87%	0.865	73%	0.732	S	S	*	*			trans	64.5	168.9	157.8	-69.3	-180	179.9	-169.3	0	117.8
607	S	29.4	Very low	33.7	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	72%	0.72	S	S	*	*			cis	-175	178.5	-35.5	64.4	0	0	0	0	111.2
608	T	29.8	Very low	33.7	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	72%	0.72	S	S	*	*			trans	104.5	154.7	151.4	-44.7	0	0	0	0	120.8
609	E	36.2	Very low	33.2	Very low	156 Å²	156	139.1 Å²	139.1	73%	0.729	71%	0.707	S	S	*	*			trans	-126.3	-159.1	-173.9	-141.5	-131.5	127.5	0	0	109.8	S611	E609-S611 PolarHBondContact OE1-N 3.24Å
610	P	40.1	Very low	34.3	Very low	107 Å²	107	138.4 Å²	138.4	70%	0.695	71%	0.705	S	S	*	*			cis	-144.9	166.3	6.1	44.5	-23.2	0	0	0	123.1
611	S	34	Very low	34.2	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	70%	0.702	S	S	*	*			trans	35.2	143.5	141.2	-155.6	0	0	0	0	125.4	E609	E609-S611 PolarHBondContact OE1-N 3.24Å
612	K	29.6	Very low	33.5	Very low	155 Å²	155	136.3 Å²	136.3	67%	0.674	71%	0.705	S	S	*	*				150.5	150.4	104.7	-158.7	170.7	179.8	172.9	0	118.2
613	W	29.6	Very low	33.5	Very low	198 Å²	198	134.2 Å²	134.2	75%	0.75	70%	0.695	S	S	*	*			trans	80.6	151.5	170.1	-53.3	106.6	0	0	0	117.6
614	D	33.5	Very low	33.6	Very low	106 Å²	106	131.3 Å²	131.3	57%	0.567	69%	0.689	S	S	*	*			cis	-146	168.8	10	-146	-4.5	0	0	0	116.4
615	K	34.6	Very low	33.6	Very low	146 Å²	146	133.8 Å²	133.8	64%	0.635	69%	0.694	S	S	*	*			trans	-13.7	157.8	167.2	-66	157	-160.7	80.3	0	119.2
616	K	33.3	Very low	33.3	Very low	161 Å²	161	131.4 Å²	131.4	70%	0.7	69%	0.69	S	S	*	*			cis	-175.7	-177.6	-4.4	-104.3	-178.6	151.2	-77.4	0	105.7
617	D	33.3	Very low	33.1	Very low	114 Å²	114	131.8 Å²	131.8	61%	0.61	69%	0.686	S	S	*	*			cis	-167.1	168.3	-2.5	-110	-5.3	0	0	0	107.5
618	D	31.6	Very low	33.1	Very low	139 Å²	139	136.9 Å²	136.9	74%	0.743	69%	0.69	S	S	*	*			cis	-152	-110.1	-17.8	-177.4	-114	0	0	0	110.4
619	K	30.8	Very low	32.9	Very low	138 Å²	138	136.8 Å²	136.8	60%	0.6	69%	0.685	S	S	*	*			trans	-161.4	-170.5	-164.3	-108	-162.6	174.5	-170.7	0	113.1	E623	K619-E623 IonicContact NZ-OE2 2.66Å; K619-E623 PolarHBondContact NZ-OE2 3.36Å
620	P	53.1	Low	32.5	Very low	108 Å²	108	133.7 Å²	133.7	70%	0.701	68%	0.677	S	S	*	*			cis	-107.5	-159.1	-9.9	25.1	-1.3	0	0	0	110.2
621	V	29.1	Very low	32	Very low	132 Å²	132	135.4 Å²	135.4	80%	0.8	68%	0.68	S	S	*	*			cis	-150.6	158.8	14.4	-177.9	0	0	0	0	107.3
622	A	30.9	Very low	31.8	Very low	72 Å²	72	140.5 Å²	140.5	60%	0.595	69%	0.693	S	S	*	*			cis	-179.8	170.5	-39.6	0	0	0	0	0	106.1
623	E	33.4	Very low	31.7	Very low	127 Å²	127	140.6 Å²	140.6	59%	0.593	70%	0.696	S	S	*	*			cis	-168.8	171.9	-9.5	-130.1	8.1	-65.2	0	0	108.3	K619	K619-E623 IonicContact NZ-OE2 2.66Å; K619-E623 PolarHBondContact NZ-OE2 3.36Å
624	V	35.8	Very low	31.5	Very low	117 Å²	117	138.9 Å²	138.9	71%	0.709	70%	0.696	S	S	*	*			trans	55.9	124.3	141	166.2	0	0	0	0	120.6
625	I	29.7	Very low	31.6	Very low	133 Å²	133	139.4 Å²	139.4	68%	0.682	71%	0.706	S	S	*	*			cis	-154.7	146.5	17	-138	174.2	0	0	0	115
626	N	29.3	Very low	31.9	Very low	124 Å²	124	141 Å²	141	66%	0.663	72%	0.715	S	S	*	*			trans	52.8	159.1	154.9	-66.3	-18.7	0	0	0	122.6
627	R	28.9	Very low	32	Very low	207 Å²	207	142.1 Å²	142.1	78%	0.781	72%	0.723	S	S	*	*			cis	176.6	120.8	-38.6	-104.5	176.1	-169.8	-135.4	4.5	104.5
628	R	28.8	Very low	32.1	Very low	203 Å²	203	145.9 Å²	145.9	77%	0.766	74%	0.737	S	S	*	*				69.7	119.2	67.1	-166.2	-149.9	-67	177.2	-3.7	114.7
629	N	26.1	Very low	32.5	Very low	133 Å²	133	148.1 Å²	148.1	71%	0.711	74%	0.743	S	S	*	*			trans	174.5	140.3	138.2	-91.1	17.5	0	0	0	107.5
630	T	26.6	Very low	33.3	Very low	91 Å²	91	148.6 Å²	148.6	56%	0.558	75%	0.752	S	S	*	*			cis	67.5	137.3	47.6	69.6	0	0	0	0	114.1
631	D	29.2	Very low	33	Very low	143 Å²	143	150.4 Å²	150.4	77%	0.765	76%	0.756	S	S	*	*			cis	-170.3	151.6	-15.6	-86	-35.9	0	0	0	105.9
632	E	29.8	Very low	33.8	Very low	204 Å²	204	147.9 Å²	147.9	95%	0.953	75%	0.749	S	S	*	*			trans	-165.2	168.7	160.2	-116.8	157.1	-151.7	0	0	112.9
633	Q	28.4	Very low	34.3	Very low	157 Å²	157	152.3 Å²	152.3	73%	0.734	76%	0.755	S	S	*	*			trans	-125.3	152.1	-154.3	-68.7	171.9	-112.4	0	0	116.2
634	E	24.6	Very low	35.3	Very low	161 Å²	161	151.5 Å²	151.5	75%	0.752	76%	0.755	S	S	*	*			trans	62.1	157	146.1	-76.2	161.7	-136.4	0	0	120.5
635	P	36.5	Very low	36.3	Very low	118 Å²	118	150.3 Å²	150.3	77%	0.766	75%	0.747	S	S	*	*			cis	-127.4	-155.1	-21	38.5	-19.4	0	0	0	113
636	E	40.1	Very low	37.4	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	75%	0.745	S	S	*	*			trans	-35.6	154.3	172.9	-66.4	150.9	-165.7	0	0	116
637	E	36.7	Very low	38.6	Very low	184 Å²	184	149.1 Å²	149.1	86%	0.86	74%	0.736	S	S	*	*				-159.6	145.6	61.5	-68.8	160.9	178	0	0	111.7
638	E	34.6	Very low	40	Very low	194 Å²	194	143.9 Å²	143.9	91%	0.907	72%	0.722	S	S	*	*			trans	172.5	93.2	151.7	-103.1	172.8	-155.1	0	0	112.1
639	E	41.2	Very low	41.1	Very low	186 Å²	186	139.6 Å²	139.6	87%	0.869	71%	0.713	S	S	*	*			trans	-125.9	-12	166.3	-81.8	-155.9	144.8	0	0	114.7	D641	E639-D641 PolarHBondContact O-N 3.35Å
640	D	45.8	Very low	42.5	Very low	148 Å²	148	137.4 Å²	137.4	79%	0.791	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-30.6	-167.3	-71	-53.4	0	0	0	115.4	A642 F643	D640-A642 PolarHBondContact O-N 3.21Å; D640-F643 PolarHBondContact O-N 2.75Å; D640-F643 VanDerWaalsContact O-N 3.15Å
641	D	46.8	Very low	43.9	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	70%	0.704	S	S	*	*	H	α-helix	trans	-59.7	-22.2	-176.7	-95.7	9.5	0	0	0	113.7	E639 F643	E639-D641 PolarHBondContact O-N 3.35Å; D641-F643 VanDerWaalsContact C-N 3.34Å; D641-F643 PolarHBondContact O-N 3.14Å
642	A	47.3	Very low	44.7	Very low	79 Å²	79	139.8 Å²	139.8	65%	0.653	70%	0.697	S	S	*	*	H	α-helix	trans	-72.7	-23.1	-179.1	0	0	0	0	0	113.8	D640	D640-A642 PolarHBondContact O-N 3.21Å
643	F	40.6	Very low	45.6	Very low	166 Å²	166	137.3 Å²	137.3	73%	0.728	68%	0.683	S	S	*	*	H	α-helix	trans	-87.1	-41.9	-170.8	-144.8	-93.9	0	0	0	112.7	D640 D641 K646 N647	D640-F643 PolarHBondContact O-N 2.75Å; D640-F643 VanDerWaalsContact O-N 3.15Å; D641-F643 VanDerWaalsContact C-N 3.34Å; D641-F643 PolarHBondContact O-N 3.14Å; F643-K646 WeakPolarHBondContact O-CB 3.42Å; F643-K646 PolarHBondContact O-N 2.73Å; F643-K646 VanDerWaalsContact O-N 3.16Å; F643-N647 PolarHBondContact O-N 2.75Å
644	D	55.1	Low	46.5	Very low	110 Å²	110	134.9 Å²	134.9	59%	0.588	68%	0.675	S	S	*	*	H	α-helix	trans	-75.3	-30.8	-171.9	-130.3	9.6	0	0	0	112.8	K646 N647 L648	D644-K646 PolarHBondContact O-N 2.75Å; D644-N647 WeakPolarHBondContact O-CB 3.42Å; D644-N647 PolarHBondContact O-N 2.63Å; D644-N647 PolarHBondContact OD1-ND2 2.67Å; D644-L648 VanDerWaalsContact O-CB 3.32Å; D644-L648 WeakPolarHBondContact O-CB 3.37Å; D644-L648 PolarHBondContact O-N 3.03Å
645	V	56.1	Low	47.8	Very low	91 Å²	91	132.5 Å²	132.5	55%	0.552	67%	0.666	S	S	*	*	H	α-helix	trans	-57.8	-40.2	168.9	178.9	0	0	0	0	111	M649	V645-M649 HydrophobicContact CG1-SD 4.31Å; V645-M649 WeakPolarHBondContact O-CB 3.1Å; V645-M649 PolarHBondContact O-N 2.83Å
646	K	52.8	Low	48	Very low	144 Å²	144	130 Å²	130	63%	0.626	66%	0.662	S	S	*	*	H	α-helix	trans	-73.9	-38.2	-178.3	-157	171	-171.7	173.5	0	111.9	F643 D644 N650	F643-K646 WeakPolarHBondContact O-CB 3.42Å; F643-K646 PolarHBondContact O-N 2.73Å; F643-K646 VanDerWaalsContact O-N 3.16Å; D644-K646 PolarHBondContact O-N 2.75Å; K646-N650 PolarHBondContact O-N 3.02Å; K646-N650 VanDerWaalsContact O-N 3.11Å
647	N	55.3	Low	48.2	Very low	89 Å²	89	127.7 Å²	127.7	48%	0.476	66%	0.656	S	S	.	*	H	α-helix	trans	-60.8	-47.6	171.7	-170.1	17.9	0	0	0	111.1	F643 D644 N650 K651	F643-N647 PolarHBondContact O-N 2.75Å; D644-N647 WeakPolarHBondContact O-CB 3.42Å; D644-N647 PolarHBondContact O-N 2.63Å; D644-N647 PolarHBondContact OD1-ND2 2.67Å; N647-N650 PolarHBondContact O-N 2.99Å; N647-K651 PolarHBondContact O-N 3.4Å
648	L	57.8	Low	48.5	Very low	96 Å²	96	122.4 Å²	122.4	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-65.4	-40.7	177.7	-168.4	63	0	0	0	112.4	D644 N650 K651 F652	D644-L648 VanDerWaalsContact O-CB 3.32Å; D644-L648 WeakPolarHBondContact O-CB 3.37Å; D644-L648 PolarHBondContact O-N 3.03Å; L648-N650 VanDerWaalsContact C-N 3.34Å; L648-N650 PolarHBondContact O-N 3.25Å; L648-K651 WeakPolarHBondContact O-CB 3.41Å; L648-K651 PolarHBondContact O-N 3.46Å; L648-K651 VanDerWaalsContact O-N 3.17Å; L648-F652 HydrophobicContact CD1-CD2 4.24Å; L648-F652 HydrophobicContact CD1-CE2 4.01Å; L648-F652 HydrophobicContact CG-CD2 4.16Å; L648-F652 HydrophobicContact CG-CE2 4.17Å; L648-F652 WeakPolarHBondContact O-CD2 3.27Å; L648-F652 PolarHBondContact O-N 3.18Å
649	M	52.4	Low	49	Very low	114 Å²	114	116.7 Å²	116.7	56%	0.562	63%	0.632	S	S	*	*	H	α-helix	trans	-57.8	-43.6	173.2	-113.4	62.7	170.3	0	0	112.4	V645 F652 K653	V645-M649 HydrophobicContact CG1-SD 4.31Å; V645-M649 WeakPolarHBondContact O-CB 3.1Å; V645-M649 PolarHBondContact O-N 2.83Å; M649-F652 PolarHBondContact O-N 2.92Å; M649-K653 PolarHBondContact O-N 2.84Å
650	N	54.5	Low	49.2	Very low	87 Å²	87	114 Å²	114	47%	0.465	62%	0.623	S	S	.	*	H	α-helix	trans	-66.5	-39.2	176.3	-72.2	-16.4	0	0	0	111.2	K646 N647 L648 F652 K653 N654	K646-N650 PolarHBondContact O-N 3.02Å; K646-N650 VanDerWaalsContact O-N 3.11Å; N647-N650 PolarHBondContact O-N 2.99Å; L648-N650 VanDerWaalsContact C-N 3.34Å; L648-N650 PolarHBondContact O-N 3.25Å; N650-F652 VanDerWaalsContact C-N 3.34Å; N650-F652 PolarHBondContact O-N 2.87Å; N650-K653 PolarHBondContact O-N 3.25Å; N650-N654 VanDerWaalsContact O-CG 3.23Å; N650-N654 PolarHBondContact O-N 3.45Å; N650-N654 PolarHBondContact O-OD1 2.93Å
651	K	55.4	Low	49	Very low	142 Å²	142	114.3 Å²	114.3	62%	0.617	62%	0.62	S	S	*	*	H	α-helix	trans	-62.3	-39.4	177	-147.7	164.5	-170.7	170.3	0	112.1	N647 L648 I655	N647-K651 PolarHBondContact O-N 3.4Å; L648-K651 WeakPolarHBondContact O-CB 3.41Å; L648-K651 PolarHBondContact O-N 3.46Å; L648-K651 VanDerWaalsContact O-N 3.17Å; K651-I655 WeakPolarHBondContact O-CD1 3.49Å; K651-I655 WeakPolarHBondContact O-CG1 3.44Å; K651-I655 PolarHBondContact O-N 3.48Å
652	F	47.6	Very low	49	Very low	141 Å²	141	112 Å²	112	62%	0.618	60%	0.603	S	S	*	*	H	α-helix	trans	-71.4	-36.2	174.1	-88.4	-76.5	0	0	0	113.9	L648 M649 N650 I655 G656	L648-F652 HydrophobicContact CD1-CD2 4.24Å; L648-F652 HydrophobicContact CD1-CE2 4.01Å; L648-F652 HydrophobicContact CG-CD2 4.16Å; L648-F652 HydrophobicContact CG-CE2 4.17Å; L648-F652 WeakPolarHBondContact O-CD2 3.27Å; L648-F652 PolarHBondContact O-N 3.18Å; M649-F652 PolarHBondContact O-N 2.92Å; N650-F652 VanDerWaalsContact C-N 3.34Å; N650-F652 PolarHBondContact O-N 2.87Å; F652-I655 PolarHBondContact O-N 3.34Å; F652-G656 PolarHBondContact O-N 2.89Å
653	K	47.4	Very low	48.8	Very low	153 Å²	153	112.5 Å²	112.5	67%	0.665	60%	0.598	S	S	*	*	H	α-helix	trans	-60.8	-46.2	171.8	-78.1	-175.1	173.2	-174.5	0	111.7	M649 N650 I655 G656 D657	M649-K653 PolarHBondContact O-N 2.84Å; N650-K653 PolarHBondContact O-N 3.25Å; K653-I655 PolarHBondContact O-N 2.93Å; K653-G656 PolarHBondContact O-N 3.31Å; K653-D657 PolarHBondContact O-N 2.81Å
654	N	48.8	Very low	49	Very low	105 Å²	105	111.4 Å²	111.4	56%	0.561	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-20	-177.6	-64.8	10	0	0	0	113.2	N650 S658	N650-N654 VanDerWaalsContact O-CG 3.23Å; N650-N654 PolarHBondContact O-N 3.45Å; N650-N654 PolarHBondContact O-OD1 2.93Å; N654-S658 WeakPolarHBondContact O-CB 3.42Å; N654-S658 PolarHBondContact O-N 2.91Å; N654-S658 VanDerWaalsContact O-N 3.17Å; N654-S658 PolarHBondContact O-OG 3.26Å
655	I	50.4	Low	48.7	Very low	112 Å²	112	110 Å²	110	57%	0.574	59%	0.588	S	S	*	*	H	α-helix	trans	-75.2	-28.7	171.3	-69.8	164.6	0	0	0	111.8	K651 F652 K653 S658	K651-I655 WeakPolarHBondContact O-CD1 3.49Å; K651-I655 WeakPolarHBondContact O-CG1 3.44Å; K651-I655 PolarHBondContact O-N 3.48Å; F652-I655 PolarHBondContact O-N 3.34Å; K653-I655 PolarHBondContact O-N 2.93Å; I655-S658 WeakPolarHBondContact CA-OG 3.41Å; I655-S658 PolarHBondContact O-OG 3Å
656	G	42.1	Very low	48.5	Very low	66 Å²	66	110.5 Å²	110.5	68%	0.68	59%	0.591	S	S	*	*	H	α-helix	trans	-71.7	-35.1	171.3	0	0	0	0	0	113.7	F652 K653	F652-G656 PolarHBondContact O-N 2.89Å; K653-G656 PolarHBondContact O-N 3.31Å
657	D	43.7	Very low	48.5	Very low	130 Å²	130	110 Å²	110	70%	0.695	59%	0.591	S	S	*	*	H	α-helix	trans	-84.5	-23.7	-177.3	-109.1	-26.3	0	0	0	113.8	K653 G659 N660	K653-D657 PolarHBondContact O-N 2.81Å; D657-G659 PolarHBondContact O-N 3.37Å; D657-G659 VanDerWaalsContact O-N 3.16Å; D657-N660 PolarHBondContact O-N 2.82Å
658	S	42.1	Very low	48.4	Very low	72 Å²	72	110 Å²	110	50%	0.503	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-74.2	-1.7	-178.2	37.4	0	0	0	0	114.3	N654 I655 N660	N654-S658 WeakPolarHBondContact O-CB 3.42Å; N654-S658 PolarHBondContact O-N 2.91Å; N654-S658 VanDerWaalsContact O-N 3.17Å; N654-S658 PolarHBondContact O-OG 3.26Å; I655-S658 WeakPolarHBondContact CA-OG 3.41Å; I655-S658 PolarHBondContact O-OG 3Å; S658-N660 VanDerWaalsContact C-N 3.27Å; S658-N660 PolarHBondContact O-N 3.06Å
659	G	46	Very low	48.2	Very low	74 Å²	74	113 Å²	113	76%	0.763	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-73.9	-8.4	170.8	0	0	0	0	0	115.2	D657	D657-G659 PolarHBondContact O-N 3.37Å; D657-G659 VanDerWaalsContact O-N 3.16Å
660	N	44.3	Very low	48.6	Very low	129 Å²	129	110.4 Å²	110.4	69%	0.69	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-144.2	60.3	-177.5	-169.9	16.3	0	0	0	113.4	D657 S658 K662	D657-N660 PolarHBondContact O-N 2.82Å; S658-N660 VanDerWaalsContact C-N 3.27Å; S658-N660 PolarHBondContact O-N 3.06Å; N660-K662 PolarHBondContact O-N 3.34Å
661	Q	42.2	Very low	49.1	Very low	156 Å²	156	111.2 Å²	111.2	73%	0.729	59%	0.591	S	S	*	*			trans	-74.7	68.7	170.4	-74.5	-161.1	-45.8	0	0	112.5	T663	Q661-T663 HydrophobicContact CB-CG2 4.17Å; Q661-T663 HydrophobicContact CG-CG2 4.41Å; Q661-T663 PolarHBondContact O-N 2.96Å
662	K	46.4	Very low	49.3	Very low	95 Å²	95	106.3 Å²	106.3	41%	0.413	57%	0.571	S	S	.	*			trans	-87.2	54.9	165.6	-158.6	165	-172.5	164.3	0	111.3	N660 Q664 N665 E731	N660-K662 PolarHBondContact O-N 3.34Å; K662-Q664 PolarHBondContact O-N 3.44Å; K662-N665 HydrophobicContact CG-CB 4.41Å; K662-N665 PolarHBondContact O-N 3.45Å; K662-E731 WeakPolarHBondContact CE-OE1 3.49Å; K662-E731 IonicContact NZ-OE1 3.69Å; K662-E731 PolarHBondContact NZ-OE1 3.38Å; K662-E731 IonicContact NZ-OE2 2.73Å; K662-E731 PolarHBondContact NZ-OE2 2.61Å
663	T	43.6	Very low	50.1	Low	90 Å²	90	103.8 Å²	103.8	55%	0.552	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	4.2	-167.5	46.9	0	0	0	0	115.7	Q661	Q661-T663 HydrophobicContact CB-CG2 4.17Å; Q661-T663 HydrophobicContact CG-CG2 4.41Å; Q661-T663 PolarHBondContact O-N 2.96Å
664	Q	45.7	Very low	51.3	Low	143 Å²	143	99.4 Å²	99.4	67%	0.668	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-15	172.6	-63.1	-174.9	-71.3	0	0	113.6	K662	K662-Q664 PolarHBondContact O-N 3.44Å
665	N	48.9	Very low	52.1	Low	82 Å²	82	98.2 Å²	98.2	44%	0.439	55%	0.547	S	S	.	.	H	α-helix	trans	-85.3	-21.3	-174.2	-142.7	-92.6	0	0	0	113.6	K662 R669	K662-N665 HydrophobicContact CG-CB 4.41Å; K662-N665 PolarHBondContact O-N 3.45Å; N665-R669 WeakPolarHBondContact O-CB 3.43Å; N665-R669 PolarHBondContact O-N 3.19Å
666	T	50.3	Low	52.9	Low	101 Å²	101	97 Å²	97	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-73.6	-37	178.4	41.5	0	0	0	0	113	R669 A670	T666-R669 PolarHBondContact O-N 2.7Å; T666-A670 PolarHBondContact O-N 3.33Å; T666-A670 VanDerWaalsContact O-N 3.09Å
667	E	53	Low	53.9	Low	133 Å²	133	97 Å²	97	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-73.4	-52.1	-176.6	-60.3	-174.5	146.7	0	0	110.5	R669 A670 E671	E667-R669 PolarHBondContact O-N 3.34Å; E667-R669 VanDerWaalsContact O-N 3.16Å; E667-A670 WeakPolarHBondContact O-CA 3.39Å; E667-A670 WeakPolarHBondContact O-CB 3.35Å; E667-A670 PolarHBondContact O-N 3.26Å; E667-E671 WeakPolarHBondContact O-CG 3.18Å; E667-E671 PolarHBondContact O-N 2.94Å
668	H	53.2	Low	55	Low	88 Å²	88	92.8 Å²	92.8	41%	0.407	51%	0.509	S	S	.	.	H	α-helix	trans	-58	-29.3	172.4	-75.1	-36.2	0	0	0	113.6	E671 L672	H668-E671 IonicContact CE1-OE2 3.71Å; H668-E671 IonicContact CG-OE2 3.23Å; H668-E671 IonicContact ND1-OE2 2.96Å; H668-E671 PolarHBondContact ND1-OE2 3.16Å; H668-L672 WeakPolarHBondContact O-CB 3.4Å; H668-L672 VanDerWaalsContact O-CG 3.32Å; H668-L672 WeakPolarHBondContact O-CG 3.33Å; H668-L672 PolarHBondContact O-N 3.14Å
669	R	53.4	Low	56	Low	159 Å²	159	91.4 Å²	91.4	60%	0.6	50%	0.503	S	S	*	.	H	α-helix	trans	-70	-40.8	172.2	-176.1	172.7	180	122.5	10.7	112.4	N665 T666 E667 L672 E673	N665-R669 WeakPolarHBondContact O-CB 3.43Å; N665-R669 PolarHBondContact O-N 3.19Å; T666-R669 PolarHBondContact O-N 2.7Å; E667-R669 PolarHBondContact O-N 3.34Å; E667-R669 VanDerWaalsContact O-N 3.16Å; R669-L672 PolarHBondContact O-N 2.94Å; R669-E673 IonicContact CZ-OE1 2.99Å; R669-E673 IonicContact NE-OE1 3.9Å; R669-E673 PolarHBondContact NE-OE1 2.83Å; R669-E673 IonicContact NH2-OE1 2.97Å; R669-E673 PolarHBondContact NH2-OE1 2.91Å; R669-E673 PolarHBondContact O-N 2.88Å; R669-E673 VanDerWaalsContact O-N 3.1Å
670	A	61.8	Low	56.9	Low	61 Å²	61	94.6 Å²	94.6	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-65	-40.6	175.6	0	0	0	0	0	111.4	T666 E667 E673 A674	T666-A670 PolarHBondContact O-N 3.33Å; T666-A670 VanDerWaalsContact O-N 3.09Å; E667-A670 WeakPolarHBondContact O-CA 3.39Å; E667-A670 WeakPolarHBondContact O-CB 3.35Å; E667-A670 PolarHBondContact O-N 3.26Å; A670-E673 PolarHBondContact O-N 2.89Å; A670-E673 VanDerWaalsContact O-N 3.16Å; A670-A674 WeakPolarHBondContact O-CB 3.21Å; A670-A674 PolarHBondContact O-N 3.35Å
671	E	64.6	Low	58.1	Low	104 Å²	104	92.7 Å²	92.7	49%	0.486	49%	0.485	S	S	.	.	H	α-helix	trans	-59.2	-47.8	173	-67.5	173.7	156.9	0	0	111.7	E667 H668 E673 A674 L675	E667-E671 WeakPolarHBondContact O-CG 3.18Å; E667-E671 PolarHBondContact O-N 2.94Å; H668-E671 IonicContact CE1-OE2 3.71Å; H668-E671 IonicContact CG-OE2 3.23Å; H668-E671 IonicContact ND1-OE2 2.96Å; H668-E671 PolarHBondContact ND1-OE2 3.16Å; E671-E673 PolarHBondContact O-N 3.33Å; E671-A674 PolarHBondContact O-N 2.73Å; E671-L675 WeakPolarHBondContact O-CB 3.09Å; E671-L675 WeakPolarHBondContact O-CG 3.43Å; E671-L675 PolarHBondContact O-N 2.97Å
672	L	60.8	Low	58.9	Low	39 Å²	39	90.8 Å²	90.8	20%	0.204	48%	0.475	C	S	.	.	H	α-helix	trans	-67.8	-13.1	176.5	-74.4	172.1	0	0	0	114.4	H668 R669 K676 R717	H668-L672 WeakPolarHBondContact O-CB 3.4Å; H668-L672 VanDerWaalsContact O-CG 3.32Å; H668-L672 WeakPolarHBondContact O-CG 3.33Å; H668-L672 PolarHBondContact O-N 3.14Å; R669-L672 PolarHBondContact O-N 2.94Å; L672-K676 WeakPolarHBondContact O-CD 3.31Å; L672-K676 WeakPolarHBondContact O-CE 3.05Å; L672-K676 WeakPolarHBondContact O-CG 3.28Å; L672-K676 PolarHBondContact O-NZ 2.83Å; L672-R717 HydrophobicContact CD2-CG 4.39Å
673	E	62.8	Low	59.6	Low	87 Å²	87	92.5 Å²	92.5	41%	0.407	48%	0.482	S	S	.	.	H	α-helix	trans	-95.8	-34.5	170.3	-72.2	-177.2	-168.2	0	0	111.6	R669 A670 E671 K676 C677	R669-E673 IonicContact CZ-OE1 2.99Å; R669-E673 IonicContact NE-OE1 3.9Å; R669-E673 PolarHBondContact NE-OE1 2.83Å; R669-E673 IonicContact NH2-OE1 2.97Å; R669-E673 PolarHBondContact NH2-OE1 2.91Å; R669-E673 PolarHBondContact O-N 2.88Å; R669-E673 VanDerWaalsContact O-N 3.1Å; A670-E673 PolarHBondContact O-N 2.89Å; A670-E673 VanDerWaalsContact O-N 3.16Å; E671-E673 PolarHBondContact O-N 3.33Å; E673-K676 WeakPolarHBondContact O-CB 3.42Å; E673-K676 PolarHBondContact O-N 2.99Å; E673-C677 PolarHBondContact O-N 3.13Å; E673-C677 PolarHBondContact O-SG 3.28Å
674	A	72.3	Confident	60.4	Low	61 Å²	61	90.3 Å²	90.3	50%	0.504	47%	0.473	S	S	.	.	H	α-helix	trans	-61	-45.6	169.7	0	0	0	0	0	112.1	A670 E671 K676 C677 A678	A670-A674 WeakPolarHBondContact O-CB 3.21Å; A670-A674 PolarHBondContact O-N 3.35Å; E671-A674 PolarHBondContact O-N 2.73Å; A674-K676 VanDerWaalsContact C-N 3.28Å; A674-K676 PolarHBondContact O-N 3.43Å; A674-C677 PolarHBondContact O-N 3.24Å; A674-C677 VanDerWaalsContact O-N 3.09Å; A674-A678 PolarHBondContact O-N 3.34Å
675	L	66.7	Low	61.1	Low	80 Å²	80	89.7 Å²	89.7	42%	0.419	47%	0.468	S	S	.	.	H	α-helix	trans	-61	-34.8	174.1	-71.8	164.5	0	0	0	112.2	E671 A679 M713	E671-L675 WeakPolarHBondContact O-CB 3.09Å; E671-L675 WeakPolarHBondContact O-CG 3.43Å; E671-L675 PolarHBondContact O-N 2.97Å; L675-A679 WeakPolarHBondContact O-CB 3.4Å; L675-A679 PolarHBondContact O-N 2.74Å; L675-M713 HydrophobicContact CD2-CE 3.86Å; L675-M713 HydrophobicContact CD2-SD 4.49Å
676	K	66.2	Low	61.3	Low	86 Å²	86	93.4 Å²	93.4	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-71.3	-30.1	173.8	-74	168.6	-165.5	145.7	0	113	L672 E673 A674 K680	L672-K676 WeakPolarHBondContact O-CD 3.31Å; L672-K676 WeakPolarHBondContact O-CE 3.05Å; L672-K676 WeakPolarHBondContact O-CG 3.28Å; L672-K676 PolarHBondContact O-NZ 2.83Å; E673-K676 WeakPolarHBondContact O-CB 3.42Å; E673-K676 PolarHBondContact O-N 2.99Å; A674-K676 VanDerWaalsContact C-N 3.28Å; A674-K676 PolarHBondContact O-N 3.43Å; K676-K680 WeakPolarHBondContact O-CD 3.29Å; K676-K680 VanDerWaalsContact O-CG 3.3Å; K676-K680 WeakPolarHBondContact O-CG 3.02Å; K676-K680 PolarHBondContact O-N 2.6Å
677	C	63.3	Low	61.6	Low	67 Å²	67	94.6 Å²	94.6	45%	0.453	48%	0.479	S	S	.	.	H	α-helix	trans	-73	-49	172.9	-70.3	0	0	0	0	110.5	E673 A674 A679 K680 D681	E673-C677 PolarHBondContact O-N 3.13Å; E673-C677 PolarHBondContact O-SG 3.28Å; A674-C677 PolarHBondContact O-N 3.24Å; A674-C677 VanDerWaalsContact O-N 3.09Å; C677-A679 VanDerWaalsContact C-N 3.29Å; C677-A679 PolarHBondContact O-N 3.07Å; C677-K680 WeakPolarHBondContact O-CA 3.17Å; C677-K680 WeakPolarHBondContact O-CB 3.03Å; C677-K680 PolarHBondContact O-N 2.93Å; C677-D681 PolarHBondContact O-N 3.45Å
678	A	67.1	Low	61.8	Low	41 Å²	41	95.1 Å²	95.1	34%	0.339	49%	0.486	S	S	.	.	H	α-helix	trans	-53.8	-43.6	175.5	0	0	0	0	0	112.6	A674 K680 D681 F682	A674-A678 PolarHBondContact O-N 3.34Å; A678-K680 VanDerWaalsContact C-N 3.32Å; A678-K680 PolarHBondContact O-N 3.33Å; A678-D681 PolarHBondContact O-N 3.14Å; A678-F682 WeakPolarHBondContact O-CD2 3.28Å; A678-F682 PolarHBondContact O-N 3.23Å
679	A	63.1	Low	61.7	Low	44 Å²	44	94.9 Å²	94.9	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-31.6	176	0	0	0	0	0	113.8	L675 C677 K683	L675-A679 WeakPolarHBondContact O-CB 3.4Å; L675-A679 PolarHBondContact O-N 2.74Å; C677-A679 VanDerWaalsContact C-N 3.29Å; C677-A679 PolarHBondContact O-N 3.07Å; A679-K683 PolarHBondContact O-N 3.49Å
680	K	66.3	Low	61.5	Low	141 Å²	141	90.7 Å²	90.7	61%	0.613	51%	0.506	S	S	*	.	H	α-helix	trans	-73.4	-42.1	173	-71.1	167.4	-177.5	177	0	111.4	K676 C677 A678 F682 K683 A684	K676-K680 WeakPolarHBondContact O-CD 3.29Å; K676-K680 VanDerWaalsContact O-CG 3.3Å; K676-K680 WeakPolarHBondContact O-CG 3.02Å; K676-K680 PolarHBondContact O-N 2.6Å; C677-K680 WeakPolarHBondContact O-CA 3.17Å; C677-K680 WeakPolarHBondContact O-CB 3.03Å; C677-K680 PolarHBondContact O-N 2.93Å; A678-K680 VanDerWaalsContact C-N 3.32Å; A678-K680 PolarHBondContact O-N 3.33Å; K680-F682 VanDerWaalsContact C-N 3.3Å; K680-F682 PolarHBondContact O-N 3.39Å; K680-K683 PolarHBondContact O-N 3.44Å; K680-K683 VanDerWaalsContact O-N 3.13Å; K680-A684 PolarHBondContact O-N 3.14Å
681	D	68.6	Low	61.1	Low	89 Å²	89	97.2 Å²	97.2	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-67.2	-32.2	-179.8	-62.6	-27.5	0	0	0	111.9	C677 A678 K685	C677-D681 PolarHBondContact O-N 3.45Å; A678-D681 PolarHBondContact O-N 3.14Å; D681-K685 WeakPolarHBondContact O-CD 3.48Å; D681-K685 VanDerWaalsContact O-CG 3.24Å; D681-K685 WeakPolarHBondContact O-CG 3.42Å; D681-K685 PolarHBondContact O-N 3.42Å; D681-K685 VanDerWaalsContact O-N 3.14Å
682	F	59.8	Low	60.2	Low	115 Å²	115	96.9 Å²	96.9	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-68	-41.7	169	-96.2	-83.6	0	0	0	112.6	A678 K680 A684 K685 F686 M706	A678-F682 WeakPolarHBondContact O-CD2 3.28Å; A678-F682 PolarHBondContact O-N 3.23Å; K680-F682 VanDerWaalsContact C-N 3.3Å; K680-F682 PolarHBondContact O-N 3.39Å; F682-A684 PolarHBondContact O-N 3.28Å; F682-K685 PolarHBondContact O-N 3.29Å; F682-F686 PolarHBondContact O-N 3.5Å; F682-M706 HydrophobicContact CD1-CE 3.87Å; F682-M706 HydrophobicContact CE1-CE 4.03Å
683	K	59.3	Low	59.7	Low	131 Å²	131	103.3 Å²	103.3	57%	0.57	58%	0.576	S	S	*	*	H	α-helix	trans	-63.2	-41	174.2	-178.4	169.7	172.6	174.1	0	112.2	A679 K680 K685 F686 E687	A679-K683 PolarHBondContact O-N 3.49Å; K680-K683 PolarHBondContact O-N 3.44Å; K680-K683 VanDerWaalsContact O-N 3.13Å; K683-K685 VanDerWaalsContact C-N 3.27Å; K683-K685 PolarHBondContact O-N 3.11Å; K683-F686 WeakPolarHBondContact O-CB 3.46Å; K683-F686 PolarHBondContact O-N 2.96Å; K683-F686 VanDerWaalsContact O-N 3.16Å; K683-E687 WeakPolarHBondContact CE-OE1 3.41Å; K683-E687 IonicContact NZ-OE1 2.61Å; K683-E687 PolarHBondContact O-N 3.36Å; K683-E687 VanDerWaalsContact O-N 3.11Å
684	A	60.9	Low	59.5	Low	44 Å²	44	102.6 Å²	102.6	36%	0.364	58%	0.584	S	S	.	*	H	α-helix	trans	-63	-32.2	175.1	0	0	0	0	0	112.6	K680 F682 N688	K680-A684 PolarHBondContact O-N 3.14Å; F682-A684 PolarHBondContact O-N 3.28Å; A684-N688 PolarHBondContact O-ND2 3.06Å
685	K	60.3	Low	58.9	Low	130 Å²	130	105.9 Å²	105.9	57%	0.565	59%	0.594	S	S	*	*	H	α-helix	trans	-70.9	-36.8	172.7	-70.9	161.8	-169.4	169.2	0	112.5	D681 F682 K683 N688 A689	D681-K685 WeakPolarHBondContact O-CD 3.48Å; D681-K685 VanDerWaalsContact O-CG 3.24Å; D681-K685 WeakPolarHBondContact O-CG 3.42Å; D681-K685 PolarHBondContact O-N 3.42Å; D681-K685 VanDerWaalsContact O-N 3.14Å; F682-K685 PolarHBondContact O-N 3.29Å; K683-K685 VanDerWaalsContact C-N 3.27Å; K683-K685 PolarHBondContact O-N 3.11Å; K685-N688 PolarHBondContact O-N 2.9Å; K685-A689 WeakPolarHBondContact O-CB 3.41Å; K685-A689 PolarHBondContact O-N 3.4Å
686	F	53.2	Low	58.7	Low	160 Å²	160	105.9 Å²	105.9	70%	0.702	61%	0.605	S	S	*	*	H	α-helix	trans	-62.3	-45.7	175.2	-177.3	-93.9	0	0	0	111.8	F682 K683 N688 A689	F682-F686 PolarHBondContact O-N 3.5Å; K683-F686 WeakPolarHBondContact O-CB 3.46Å; K683-F686 PolarHBondContact O-N 2.96Å; K683-F686 VanDerWaalsContact O-N 3.16Å; F686-N688 PolarHBondContact O-N 3.47Å; F686-A689 PolarHBondContact O-N 3.35Å
687	E	57.4	Low	58.7	Low	127 Å²	127	105.5 Å²	105.5	59%	0.593	62%	0.618	S	S	*	*	H	α-helix	trans	-67.7	-14.3	-179.6	-69.8	173.5	178	0	0	113.9	K683	K683-E687 WeakPolarHBondContact CE-OE1 3.41Å; K683-E687 IonicContact NZ-OE1 2.61Å; K683-E687 PolarHBondContact O-N 3.36Å; K683-E687 VanDerWaalsContact O-N 3.11Å
688	N	56	Low	59.1	Low	143 Å²	143	105.9 Å²	105.9	77%	0.765	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	1.8	179.1	-75	-82.3	0	0	0	114.5	A684 K685 F686	A684-N688 PolarHBondContact O-ND2 3.06Å; K685-N688 PolarHBondContact O-N 2.9Å; F686-N688 PolarHBondContact O-N 3.47Å
689	A	52.5	Low	59.2	Low	84 Å²	84	107.8 Å²	107.8	69%	0.694	63%	0.625	S	S	*	*			trans	-96.8	16.9	-174.5	0	0	0	0	0	114.5	K685 F686	K685-A689 WeakPolarHBondContact O-CB 3.41Å; K685-A689 PolarHBondContact O-N 3.4Å; F686-A689 PolarHBondContact O-N 3.35Å
690	G	49.2	Very low	59.8	Low	71 Å²	71	110.5 Å²	110.5	73%	0.732	63%	0.63	S	S	*	*			trans	-96	27	-161.2	0	0	0	0	0	118.3
691	E	52.2	Low	60.3	Low	198 Å²	198	106.4 Å²	106.4	93%	0.925	62%	0.623	S	S	*	*			trans	-158.5	86.9	176.2	-126.9	169.5	-140.8	0	0	114.1
692	A	47	Very low	60.8	Low	96 Å²	96	108.7 Å²	108.7	79%	0.793	63%	0.629	S	S	*	*	S	Bend	trans	-176.2	146.5	156.6	0	0	0	0	0	111
693	D	50.4	Low	61.6	Low	174 Å²	174	109.3 Å²	109.3	93%	0.93	63%	0.628	S	S	*	*			trans	-67.6	127.5	-174.2	-55.3	-95.7	0	0	0	114.7
694	A	56.7	Low	62.6	Low	72 Å²	72	108.5 Å²	108.5	60%	0.595	63%	0.626	S	S	*	*			trans	-153.1	149.6	165.9	0	0	0	0	0	110.7	A696 V699	A694-A696 PolarHBondContact O-N 2.81Å; A694-V699 HydrophobicContact CB-CG2 4.3Å
695	D	60.9	Low	63.5	Low	130 Å²	130	111.7 Å²	111.7	70%	0.695	63%	0.633	S	S	*	*			trans	-54.2	128.3	-174	-71.9	-69	0	0	0	113.6	A697 V698 V699	D695-A697 PolarHBondContact O-N 2.89Å; D695-A697 VanDerWaalsContact O-N 3.11Å; D695-V698 HydrophobicContact CB-CG2 4.15Å; D695-V698 WeakPolarHBondContact O-CA 3.25Å; D695-V698 WeakPolarHBondContact O-CB 3.18Å; D695-V698 PolarHBondContact O-N 2.86Å; D695-V699 PolarHBondContact O-N 3.42Å; D695-V699 VanDerWaalsContact O-N 3.08Å
696	A	62.7	Low	64.2	Low	80 Å²	80	110 Å²	110	66%	0.661	63%	0.628	S	S	*	*	H	α-helix	trans	-54.8	-36.7	-173.1	0	0	0	0	0	113.7	A694 V698 V699 E700	A694-A696 PolarHBondContact O-N 2.81Å; A696-V698 VanDerWaalsContact C-N 3.33Å; A696-V698 PolarHBondContact O-N 3.49Å; A696-V699 PolarHBondContact O-N 2.72Å; A696-E700 WeakPolarHBondContact O-CB 3.23Å; A696-E700 PolarHBondContact O-N 3.15Å
697	A	66.7	Low	65.4	Low	78 Å²	78	107 Å²	107	65%	0.645	62%	0.617	S	S	*	*	H	α-helix	trans	-66.5	-31.6	176.3	0	0	0	0	0	113.2	D695 A701	D695-A697 PolarHBondContact O-N 2.89Å; D695-A697 VanDerWaalsContact O-N 3.11Å; A697-A701 VanDerWaalsContact O-CB 3.23Å; A697-A701 WeakPolarHBondContact O-CB 3.12Å; A697-A701 PolarHBondContact O-N 3.32Å
698	V	70.1	Confident	66.7	Low	75 Å²	75	107.8 Å²	107.8	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-76.5	-34.9	175.3	-179	0	0	0	0	110.5	D695 A696 K702	D695-V698 HydrophobicContact CB-CG2 4.15Å; D695-V698 WeakPolarHBondContact O-CA 3.25Å; D695-V698 WeakPolarHBondContact O-CB 3.18Å; D695-V698 PolarHBondContact O-N 2.86Å; A696-V698 VanDerWaalsContact C-N 3.33Å; A696-V698 PolarHBondContact O-N 3.49Å; V698-K702 HydrophobicContact CG1-CD 4.4Å; V698-K702 WeakPolarHBondContact O-CB 3.5Å; V698-K702 VanDerWaalsContact O-CG 3.27Å; V698-K702 WeakPolarHBondContact O-CG 3.05Å; V698-K702 PolarHBondContact O-N 2.96Å; V698-K702 VanDerWaalsContact O-N 3.09Å
699	V	69.5	Low	67.9	Low	81 Å²	81	105.4 Å²	105.4	49%	0.491	61%	0.605	S	S	.	*	H	α-helix	trans	-66.3	-44.8	173	179.3	0	0	0	0	110.8	A694 D695 A696 K702 R703	A694-V699 HydrophobicContact CB-CG2 4.3Å; D695-V699 PolarHBondContact O-N 3.42Å; D695-V699 VanDerWaalsContact O-N 3.08Å; A696-V699 PolarHBondContact O-N 2.72Å; V699-K702 PolarHBondContact O-N 3.19Å; V699-R703 WeakPolarHBondContact O-CB 3.15Å; V699-R703 PolarHBondContact O-N 3.16Å
700	E	76.4	Confident	69.2	Low	101 Å²	101	108.1 Å²	108.1	47%	0.472	60%	0.601	S	S	.	*	H	α-helix	trans	-71.9	-38.4	-179.8	-172.2	143.5	-129.7	0	0	112.8	A696 R703 Q704	A696-E700 WeakPolarHBondContact O-CB 3.23Å; A696-E700 PolarHBondContact O-N 3.15Å; E700-R703 WeakPolarHBondContact O-CB 3.05Å; E700-R703 PolarHBondContact O-N 3.49Å; E700-R703 IonicContact OE1-NH1 2.63Å; E700-Q704 WeakPolarHBondContact O-CG 3.16Å; E700-Q704 PolarHBondContact O-N 3.45Å
701	A	76.3	Confident	70.8	Confident	55 Å²	55	110.1 Å²	110.1	46%	0.455	59%	0.591	S	S	.	*	H	α-helix	trans	-62.1	-42.7	171.8	0	0	0	0	0	112.2	A697 R703 Q704 Q705	A697-A701 VanDerWaalsContact O-CB 3.23Å; A697-A701 WeakPolarHBondContact O-CB 3.12Å; A697-A701 PolarHBondContact O-N 3.32Å; A701-R703 VanDerWaalsContact C-N 3.34Å; A701-Q704 PolarHBondContact O-N 3.48Å; A701-Q705 PolarHBondContact O-N 3.12Å
702	K	78.6	Confident	72.4	Confident	137 Å²	137	102.4 Å²	102.4	60%	0.596	56%	0.562	S	S	*	*	H	α-helix	trans	-62.9	-39.9	172.7	-78.1	175.6	178.6	178.8	0	112	V698 V699 Q705 M706	V698-K702 HydrophobicContact CG1-CD 4.4Å; V698-K702 WeakPolarHBondContact O-CB 3.5Å; V698-K702 VanDerWaalsContact O-CG 3.27Å; V698-K702 WeakPolarHBondContact O-CG 3.05Å; V698-K702 PolarHBondContact O-N 2.96Å; V698-K702 VanDerWaalsContact O-N 3.09Å; V699-K702 PolarHBondContact O-N 3.19Å; K702-Q705 PolarHBondContact O-N 3.45Å; K702-M706 WeakPolarHBondContact O-CB 3.26Å; K702-M706 WeakPolarHBondContact O-CG 3.17Å; K702-M706 PolarHBondContact O-N 2.99Å
703	R	77.3	Confident	73.7	Confident	128 Å²	128	101.8 Å²	101.8	48%	0.483	54%	0.543	S	S	.	.	H	α-helix	trans	-61.1	-47.2	175.7	-176.8	-170.6	149.3	-143	-13.9	110.9	V699 E700 A701 M706 E707	V699-R703 WeakPolarHBondContact O-CB 3.15Å; V699-R703 PolarHBondContact O-N 3.16Å; E700-R703 WeakPolarHBondContact O-CB 3.05Å; E700-R703 PolarHBondContact O-N 3.49Å; E700-R703 IonicContact OE1-NH1 2.63Å; A701-R703 VanDerWaalsContact C-N 3.34Å; R703-M706 PolarHBondContact O-N 3.37Å; R703-E707 IonicContact CZ-OE2 3.92Å; R703-E707 IonicContact NE-OE2 2.84Å; R703-E707 PolarHBondContact NE-OE2 3.29Å; R703-E707 VanDerWaalsContact NE-OE2 3.15Å; R703-E707 IonicContact NH2-OE1 3.41Å; R703-E707 IonicContact NH2-OE2 2.65Å; R703-E707 PolarHBondContact NH2-OE2 3.29Å; R703-E707 WeakPolarHBondContact O-CB 3.49Å; R703-E707 PolarHBondContact O-N 2.82Å
704	Q	80.9	Confident	75.4	Confident	114 Å²	114	99.2 Å²	99.2	53%	0.533	52%	0.524	S	S	.	.	H	α-helix	trans	-61	-45.9	178.5	-72.3	173.8	4.3	0	0	111.6	E700 A701 M706 E707 E708	E700-Q704 WeakPolarHBondContact O-CG 3.16Å; E700-Q704 PolarHBondContact O-N 3.45Å; A701-Q704 PolarHBondContact O-N 3.48Å; Q704-M706 VanDerWaalsContact C-N 3.34Å; Q704-M706 PolarHBondContact O-N 3.28Å; Q704-E707 PolarHBondContact O-N 3.39Å; Q704-E707 VanDerWaalsContact O-N 3.15Å; Q704-E708 PolarHBondContact O-N 3.41Å
705	Q	79.7	Confident	76.9	Confident	111 Å²	111	102.6 Å²	102.6	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-58.6	-43.9	175.3	-172	-174.4	-23.7	0	0	112.2	A701 K702 E707 E708 E709	A701-Q705 PolarHBondContact O-N 3.12Å; K702-Q705 PolarHBondContact O-N 3.45Å; Q705-E707 VanDerWaalsContact C-N 3.32Å; Q705-E707 PolarHBondContact O-N 3.2Å; Q705-E708 PolarHBondContact O-N 2.9Å; Q705-E709 PolarHBondContact NE2-OE1 3.33Å; Q705-E709 WeakPolarHBondContact O-CB 3.46Å; Q705-E709 WeakPolarHBondContact O-CG 3.46Å; Q705-E709 PolarHBondContact O-N 3.06Å
706	M	74.2	Confident	78	Confident	94 Å²	94	102.4 Å²	102.4	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-68.3	-29.6	177.7	-66.3	-75.6	-60.8	0	0	113	F682 K702 R703 Q704 F710	F682-M706 HydrophobicContact CD1-CE 3.87Å; F682-M706 HydrophobicContact CE1-CE 4.03Å; K702-M706 WeakPolarHBondContact O-CB 3.26Å; K702-M706 WeakPolarHBondContact O-CG 3.17Å; K702-M706 PolarHBondContact O-N 2.99Å; R703-M706 PolarHBondContact O-N 3.37Å; Q704-M706 VanDerWaalsContact C-N 3.34Å; Q704-M706 PolarHBondContact O-N 3.28Å; M706-F710 WeakPolarHBondContact O-CB 3.13Å; M706-F710 PolarHBondContact O-N 3.16Å
707	E	78	Confident	78.9	Confident	99 Å²	99	104.3 Å²	104.3	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-75.9	-38.5	177.4	-159.5	151.9	-167.6	0	0	110.2	R703 Q704 Q705 F710 E711	R703-E707 IonicContact CZ-OE2 3.92Å; R703-E707 IonicContact NE-OE2 2.84Å; R703-E707 PolarHBondContact NE-OE2 3.29Å; R703-E707 VanDerWaalsContact NE-OE2 3.15Å; R703-E707 IonicContact NH2-OE1 3.41Å; R703-E707 IonicContact NH2-OE2 2.65Å; R703-E707 PolarHBondContact NH2-OE2 3.29Å; R703-E707 WeakPolarHBondContact O-CB 3.49Å; R703-E707 PolarHBondContact O-N 2.82Å; Q704-E707 PolarHBondContact O-N 3.39Å; Q704-E707 VanDerWaalsContact O-N 3.15Å; Q705-E707 VanDerWaalsContact C-N 3.32Å; Q705-E707 PolarHBondContact O-N 3.2Å; E707-F710 PolarHBondContact O-N 3Å; E707-E711 PolarHBondContact O-N 2.87Å
708	E	86	Confident	79.7	Confident	143 Å²	143	106.8 Å²	106.8	67%	0.668	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-42.5	169	-71.9	-175.4	166.5	0	0	113	Q704 Q705 F710 E711 A712	Q704-E708 PolarHBondContact O-N 3.41Å; Q705-E708 PolarHBondContact O-N 2.9Å; E708-F710 VanDerWaalsContact C-N 3.31Å; E708-F710 PolarHBondContact O-N 3.35Å; E708-E711 PolarHBondContact O-N 3.4Å; E708-A712 WeakPolarHBondContact O-CB 3.44Å; E708-A712 PolarHBondContact O-N 3.49Å
709	E	81.1	Confident	80.6	Confident	92 Å²	92	109.9 Å²	109.9	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-37.3	174.3	-76.6	175.2	-158.5	0	0	111.5	Q705 A712 M713	Q705-E709 PolarHBondContact NE2-OE1 3.33Å; Q705-E709 WeakPolarHBondContact O-CB 3.46Å; Q705-E709 WeakPolarHBondContact O-CG 3.46Å; Q705-E709 PolarHBondContact O-N 3.06Å; E709-A712 PolarHBondContact O-N 3.17Å; E709-M713 WeakPolarHBondContact O-CG 3.38Å; E709-M713 PolarHBondContact O-N 3.03Å
710	F	80	Confident	81.1	Confident	142 Å²	142	108 Å²	108	62%	0.623	51%	0.506	S	S	*	.	H	α-helix	trans	-69.3	-40.1	175	-170.4	-98.7	0	0	0	112.6	M706 E707 E708 A712 K714	M706-F710 WeakPolarHBondContact O-CB 3.13Å; M706-F710 PolarHBondContact O-N 3.16Å; E707-F710 PolarHBondContact O-N 3Å; E708-F710 VanDerWaalsContact C-N 3.31Å; E708-F710 PolarHBondContact O-N 3.35Å; F710-A712 VanDerWaalsContact C-N 3.34Å; F710-K714 WeakPolarHBondContact O-CB 3.34Å; F710-K714 PolarHBondContact O-N 3.13Å
711	E	82.9	Confident	80.9	Confident	112 Å²	112	108 Å²	108	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-67	-33.4	172.6	-70.6	-139.6	133	0	0	112.7	E707 E708 K714 R715	E707-E711 PolarHBondContact O-N 2.87Å; E708-E711 PolarHBondContact O-N 3.4Å; E711-K714 PolarHBondContact O-N 2.93Å; E711-R715 WeakPolarHBondContact O-CB 3.46Å; E711-R715 PolarHBondContact O-N 3.49Å
712	A	84.3	Confident	81.5	Confident	37 Å²	37	112.2 Å²	112.2	31%	0.306	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-51.1	173.2	0	0	0	0	0	111.8	E708 E709 F710 K714 R715 E716	E708-A712 WeakPolarHBondContact O-CB 3.44Å; E708-A712 PolarHBondContact O-N 3.49Å; E709-A712 PolarHBondContact O-N 3.17Å; F710-A712 VanDerWaalsContact C-N 3.34Å; A712-K714 VanDerWaalsContact C-N 3.26Å; A712-K714 PolarHBondContact O-N 3.4Å; A712-R715 WeakPolarHBondContact O-CB 3.45Å; A712-R715 PolarHBondContact O-N 3.5Å; A712-R715 VanDerWaalsContact O-N 3.1Å; A712-E716 PolarHBondContact O-N 3.46Å
713	M	75.4	Confident	81.9	Confident	82 Å²	82	114.3 Å²	114.3	40%	0.404	52%	0.519	S	S	.	.	H	α-helix	trans	-58.7	-35.1	175.2	-75.3	-81.7	-74.1	0	0	112.8	L675 E709 R717	L675-M713 HydrophobicContact CD2-CE 3.86Å; L675-M713 HydrophobicContact CD2-SD 4.49Å; E709-M713 WeakPolarHBondContact O-CG 3.38Å; E709-M713 PolarHBondContact O-N 3.03Å; M713-R717 WeakPolarHBondContact O-CB 3.21Å; M713-R717 PolarHBondContact O-N 3.25Å
714	K	86.3	Confident	81.9	Confident	120 Å²	120	110.8 Å²	110.8	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-44.9	174.3	-178.4	-173.3	168.6	-162.7	0	111.6	F710 E711 A712 R717 E718	F710-K714 WeakPolarHBondContact O-CB 3.34Å; F710-K714 PolarHBondContact O-N 3.13Å; E711-K714 PolarHBondContact O-N 2.93Å; A712-K714 VanDerWaalsContact C-N 3.26Å; A712-K714 PolarHBondContact O-N 3.4Å; K714-R717 PolarHBondContact O-N 2.99Å; K714-E718 PolarHBondContact O-N 3.32Å
715	R	86.9	Confident	81.8	Confident	144 Å²	144	109.9 Å²	109.9	54%	0.543	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-45.7	-179.6	-165	-171.1	-45.3	108.3	8.8	112.1	E711 A712 R717 E718 E719	E711-R715 WeakPolarHBondContact O-CB 3.46Å; E711-R715 PolarHBondContact O-N 3.49Å; A712-R715 WeakPolarHBondContact O-CB 3.45Å; A712-R715 PolarHBondContact O-N 3.5Å; A712-R715 VanDerWaalsContact O-N 3.1Å; R715-R717 VanDerWaalsContact C-N 3.31Å; R715-R717 PolarHBondContact O-N 3.2Å; R715-E718 PolarHBondContact O-N 3.25Å; R715-E718 VanDerWaalsContact O-N 3.14Å; R715-E719 WeakPolarHBondContact O-CB 3.12Å; R715-E719 PolarHBondContact O-N 3.45Å
716	E	84.8	Confident	82	Confident	125 Å²	125	110.8 Å²	110.8	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-58.4	-43.1	175.3	-178.5	177	-165.3	0	0	111.4	A712 E719 A720	A712-E716 PolarHBondContact O-N 3.46Å; E716-E719 PolarHBondContact O-N 3.14Å; E716-A720 WeakPolarHBondContact O-CB 3.33Å; E716-A720 PolarHBondContact O-N 2.99Å
717	R	82.2	Confident	82.1	Confident	121 Å²	121	110.2 Å²	110.2	46%	0.457	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-38.1	174.7	177.5	177.9	160.3	-160.6	-11.4	113	L672 M713 K714 R715 Q721	L672-R717 HydrophobicContact CD2-CG 4.39Å; M713-R717 WeakPolarHBondContact O-CB 3.21Å; M713-R717 PolarHBondContact O-N 3.25Å; K714-R717 PolarHBondContact O-N 2.99Å; R715-R717 VanDerWaalsContact C-N 3.31Å; R715-R717 PolarHBondContact O-N 3.2Å; R717-Q721 WeakPolarHBondContact O-CG 3.5Å; R717-Q721 PolarHBondContact O-N 2.84Å
718	E	83.9	Confident	82.1	Confident	130 Å²	130	111.7 Å²	111.7	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-68.5	-39.6	177.9	-168.6	166.5	175.6	0	0	111.2	K714 R715 Q721 K722	K714-E718 PolarHBondContact O-N 3.32Å; R715-E718 PolarHBondContact O-N 3.25Å; R715-E718 VanDerWaalsContact O-N 3.14Å; E718-Q721 PolarHBondContact O-N 3.43Å; E718-K722 WeakPolarHBondContact O-CB 3.44Å; E718-K722 PolarHBondContact O-N 3.01Å
719	E	86.9	Confident	81.6	Confident	140 Å²	140	109.8 Å²	109.8	65%	0.654	50%	0.501	S	S	*	.	H	α-helix	trans	-65.7	-41.5	172.9	-172.3	163.2	-161.9	0	0	112.2	R715 E716 K722 R723	R715-E719 WeakPolarHBondContact O-CB 3.12Å; R715-E719 PolarHBondContact O-N 3.45Å; E716-E719 PolarHBondContact O-N 3.14Å; E719-K722 PolarHBondContact O-N 3.35Å; E719-R723 WeakPolarHBondContact O-CB 3.3Å; E719-R723 PolarHBondContact O-N 2.97Å
720	A	80.6	Confident	81.3	Confident	40 Å²	40	108.1 Å²	108.1	33%	0.331	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-39.8	172.7	0	0	0	0	0	112.7	E716 R723 L724	E716-A720 WeakPolarHBondContact O-CB 3.33Å; E716-A720 PolarHBondContact O-N 2.99Å; A720-R723 PolarHBondContact O-N 2.95Å; A720-L724 PolarHBondContact O-N 3.11Å; A720-L724 VanDerWaalsContact O-N 3.1Å
721	Q	73.5	Confident	80.7	Confident	102 Å²	102	105.5 Å²	105.5	48%	0.477	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-40.7	173.6	-77.2	-167.6	-124.7	0	0	111.9	R717 E718 L724 E725	R717-Q721 WeakPolarHBondContact O-CG 3.5Å; R717-Q721 PolarHBondContact O-N 2.84Å; E718-Q721 PolarHBondContact O-N 3.43Å; Q721-L724 PolarHBondContact O-N 3Å; Q721-E725 PolarHBondContact O-N 3.2Å; Q721-E725 VanDerWaalsContact O-N 3.07Å
722	K	88.9	Confident	79.8	Confident	143 Å²	143	102.6 Å²	102.6	62%	0.622	49%	0.488	S	S	*	.	H	α-helix	trans	-63.2	-43.2	175.5	-174	-171.4	172.3	-162.4	0	111.7	E718 E719 L724 E725 E726	E718-K722 WeakPolarHBondContact O-CB 3.44Å; E718-K722 PolarHBondContact O-N 3.01Å; E719-K722 PolarHBondContact O-N 3.35Å; K722-L724 PolarHBondContact O-N 2.95Å; K722-E725 PolarHBondContact O-N 3.28Å; K722-E725 VanDerWaalsContact O-N 3.11Å; K722-E726 WeakPolarHBondContact O-CB 3.46Å; K722-E726 PolarHBondContact O-N 2.89Å
723	R	86.9	Confident	78.7	Confident	181 Å²	181	104.5 Å²	104.5	68%	0.683	50%	0.499	S	S	*	.	H	α-helix	trans	-60.8	-42.4	176.8	-179	174.7	168.8	-175	-6.2	112.1	E719 A720 E725 E726 E727	E719-R723 WeakPolarHBondContact O-CB 3.3Å; E719-R723 PolarHBondContact O-N 2.97Å; A720-R723 PolarHBondContact O-N 2.95Å; R723-E725 VanDerWaalsContact C-N 3.31Å; R723-E725 PolarHBondContact O-N 2.91Å; R723-E726 PolarHBondContact O-N 2.61Å; R723-E727 VanDerWaalsContact O-CB 3.3Å; R723-E727 WeakPolarHBondContact O-CB 3.37Å; R723-E727 PolarHBondContact O-N 3.49Å
724	L	76.3	Confident	78.1	Confident	54 Å²	54	104.6 Å²	104.6	28%	0.283	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-32.3	173	-86.4	166.8	0	0	0	113.1	A720 Q721 K722 R728	A720-L724 PolarHBondContact O-N 3.11Å; A720-L724 VanDerWaalsContact O-N 3.1Å; Q721-L724 PolarHBondContact O-N 3Å; K722-L724 PolarHBondContact O-N 2.95Å; L724-R728 VanDerWaalsContact O-CB 3.28Å; L724-R728 WeakPolarHBondContact O-CB 3.16Å; L724-R728 PolarHBondContact O-N 3.5Å
725	E	79	Confident	76.7	Confident	96 Å²	96	102 Å²	102	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-75.3	-37.8	175.8	-177.5	142.7	-114.8	0	0	112.3	Q721 K722 R723 R728 L729	Q721-E725 PolarHBondContact O-N 3.2Å; Q721-E725 VanDerWaalsContact O-N 3.07Å; K722-E725 PolarHBondContact O-N 3.28Å; K722-E725 VanDerWaalsContact O-N 3.11Å; R723-E725 VanDerWaalsContact C-N 3.31Å; R723-E725 PolarHBondContact O-N 2.91Å; E725-R728 PolarHBondContact O-N 3.4Å; E725-R728 IonicContact OE1-CZ 2.73Å; E725-R728 IonicContact OE1-NH1 3.63Å; E725-R728 PolarHBondContact OE1-NH1 3.45Å; E725-R728 IonicContact OE1-NH2 3.15Å; E725-R728 PolarHBondContact OE1-NH2 2.9Å; E725-L729 HydrophobicContact CG-CD1 4.34Å; E725-L729 WeakPolarHBondContact O-CB 3.49Å; E725-L729 VanDerWaalsContact O-CG 3.25Å; E725-L729 WeakPolarHBondContact O-CG 3.4Å; E725-L729 PolarHBondContact O-N 2.88Å
726	E	83.3	Confident	75.1	Confident	130 Å²	130	103 Å²	103	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-65.8	-41.6	173	-170.8	163.7	-167.2	0	0	111.6	K722 R723 L729 A730	K722-E726 WeakPolarHBondContact O-CB 3.46Å; K722-E726 PolarHBondContact O-N 2.89Å; R723-E726 PolarHBondContact O-N 2.61Å; E726-L729 PolarHBondContact O-N 3.44Å; E726-A730 PolarHBondContact O-N 3.18Å
727	E	77.3	Confident	73.7	Confident	82 Å²	82	100 Å²	100	38%	0.383	52%	0.524	S	S	.	.	H	α-helix	trans	-62	-46.7	171.5	-175.1	175.3	-171.5	0	0	111.8	R723 L729 A730 E731	R723-E727 VanDerWaalsContact O-CB 3.3Å; R723-E727 WeakPolarHBondContact O-CB 3.37Å; R723-E727 PolarHBondContact O-N 3.49Å; E727-L729 VanDerWaalsContact C-N 3.27Å; E727-L729 PolarHBondContact O-N 3.33Å; E727-A730 WeakPolarHBondContact O-CB 3.39Å; E727-A730 PolarHBondContact O-N 3.26Å; E727-A730 VanDerWaalsContact O-N 3.13Å; E727-E731 WeakPolarHBondContact O-CG 3.49Å; E727-E731 PolarHBondContact O-N 2.56Å
728	R	76.9	Confident	72.5	Confident	129 Å²	129	98.4 Å²	98.4	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-60.4	-35.2	175	-169.8	-163.5	73.8	-145.6	-5.6	112.4	L724 E725 A732	L724-R728 VanDerWaalsContact O-CB 3.28Å; L724-R728 WeakPolarHBondContact O-CB 3.16Å; L724-R728 PolarHBondContact O-N 3.5Å; E725-R728 PolarHBondContact O-N 3.4Å; E725-R728 IonicContact OE1-CZ 2.73Å; E725-R728 IonicContact OE1-NH1 3.63Å; E725-R728 PolarHBondContact OE1-NH1 3.45Å; E725-R728 IonicContact OE1-NH2 3.15Å; E725-R728 PolarHBondContact OE1-NH2 2.9Å; R728-A732 WeakPolarHBondContact O-CB 3.37Å; R728-A732 PolarHBondContact O-N 3.42Å
729	L	75.8	Confident	71.2	Confident	104 Å²	104	99.4 Å²	99.4	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-72.7	-36.7	175.6	-73.9	167	0	0	0	111.7	E725 E726 E727 A732 S733	E725-L729 HydrophobicContact CG-CD1 4.34Å; E725-L729 WeakPolarHBondContact O-CB 3.49Å; E725-L729 VanDerWaalsContact O-CG 3.25Å; E725-L729 WeakPolarHBondContact O-CG 3.4Å; E725-L729 PolarHBondContact O-N 2.88Å; E726-L729 PolarHBondContact O-N 3.44Å; E727-L729 VanDerWaalsContact C-N 3.27Å; E727-L729 PolarHBondContact O-N 3.33Å; L729-A732 PolarHBondContact O-N 3.5Å; L729-S733 PolarHBondContact O-N 3.12Å
730	A	75.1	Confident	69.8	Low	57 Å²	57	96.6 Å²	96.6	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-47.3	171.8	0	0	0	0	0	111.5	E726 E727 A732 S733 A734	E726-A730 PolarHBondContact O-N 3.18Å; E727-A730 WeakPolarHBondContact O-CB 3.39Å; E727-A730 PolarHBondContact O-N 3.26Å; E727-A730 VanDerWaalsContact O-N 3.13Å; A730-A732 VanDerWaalsContact C-N 3.35Å; A730-A732 PolarHBondContact O-N 2.87Å; A730-S733 PolarHBondContact O-N 2.94Å; A730-S733 PolarHBondContact O-OG 3.27Å; A730-A734 PolarHBondContact O-N 3.31Å
731	E	67.5	Low	68.7	Low	87 Å²	87	102.8 Å²	102.8	41%	0.407	54%	0.544	S	S	.	.	H	α-helix	trans	-56.2	-46	173.3	-70.9	-175	127.6	0	0	112.2	K662 E727 S733 A734 S735	K662-E731 WeakPolarHBondContact CE-OE1 3.49Å; K662-E731 IonicContact NZ-OE1 3.69Å; K662-E731 PolarHBondContact NZ-OE1 3.38Å; K662-E731 IonicContact NZ-OE2 2.73Å; K662-E731 PolarHBondContact NZ-OE2 2.61Å; E727-E731 WeakPolarHBondContact O-CG 3.49Å; E727-E731 PolarHBondContact O-N 2.56Å; E731-S733 VanDerWaalsContact C-N 3.34Å; E731-S733 PolarHBondContact O-N 3Å; E731-A734 WeakPolarHBondContact O-CB 3.41Å; E731-A734 PolarHBondContact O-N 2.88Å; E731-S735 PolarHBondContact O-N 3.37Å
732	A	63.1	Low	68	Low	51 Å²	51	102.4 Å²	102.4	42%	0.421	55%	0.545	S	S	.	.	H	α-helix	trans	-64.2	-36.5	177.6	0	0	0	0	0	112.6	R728 L729 A730 A734 S735	R728-A732 WeakPolarHBondContact O-CB 3.37Å; R728-A732 PolarHBondContact O-N 3.42Å; L729-A732 PolarHBondContact O-N 3.5Å; A730-A732 VanDerWaalsContact C-N 3.35Å; A730-A732 PolarHBondContact O-N 2.87Å; A732-A734 VanDerWaalsContact C-N 3.3Å; A732-A734 PolarHBondContact O-N 2.86Å; A732-S735 PolarHBondContact O-N 2.95Å; A732-S735 PolarHBondContact O-OG 3.48Å
733	S	63	Low	66.9	Low	77 Å²	77	102 Å²	102	54%	0.538	55%	0.546	S	S	.	.	H	α-helix	trans	-68.2	-30.1	174.7	74.4	0	0	0	0	112.6	L729 A730 E731	L729-S733 PolarHBondContact O-N 3.12Å; A730-S733 PolarHBondContact O-N 2.94Å; A730-S733 PolarHBondContact O-OG 3.27Å; E731-S733 VanDerWaalsContact C-N 3.34Å; E731-S733 PolarHBondContact O-N 3Å
734	A	63	Low	66	Low	83 Å²	83	97 Å²	97	69%	0.686	53%	0.533	S	S	*	.	H	α-helix	trans	-73.4	-23.4	177	0	0	0	0	0	113.4	A730 E731 A732	A730-A734 PolarHBondContact O-N 3.31Å; E731-A734 WeakPolarHBondContact O-CB 3.41Å; E731-A734 PolarHBondContact O-N 2.88Å; A732-A734 VanDerWaalsContact C-N 3.3Å; A732-A734 PolarHBondContact O-N 2.86Å
735	S	56.8	Low	65.7	Low	67 Å²	67	98.8 Å²	98.8	47%	0.469	55%	0.545	S	S	.	.	H	α-helix	trans	-78.9	-18.1	178.7	61.1	0	0	0	0	114.3	E731 A732 G737	E731-S735 PolarHBondContact O-N 3.37Å; A732-S735 PolarHBondContact O-N 2.95Å; A732-S735 PolarHBondContact O-OG 3.48Å; S735-G737 PolarHBondContact O-N 2.86Å
736	Q	52.6	Low	65.3	Low	163 Å²	163	96.9 Å²	96.9	76%	0.762	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	16.9	-177.1	-63.3	-167.4	-56.3	0	0	115.1
737	G	54.3	Low	65	Low	64 Å²	64	95.9 Å²	95.9	66%	0.66	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	4.9	-178.9	0	0	0	0	0	115.8	S735	S735-G737 PolarHBondContact O-N 2.86Å
738	N	57.8	Low	65.1	Low	86 Å²	86	97.5 Å²	97.5	46%	0.46	55%	0.55	S	S	.	.			trans	-148.6	25.5	-168.4	-111.1	-34.8	0	0	0	116.6	A740 R741 D742	N738-A740 VanDerWaalsContact C-N 3.26Å; N738-A740 PolarHBondContact O-N 3.08Å; N738-A740 VanDerWaalsContact O-N 3.07Å; N738-R741 HydrophobicContact CB-CB 4.49Å; N738-R741 PolarHBondContact O-N 3.07Å; N738-R741 WeakPolarHBondContact OD1-CD 3.47Å; N738-D742 PolarHBondContact O-N 2.92Å
739	E	56.7	Low	65.3	Low	152 Å²	152	93.8 Å²	93.8	71%	0.71	55%	0.546	S	S	*	.	H	α-helix	trans	-45.8	-45.7	-175.6	-60.2	177.3	141.1	0	0	113.5	R741 D742 E743	E739-R741 VanDerWaalsContact C-N 3.29Å; E739-R741 PolarHBondContact O-N 2.86Å; E739-D742 PolarHBondContact O-N 2.89Å; E739-D742 VanDerWaalsContact O-N 3.16Å; E739-E743 PolarHBondContact O-N 3.38Å
740	A	57.2	Low	65.3	Low	81 Å²	81	93.7 Å²	93.7	67%	0.669	54%	0.543	S	S	*	.	H	α-helix	trans	-66.6	-19.7	178.9	0	0	0	0	0	115.3	N738 D744	N738-A740 VanDerWaalsContact C-N 3.26Å; N738-A740 PolarHBondContact O-N 3.08Å; N738-A740 VanDerWaalsContact O-N 3.07Å; A740-D744 WeakPolarHBondContact O-CB 3.24Å
741	R	58.3	Low	65.5	Low	170 Å²	170	96 Å²	96	64%	0.642	54%	0.544	S	S	*	.	H	α-helix	trans	-84.6	-34.9	171.2	-81	-176.2	62.2	158.5	-4.6	111.8	N738 E739 D744 V745	N738-R741 HydrophobicContact CB-CB 4.49Å; N738-R741 PolarHBondContact O-N 3.07Å; N738-R741 WeakPolarHBondContact OD1-CD 3.47Å; E739-R741 VanDerWaalsContact C-N 3.29Å; E739-R741 PolarHBondContact O-N 2.86Å; R741-D744 PolarHBondContact O-N 2.92Å; R741-V745 WeakPolarHBondContact O-CB 3.43Å; R741-V745 VanDerWaalsContact O-CG2 3.29Å; R741-V745 WeakPolarHBondContact O-CG2 3.47Å; R741-V745 PolarHBondContact O-N 3.37Å
742	D	59	Low	66	Low	93 Å²	93	94.5 Å²	94.5	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-76.2	-34.7	-177.5	-67	-21.8	0	0	0	111.7	N738 E739 V745 A746	N738-D742 PolarHBondContact O-N 2.92Å; E739-D742 PolarHBondContact O-N 2.89Å; E739-D742 VanDerWaalsContact O-N 3.16Å; D742-V745 PolarHBondContact O-N 2.97Å; D742-A746 VanDerWaalsContact O-CB 3.28Å; D742-A746 WeakPolarHBondContact O-CB 3.34Å; D742-A746 PolarHBondContact O-N 2.76Å
743	E	64.3	Low	66.8	Low	135 Å²	135	95.8 Å²	95.8	63%	0.631	55%	0.552	S	S	*	*	H	α-helix	trans	-59.9	-46.5	166.7	-70.7	-170.7	152.5	0	0	111.9	E739 V745 A746 I747	E739-E743 PolarHBondContact O-N 3.38Å; E743-V745 VanDerWaalsContact C-N 3.31Å; E743-V745 PolarHBondContact O-N 3.06Å; E743-A746 PolarHBondContact O-N 2.91Å; E743-A746 VanDerWaalsContact O-N 3.15Å; E743-I747 VanDerWaalsContact O-CG1 3.3Å; E743-I747 WeakPolarHBondContact O-CG1 3.47Å; E743-I747 PolarHBondContact O-N 3.27Å
744	D	68.6	Low	67.7	Low	77 Å²	77	97.7 Å²	97.7	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-71.2	-26.8	-177.1	-165.5	30.5	0	0	0	112.1	A740 R741 K748	A740-D744 WeakPolarHBondContact O-CB 3.24Å; R741-D744 PolarHBondContact O-N 2.92Å; D744-K748 WeakPolarHBondContact O-CD 3.38Å; D744-K748 VanDerWaalsContact O-CE 3.25Å; D744-K748 WeakPolarHBondContact O-CE 3.48Å; D744-K748 WeakPolarHBondContact O-CG 3.36Å; D744-K748 PolarHBondContact O-N 3.44Å; D744-K748 WeakPolarHBondContact OD1-CE 3.46Å; D744-K748 IonicContact OD1-NZ 3.78Å; D744-K748 PolarHBondContact OD1-NZ 3Å; D744-K748 IonicContact OD2-NZ 3.63Å; D744-K748 PolarHBondContact OD2-NZ 2.81Å
745	V	70.1	Confident	68.4	Low	90 Å²	90	97.4 Å²	97.4	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-73.9	-42.5	166.7	167.8	0	0	0	0	111.3	R741 D742 E743 I747 K748 A749	R741-V745 WeakPolarHBondContact O-CB 3.43Å; R741-V745 VanDerWaalsContact O-CG2 3.29Å; R741-V745 WeakPolarHBondContact O-CG2 3.47Å; R741-V745 PolarHBondContact O-N 3.37Å; D742-V745 PolarHBondContact O-N 2.97Å; E743-V745 VanDerWaalsContact C-N 3.31Å; E743-V745 PolarHBondContact O-N 3.06Å; V745-I747 PolarHBondContact O-N 3.34Å; V745-K748 PolarHBondContact O-N 3.09Å; V745-A749 WeakPolarHBondContact O-CB 3.45Å; V745-A749 PolarHBondContact O-N 3.23Å
746	A	69.9	Low	69.3	Low	57 Å²	57	97 Å²	97	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-62.4	-42.4	177.8	0	0	0	0	0	112.1	D742 E743 K748 A749 E750	D742-A746 VanDerWaalsContact O-CB 3.28Å; D742-A746 WeakPolarHBondContact O-CB 3.34Å; D742-A746 PolarHBondContact O-N 2.76Å; E743-A746 PolarHBondContact O-N 2.91Å; E743-A746 VanDerWaalsContact O-N 3.15Å; A746-K748 VanDerWaalsContact C-N 3.34Å; A746-K748 PolarHBondContact O-N 3.23Å; A746-A749 PolarHBondContact O-N 3.42Å; A746-E750 WeakPolarHBondContact O-CB 2.76Å; A746-E750 PolarHBondContact O-N 3.37Å
747	I	78.4	Confident	70.5	Confident	109 Å²	109	91.2 Å²	91.2	56%	0.559	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-42.1	174.7	-68.9	163.8	0	0	0	110.8	E743 V745 E750 H751	E743-I747 VanDerWaalsContact O-CG1 3.3Å; E743-I747 WeakPolarHBondContact O-CG1 3.47Å; E743-I747 PolarHBondContact O-N 3.27Å; V745-I747 PolarHBondContact O-N 3.34Å; I747-E750 PolarHBondContact O-N 3.1Å; I747-H751 WeakPolarHBondContact O-CB 3.37Å; I747-H751 PolarHBondContact O-N 3.43Å
748	K	79.3	Confident	71.8	Confident	116 Å²	116	94.2 Å²	94.2	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-36.7	178.2	-71.1	163.9	-157.3	162.2	0	112.2	D744 V745 A746 A752	D744-K748 WeakPolarHBondContact O-CD 3.38Å; D744-K748 VanDerWaalsContact O-CE 3.25Å; D744-K748 WeakPolarHBondContact O-CE 3.48Å; D744-K748 WeakPolarHBondContact O-CG 3.36Å; D744-K748 PolarHBondContact O-N 3.44Å; D744-K748 WeakPolarHBondContact OD1-CE 3.46Å; D744-K748 IonicContact OD1-NZ 3.78Å; D744-K748 PolarHBondContact OD1-NZ 3Å; D744-K748 IonicContact OD2-NZ 3.63Å; D744-K748 PolarHBondContact OD2-NZ 2.81Å; V745-K748 PolarHBondContact O-N 3.09Å; A746-K748 VanDerWaalsContact C-N 3.34Å; A746-K748 PolarHBondContact O-N 3.23Å; K748-A752 VanDerWaalsContact O-CB 3.29Å; K748-A752 WeakPolarHBondContact O-CB 3.48Å; K748-A752 PolarHBondContact O-N 2.68Å
749	A	79.7	Confident	72.2	Confident	50 Å²	50	98.1 Å²	98.1	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-45.7	172.8	0	0	0	0	0	111.3	V745 A746 H751 A752 S753	V745-A749 WeakPolarHBondContact O-CB 3.45Å; V745-A749 PolarHBondContact O-N 3.23Å; A746-A749 PolarHBondContact O-N 3.42Å; A749-H751 PolarHBondContact O-N 3.22Å; A749-A752 CarbonylContact O-C 3.5Å; A749-A752 WeakPolarHBondContact O-CB 3.32Å; A749-A752 PolarHBondContact O-N 3.47Å; A749-A752 VanDerWaalsContact O-N 3.13Å; A749-S753 PolarHBondContact O-N 3.3Å; A749-S753 PolarHBondContact O-OG 2.91Å; A749-S753 VanDerWaalsContact O-OG 3.11Å
750	E	75.9	Confident	73.4	Confident	103 Å²	103	96.3 Å²	96.3	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-66.2	-38.3	178.7	-161.6	-122.5	-170.6	0	0	111.8	A746 I747 S753 K754	A746-E750 WeakPolarHBondContact O-CB 2.76Å; A746-E750 PolarHBondContact O-N 3.37Å; I747-E750 PolarHBondContact O-N 3.1Å; E750-S753 PolarHBondContact O-N 3Å; E750-K754 WeakPolarHBondContact O-CB 3.29Å; E750-K754 VanDerWaalsContact O-CG 3.3Å; E750-K754 WeakPolarHBondContact O-CG 3.43Å; E750-K754 PolarHBondContact O-N 3.34Å; E750-K754 WeakPolarHBondContact OE1-CE 3.43Å; E750-K754 IonicContact OE1-NZ 2.7Å; E750-K754 PolarHBondContact OE1-NZ 2.95Å; E750-K754 VanDerWaalsContact OE2-CE 3.31Å; E750-K754 WeakPolarHBondContact OE2-CE 3.49Å; E750-K754 IonicContact OE2-NZ 2.78Å; E750-K754 PolarHBondContact OE2-NZ 3.16Å
751	H	80.3	Confident	74.5	Confident	106 Å²	106	99 Å²	99	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-41	169.5	-179.2	-106.9	0	0	0	112.4	I747 A749 K754 M755	I747-H751 WeakPolarHBondContact O-CB 3.37Å; I747-H751 PolarHBondContact O-N 3.43Å; A749-H751 PolarHBondContact O-N 3.22Å; H751-K754 PolarHBondContact O-N 2.9Å; H751-M755 WeakPolarHBondContact O-CG 3.39Å; H751-M755 PolarHBondContact O-N 3.45Å
752	A	78.6	Confident	75.5	Confident	55 Å²	55	93.9 Å²	93.9	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-40.7	174.6	0	0	0	0	0	112	K748 A749 M755 A756	K748-A752 VanDerWaalsContact O-CB 3.29Å; K748-A752 WeakPolarHBondContact O-CB 3.48Å; K748-A752 PolarHBondContact O-N 2.68Å; A749-A752 CarbonylContact O-C 3.5Å; A749-A752 WeakPolarHBondContact O-CB 3.32Å; A749-A752 PolarHBondContact O-N 3.47Å; A749-A752 VanDerWaalsContact O-N 3.13Å; A752-M755 PolarHBondContact O-N 3.15Å; A752-A756 WeakPolarHBondContact O-CB 3.48Å; A752-A756 PolarHBondContact O-N 2.97Å
753	S	79.4	Confident	76.4	Confident	78 Å²	78	94.4 Å²	94.4	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-41.4	173.4	-58.6	0	0	0	0	112.2	A749 E750 M755 A756 A757	A749-S753 PolarHBondContact O-N 3.3Å; A749-S753 PolarHBondContact O-OG 2.91Å; A749-S753 VanDerWaalsContact O-OG 3.11Å; E750-S753 PolarHBondContact O-N 3Å; S753-M755 VanDerWaalsContact C-N 3.31Å; S753-M755 PolarHBondContact O-N 3.3Å; S753-A756 PolarHBondContact O-N 3.23Å; S753-A757 WeakPolarHBondContact O-CB 3.46Å; S753-A757 PolarHBondContact O-N 3.32Å
754	K	80.6	Confident	77	Confident	117 Å²	117	92.3 Å²	92.3	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-38.4	173	-77	168.2	176.8	168.9	0	111.9	E750 H751 K758	E750-K754 WeakPolarHBondContact O-CB 3.29Å; E750-K754 VanDerWaalsContact O-CG 3.3Å; E750-K754 WeakPolarHBondContact O-CG 3.43Å; E750-K754 PolarHBondContact O-N 3.34Å; E750-K754 WeakPolarHBondContact OE1-CE 3.43Å; E750-K754 IonicContact OE1-NZ 2.7Å; E750-K754 PolarHBondContact OE1-NZ 2.95Å; E750-K754 VanDerWaalsContact OE2-CE 3.31Å; E750-K754 WeakPolarHBondContact OE2-CE 3.49Å; E750-K754 IonicContact OE2-NZ 2.78Å; E750-K754 PolarHBondContact OE2-NZ 3.16Å; H751-K754 PolarHBondContact O-N 2.9Å; K754-K758 WeakPolarHBondContact O-CB 3.38Å; K754-K758 PolarHBondContact O-N 2.7Å
755	M	77.4	Confident	77.4	Confident	77 Å²	77	96 Å²	96	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-47.5	171.8	-74.4	-67.2	-171.4	0	0	111.8	H751 A752 S753 A757 K758 W759	H751-M755 WeakPolarHBondContact O-CG 3.39Å; H751-M755 PolarHBondContact O-N 3.45Å; A752-M755 PolarHBondContact O-N 3.15Å; S753-M755 VanDerWaalsContact C-N 3.31Å; S753-M755 PolarHBondContact O-N 3.3Å; M755-A757 PolarHBondContact O-N 3.35Å; M755-K758 CarbonylContact O-C 3.59Å; M755-K758 WeakPolarHBondContact O-CA 3.36Å; M755-K758 WeakPolarHBondContact O-CB 3.47Å; M755-K758 PolarHBondContact O-N 3.1Å; M755-W759 PolarHBondContact O-N 3.19Å
756	A	75.8	Confident	77.7	Confident	57 Å²	57	96.6 Å²	96.6	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-57.6	-47.7	179	0	0	0	0	0	111.8	A752 S753 K758 W759 E760	A752-A756 WeakPolarHBondContact O-CB 3.48Å; A752-A756 PolarHBondContact O-N 2.97Å; S753-A756 PolarHBondContact O-N 3.23Å; A756-K758 PolarHBondContact O-N 3.3Å; A756-W759 PolarHBondContact O-N 3.2Å; A756-E760 WeakPolarHBondContact O-CB 3.42Å; A756-E760 PolarHBondContact O-N 3.23Å
757	A	78.1	Confident	77.9	Confident	42 Å²	42	96.6 Å²	96.6	35%	0.347	49%	0.492	S	S	.	.	H	α-helix	trans	-64.8	-24.4	175.5	0	0	0	0	0	113.4	S753 M755 K761	S753-A757 WeakPolarHBondContact O-CB 3.46Å; S753-A757 PolarHBondContact O-N 3.32Å; M755-A757 PolarHBondContact O-N 3.35Å; A757-K761 WeakPolarHBondContact O-CB 3.34Å; A757-K761 WeakPolarHBondContact O-CD 3.05Å; A757-K761 WeakPolarHBondContact O-CG 3.44Å; A757-K761 PolarHBondContact O-N 2.68Å
758	K	81.8	Confident	77.6	Confident	127 Å²	127	98 Å²	98	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-77.5	-42.6	172.5	-175.6	-176.1	176.3	-171.7	0	111.4	K754 M755 A756 K761 I762	K754-K758 WeakPolarHBondContact O-CB 3.38Å; K754-K758 PolarHBondContact O-N 2.7Å; M755-K758 CarbonylContact O-C 3.59Å; M755-K758 WeakPolarHBondContact O-CA 3.36Å; M755-K758 WeakPolarHBondContact O-CB 3.47Å; M755-K758 PolarHBondContact O-N 3.1Å; A756-K758 PolarHBondContact O-N 3.3Å; K758-K761 PolarHBondContact O-N 3.34Å; K758-I762 WeakPolarHBondContact O-CG1 3.42Å; K758-I762 PolarHBondContact O-N 2.85Å
759	W	67.7	Low	77.3	Confident	169 Å²	169	100.5 Å²	100.5	64%	0.64	51%	0.505	S	S	*	.	H	α-helix	trans	-63.5	-41.9	173.1	-80.6	104.5	0	0	0	111.9	M755 A756 K761 I762 Q763	M755-W759 PolarHBondContact O-N 3.19Å; A756-W759 PolarHBondContact O-N 3.2Å; W759-K761 PolarHBondContact O-N 3.14Å; W759-I762 WeakPolarHBondContact O-CA 3.22Å; W759-I762 WeakPolarHBondContact O-CB 3.44Å; W759-I762 PolarHBondContact O-N 3.09Å; W759-Q763 PolarHBondContact O-N 3.35Å
760	E	81	Confident	76.7	Confident	113 Å²	113	101 Å²	101	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-41.4	174.8	-161.1	-165	159.7	0	0	111.3	A756 I762 Q763 Q764	A756-E760 WeakPolarHBondContact O-CB 3.42Å; A756-E760 PolarHBondContact O-N 3.23Å; E760-I762 PolarHBondContact O-N 3.11Å; E760-Q763 PolarHBondContact O-N 2.72Å; E760-Q764 HydrophobicContact CG-CG 4.48Å; E760-Q764 WeakPolarHBondContact O-CB 3.48Å; E760-Q764 VanDerWaalsContact O-CG 3.28Å; E760-Q764 WeakPolarHBondContact O-CG 3.35Å; E760-Q764 PolarHBondContact O-N 3.11Å; E760-Q764 PolarHBondContact OE1-NE2 2.97Å
761	K	81.1	Confident	75.9	Confident	137 Å²	137	103.2 Å²	103.2	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-67.4	-18.4	172.9	-75.7	171	-176	173.1	0	114	A757 K758 W759 K765	A757-K761 WeakPolarHBondContact O-CB 3.34Å; A757-K761 WeakPolarHBondContact O-CD 3.05Å; A757-K761 WeakPolarHBondContact O-CG 3.44Å; A757-K761 PolarHBondContact O-N 2.68Å; K758-K761 PolarHBondContact O-N 3.34Å; W759-K761 PolarHBondContact O-N 3.14Å; K761-K765 WeakPolarHBondContact O-CD 3.18Å; K761-K765 VanDerWaalsContact O-CG 3.27Å; K761-K765 WeakPolarHBondContact O-CG 3.32Å
762	I	78.9	Confident	74.9	Confident	64 Å²	64	107.6 Å²	107.6	33%	0.328	54%	0.537	S	S	.	.	H	α-helix	trans	-80.1	-51.1	169	-69.7	162.5	0	0	0	109.1	K758 W759 E760 Q764 K765 E766	K758-I762 WeakPolarHBondContact O-CG1 3.42Å; K758-I762 PolarHBondContact O-N 2.85Å; W759-I762 WeakPolarHBondContact O-CA 3.22Å; W759-I762 WeakPolarHBondContact O-CB 3.44Å; W759-I762 PolarHBondContact O-N 3.09Å; E760-I762 PolarHBondContact O-N 3.11Å; I762-Q764 VanDerWaalsContact C-N 3.34Å; I762-Q764 PolarHBondContact O-N 3.39Å; I762-K765 CarbonylContact O-C 3.59Å; I762-K765 WeakPolarHBondContact O-CA 3.49Å; I762-K765 WeakPolarHBondContact O-CB 3.34Å; I762-K765 PolarHBondContact O-N 2.82Å; I762-E766 HydrophobicContact CG2-CG 4.31Å; I762-E766 PolarHBondContact O-N 3.38Å
763	Q	78.2	Confident	73.7	Confident	104 Å²	104	107.9 Å²	107.9	49%	0.486	55%	0.545	S	S	.	.	H	α-helix	trans	-58.1	-40.6	177	-76	-70.8	-54.8	0	0	113	W759 E760 K765 E766 A767	W759-Q763 PolarHBondContact O-N 3.35Å; E760-Q763 PolarHBondContact O-N 2.72Å; Q763-K765 VanDerWaalsContact C-N 3.27Å; Q763-K765 PolarHBondContact O-N 3.49Å; Q763-E766 PolarHBondContact NE2-OE2 2.85Å; Q763-E766 PolarHBondContact O-N 2.95Å; Q763-A767 VanDerWaalsContact O-CB 3.25Å; Q763-A767 WeakPolarHBondContact O-CB 3.48Å; Q763-A767 PolarHBondContact O-N 3.01Å
764	Q	75.2	Confident	72.2	Confident	90 Å²	90	112.5 Å²	112.5	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-65.6	-27	173.1	-70.6	178.3	15.1	0	0	112.8	E760 I762 K768	E760-Q764 HydrophobicContact CG-CG 4.48Å; E760-Q764 WeakPolarHBondContact O-CB 3.48Å; E760-Q764 VanDerWaalsContact O-CG 3.28Å; E760-Q764 WeakPolarHBondContact O-CG 3.35Å; E760-Q764 PolarHBondContact O-N 3.11Å; E760-Q764 PolarHBondContact OE1-NE2 2.97Å; I762-Q764 VanDerWaalsContact C-N 3.34Å; I762-Q764 PolarHBondContact O-N 3.39Å; Q764-K768 WeakPolarHBondContact O-CB 3.47Å; Q764-K768 WeakPolarHBondContact O-CD 3.49Å; Q764-K768 WeakPolarHBondContact O-CG 3.28Å; Q764-K768 PolarHBondContact O-N 3.47Å
765	K	77.8	Confident	70.2	Confident	156 Å²	156	115 Å²	115	68%	0.678	57%	0.572	S	S	*	*	H	α-helix	trans	-80.2	-37.1	172.8	-76.3	176	179.6	-174.8	0	111.9	K761 I762 Q763 K769	K761-K765 WeakPolarHBondContact O-CD 3.18Å; K761-K765 VanDerWaalsContact O-CG 3.27Å; K761-K765 WeakPolarHBondContact O-CG 3.32Å; I762-K765 CarbonylContact O-C 3.59Å; I762-K765 WeakPolarHBondContact O-CA 3.49Å; I762-K765 WeakPolarHBondContact O-CB 3.34Å; I762-K765 PolarHBondContact O-N 2.82Å; Q763-K765 VanDerWaalsContact C-N 3.27Å; Q763-K765 PolarHBondContact O-N 3.49Å; K765-K769 VanDerWaalsContact O-CB 3.32Å; K765-K769 WeakPolarHBondContact O-CB 3.28Å; K765-K769 PolarHBondContact O-N 2.85Å
766	E	77	Confident	68.7	Low	102 Å²	102	117 Å²	117	48%	0.477	59%	0.59	S	S	.	*	H	α-helix	trans	-70.5	-42.7	176.5	-69	-178.1	135.3	0	0	111.3	I762 Q763 K768 K769 A770	I762-E766 HydrophobicContact CG2-CG 4.31Å; I762-E766 PolarHBondContact O-N 3.38Å; Q763-E766 PolarHBondContact NE2-OE2 2.85Å; Q763-E766 PolarHBondContact O-N 2.95Å; E766-K768 PolarHBondContact O-N 3.4Å; E766-K769 CarbonylContact O-C 3.59Å; E766-K769 WeakPolarHBondContact O-CA 3.47Å; E766-K769 WeakPolarHBondContact O-CB 3.33Å; E766-K769 PolarHBondContact O-N 3.15Å; E766-K769 VanDerWaalsContact O-N 3.07Å; E766-A770 WeakPolarHBondContact O-CB 3.43Å; E766-A770 PolarHBondContact O-N 3.47Å
767	A	72.7	Confident	67.4	Low	57 Å²	57	123.4 Å²	123.4	47%	0.471	61%	0.61	S	S	.	*	H	α-helix	trans	-58.2	-46.5	170.6	0	0	0	0	0	111.8	Q763 K769 A770 E771	Q763-A767 VanDerWaalsContact O-CB 3.25Å; Q763-A767 WeakPolarHBondContact O-CB 3.48Å; Q763-A767 PolarHBondContact O-N 3.01Å; A767-K769 VanDerWaalsContact C-N 3.27Å; A767-K769 PolarHBondContact O-N 3.17Å; A767-A770 PolarHBondContact O-N 3.42Å; A767-E771 PolarHBondContact O-N 3.35Å
768	K	72.2	Confident	65.6	Low	139 Å²	139	131.1 Å²	131.1	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-65.4	-27.3	174.1	-75.7	174.8	-179.9	177.9	0	113.3	Q764 E766 K772	Q764-K768 WeakPolarHBondContact O-CB 3.47Å; Q764-K768 WeakPolarHBondContact O-CD 3.49Å; Q764-K768 WeakPolarHBondContact O-CG 3.28Å; Q764-K768 PolarHBondContact O-N 3.47Å; E766-K768 PolarHBondContact O-N 3.4Å; K768-K772 VanDerWaalsContact O-CB 3.28Å; K768-K772 WeakPolarHBondContact O-CB 3.4Å; K768-K772 PolarHBondContact O-N 2.92Å
769	K	74.3	Confident	63.7	Low	167 Å²	167	134.6 Å²	134.6	73%	0.726	65%	0.651	S	S	*	*	H	α-helix	trans	-76.6	-35.2	173.2	-167.8	-179.1	179	-171	0	111.4	K765 E766 A767 K772 G773	K765-K769 VanDerWaalsContact O-CB 3.32Å; K765-K769 WeakPolarHBondContact O-CB 3.28Å; K765-K769 PolarHBondContact O-N 2.85Å; E766-K769 CarbonylContact O-C 3.59Å; E766-K769 WeakPolarHBondContact O-CA 3.47Å; E766-K769 WeakPolarHBondContact O-CB 3.33Å; E766-K769 PolarHBondContact O-N 3.15Å; E766-K769 VanDerWaalsContact O-N 3.07Å; A767-K769 VanDerWaalsContact C-N 3.27Å; A767-K769 PolarHBondContact O-N 3.17Å; K769-K772 CarbonylContact O-C 3.58Å; K769-K772 PolarHBondContact O-N 3.35Å; K769-G773 PolarHBondContact O-N 2.81Å; K769-G773 VanDerWaalsContact O-N 3.09Å
770	A	65.7	Low	62.8	Low	62 Å²	62	133.9 Å²	133.9	51%	0.512	67%	0.666	S	S	.	*	H	α-helix	trans	-71.9	-42.9	176.1	0	0	0	0	0	112.3	E766 A767 K772 G773 K774	E766-A770 WeakPolarHBondContact O-CB 3.43Å; E766-A770 PolarHBondContact O-N 3.47Å; A767-A770 PolarHBondContact O-N 3.42Å; A770-K772 VanDerWaalsContact C-N 3.3Å; A770-K772 PolarHBondContact O-N 3.38Å; A770-G773 CarbonylContact O-C 3.47Å; A770-G773 WeakPolarHBondContact O-CA 3.46Å; A770-G773 PolarHBondContact O-N 3.35Å; A770-K774 PolarHBondContact O-N 2.95Å; A770-K774 VanDerWaalsContact O-N 3.1Å
771	E	59.9	Low	60.9	Low	149 Å²	149	131.3 Å²	131.3	70%	0.696	67%	0.669	S	S	*	*	H	α-helix	trans	-57.8	-44.6	169.2	-77.8	-160.9	120.3	0	0	111.2	A767 G773 K774	A767-E771 PolarHBondContact O-N 3.35Å; E771-G773 PolarHBondContact O-N 3.28Å; E771-G773 VanDerWaalsContact O-N 3.15Å; E771-K774 PolarHBondContact O-N 3.18Å; E771-K774 VanDerWaalsContact O-N 3.08Å
772	K	59.2	Low	59.3	Low	197 Å²	197	133.6 Å²	133.6	86%	0.857	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-7.4	176.9	-152.7	169.3	-170.6	176.6	0	113.9	K768 K769 A770	K768-K772 VanDerWaalsContact O-CB 3.28Å; K768-K772 WeakPolarHBondContact O-CB 3.4Å; K768-K772 PolarHBondContact O-N 2.92Å; K769-K772 CarbonylContact O-C 3.58Å; K769-K772 PolarHBondContact O-N 3.35Å; A770-K772 VanDerWaalsContact C-N 3.3Å; A770-K772 PolarHBondContact O-N 3.38Å
773	G	52.5	Low	57.5	Low	61 Å²	61	133.8 Å²	133.8	63%	0.629	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-13.6	171	0	0	0	0	0	114.4	K769 A770 E771 M775	K769-G773 PolarHBondContact O-N 2.81Å; K769-G773 VanDerWaalsContact O-N 3.09Å; A770-G773 CarbonylContact O-C 3.47Å; A770-G773 WeakPolarHBondContact O-CA 3.46Å; A770-G773 PolarHBondContact O-N 3.35Å; E771-G773 PolarHBondContact O-N 3.28Å; E771-G773 VanDerWaalsContact O-N 3.15Å; G773-M775 PolarHBondContact O-N 3.49Å
774	K	48.2	Very low	56	Low	175 Å²	175	140 Å²	140	76%	0.761	73%	0.725	S	S	*	*			trans	-77.8	112.7	175.5	-78.6	-168.4	172.7	-171.5	0	110.5	A770 E771	A770-K774 PolarHBondContact O-N 2.95Å; A770-K774 VanDerWaalsContact O-N 3.1Å; E771-K774 PolarHBondContact O-N 3.18Å; E771-K774 VanDerWaalsContact O-N 3.08Å
775	M	39.7	Very low	54.2	Low	171 Å²	171	145.2 Å²	145.2	84%	0.842	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.2	137.7	162.7	-71.6	-179.6	62.2	0	0	109.7	G773	G773-M775 PolarHBondContact O-N 3.49Å
776	P	46.6	Very low	52.9	Low	119 Å²	119	143 Å²	143	77%	0.773	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-69.5	134.3	177.8	28.2	-34.1	0	0	0	110.9	K778	P776-K778 PolarHBondContact O-N 2.79Å
777	E	47.5	Very low	51.8	Low	191 Å²	191	144.9 Å²	144.9	89%	0.893	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-63.4	130.2	178.6	-64	-179.7	126.8	0	0	111.4	K779	E777-K779 PolarHBondContact O-N 3.04Å
778	K	39.6	Very low	51.5	Low	203 Å²	203	147.3 Å²	147.3	88%	0.883	77%	0.773	S	S	*	*			trans	-73.5	91.7	176.2	-75.2	-178.1	177.9	174.2	0	110.8	P776 T780	P776-K778 PolarHBondContact O-N 2.79Å; K778-T780 PolarHBondContact O-N 3.42Å
779	K	43.1	Very low	51.3	Low	201 Å²	201	145.8 Å²	145.8	87%	0.874	78%	0.778	S	S	*	*			trans	-58.7	127.7	152.5	-78.4	-173.4	175.8	178.9	0	108.7	E777 G781	E777-K779 PolarHBondContact O-N 3.04Å; K779-G781 VanDerWaalsContact C-N 3.32Å; K779-G781 PolarHBondContact O-N 2.7Å
780	T	47.5	Very low	51.2	Low	154 Å²	154	140.9 Å²	140.9	95%	0.945	76%	0.762	S	S	*	*	S	Bend	trans	-75	77.7	-176.2	35.2	0	0	0	0	111.7	K778	K778-T780 PolarHBondContact O-N 3.42Å
781	G	42.3	Very low	52.2	Low	59 Å²	59	142.4 Å²	142.4	61%	0.608	76%	0.762	S	S	*	*			trans	-134	131.8	171	0	0	0	0	0	111.2	K779 G783	K779-G781 VanDerWaalsContact C-N 3.32Å; K779-G781 PolarHBondContact O-N 2.7Å; G781-G783 PolarHBondContact O-N 2.97Å
782	N	47.3	Very low	53.5	Low	184 Å²	184	141.5 Å²	141.5	98%	0.984	76%	0.756	S	S	*	*			trans	-74.8	66.2	-179.2	-81.6	-11.1	0	0	0	112.5
783	G	41.7	Very low	55	Low	69 Å²	69	132.2 Å²	132.2	71%	0.711	72%	0.715	S	S	*	*			trans	-93.4	107.3	169.4	0	0	0	0	0	111.2	G781 F785	G781-G783 PolarHBondContact O-N 2.97Å; G783-F785 PolarHBondContact O-N 3.3Å
784	R	45	Very low	56.7	Low	235 Å²	235	131.6 Å²	131.6	89%	0.887	70%	0.702	S	S	*	*			trans	-66.8	122.3	165.6	-77	-175.6	172.9	-171.6	-2	108.4	C786	R784-C786 VanDerWaalsContact C-N 3.29Å; R784-C786 PolarHBondContact O-N 3.21Å
785	F	38	Very low	58.5	Low	199 Å²	199	126.2 Å²	126.2	87%	0.873	68%	0.681	S	S	*	*			trans	-75.2	82.6	178.4	-159.6	-87.2	0	0	0	110.1	G783 L787	G783-F785 PolarHBondContact O-N 3.3Å; F785-L787 PolarHBondContact O-N 2.97Å
786	C	51.6	Low	60.8	Low	108 Å²	108	119.9 Å²	119.9	73%	0.73	65%	0.653	S	S	*	*			trans	-75	115.4	174	-66.8	0	0	0	0	109.5	R784	R784-C786 VanDerWaalsContact C-N 3.29Å; R784-C786 PolarHBondContact O-N 3.21Å
787	L	54.2	Low	62.7	Low	143 Å²	143	119.3 Å²	119.3	75%	0.749	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-53.3	145.6	158.6	-73.9	159.9	0	0	0	109.1	F785	F785-L787 PolarHBondContact O-N 2.97Å
788	P	65.3	Low	64.6	Low	107 Å²	107	117.3 Å²	117.3	70%	0.695	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-55.6	138	171.1	25.2	-33.5	0	0	0	109
789	P	67.6	Low	67	Low	108 Å²	108	110.5 Å²	110.5	70%	0.701	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-60.6	131.3	-178.5	25.7	-33.5	0	0	0	109.1
790	P	73	Confident	69.1	Low	63 Å²	63	101.4 Å²	101.4	41%	0.409	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-61.7	141.5	-178.1	25.5	-34.9	0	0	0	110.8	N799	P790-N799 HydrophobicContact CB-CB 4.21Å; P790-N799 HydrophobicContact CG-CB 4.14Å; P790-N799 VanDerWaalsContact CG-ND2 3.33Å; P790-N799 WeakPolarHBondContact CG-ND2 3.43Å
791	D	85.7	Confident	70.9	Confident	94 Å²	94	101 Å²	101	50%	0.503	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-52.7	143.2	-179.9	-71.2	-51.4	0	0	0	111.9	N799 V800 L812	D791-N799 CarbonylContact O-C 3.56Å; D791-N799 VanDerWaalsContact O-CA 3.28Å; D791-N799 WeakPolarHBondContact O-CA 3.46Å; D791-V800 PolarHBondContact O-N 3.43Å; D791-L812 HydrophobicContact CB-CD1 3.57Å
792	K	88.8	Confident	72.8	Confident	131 Å²	131	103.8 Å²	103.8	57%	0.57	55%	0.545	S	S	*	.	B	Isolated β-bridge	trans	-115	139.2	-174.5	-64.3	-178.2	-177.3	178	0	111.6	S794	K792-S794 PolarHBondContact O-N 3.38Å
793	C	90.8	Very high	74.4	Confident	1 Å²	1	100 Å²	100	1%	0.007	54%	0.538	C	S	.	.			trans	-68.1	124.2	175	176	0	0	0	0	109.6	L795 C796 T797 K798 V800 L812 H814	C793-L795 PolarHBondContact O-N 3.08Å; C793-L795 VanDerWaalsContact O-N 3.11Å; C793-C796 VanDerWaalsContact CB-SG 3.55Å; C793-C796 VanDerWaalsContact SG-SG 3.64Å; C793-T797 WeakPolarHBondContact O-CA 3.37Å; C793-T797 PolarHBondContact O-N 3.36Å; C793-K798 PolarHBondContact N-O 3.34Å; C793-V800 HydrophobicContact CB-CG2 3.53Å; C793-V800 VanDerWaalsContact N-CG2 3.35Å; C793-L812 WeakPolarHBondContact CA-O 3.47Å; C793-H814 WeakPolarHBondContact CB-CE1 3.45Å; C793-H814 WeakPolarHBondContact CB-ND1 3.28Å; C793-H814 PolarHBondContact SG-ND1 3.48Å
794	S	87.2	Confident	76.4	Confident	49 Å²	49	100.6 Å²	100.6	34%	0.343	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-10.6	-178.6	54.9	0	0	0	0	114.8	K792 L812 Y813	K792-S794 PolarHBondContact O-N 3.38Å; S794-L812 PolarHBondContact N-O 2.92Å; S794-L812 PolarHBondContact OG-O 2.68Å; S794-L812 VanDerWaalsContact OG-O 3.08Å; S794-Y813 WeakPolarHBondContact OG-CD1 3.33Å; S794-Y813 WeakPolarHBondContact OG-CE1 3.4Å; S794-Y813 VanDerWaalsContact OG-CZ 3.28Å
795	L	86.5	Confident	78.3	Confident	61 Å²	61	92.7 Å²	92.7	32%	0.319	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-49.4	174.2	-65.4	174.3	0	0	0	113.5	C793 Y813 C817 L841	C793-L795 PolarHBondContact O-N 3.08Å; C793-L795 VanDerWaalsContact O-N 3.11Å; L795-Y813 HydrophobicContact CD1-CD1 3.74Å; L795-Y813 HydrophobicContact CD1-CE1 3.94Å; L795-Y813 HydrophobicContact CD2-CE1 4.5Å; L795-Y813 HydrophobicContact CG-CD1 3.84Å; L795-Y813 HydrophobicContact CG-CE1 3.82Å; L795-C817 HydrophobicContact CD1-CB 4.38Å; L795-C817 VanDerWaalsContact CD1-O 3.23Å; L795-C817 WeakPolarHBondContact CD1-O 3.05Å; L795-L841 HydrophobicContact CD1-CD1 3.84Å; L795-L841 HydrophobicContact CD1-CG 4.15Å
796	C	87.9	Confident	80.6	Confident	38 Å²	38	85.8 Å²	85.8	26%	0.257	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-3.5	-174.1	79	0	0	0	0	114	C793 K798 H814	C793-C796 VanDerWaalsContact CB-SG 3.55Å; C793-C796 VanDerWaalsContact SG-SG 3.64Å; C796-K798 PolarHBondContact O-N 2.9Å; C796-H814 PolarHBondContact SG-CE1 2.76Å; C796-H814 PolarHBondContact SG-ND1 3.28Å
797	T	85.6	Confident	82.4	Confident	107 Å²	107	87 Å²	87	66%	0.656	46%	0.461	S	S	*	.			trans	59.6	-5.8	-177.2	71.2	0	0	0	0	117	C793	C793-T797 WeakPolarHBondContact O-CA 3.37Å; C793-T797 PolarHBondContact O-N 3.36Å
798	K	88.2	Confident	83.8	Confident	149 Å²	149	80.8 Å²	80.8	65%	0.648	43%	0.429	S	S	*	.	S	Bend	trans	-70.1	155.2	174.7	-58.7	177.7	-177.3	179.8	0	111.4	C793 C796	C793-K798 PolarHBondContact N-O 3.34Å; C796-K798 PolarHBondContact O-N 2.9Å
799	N	90.8	Very high	84.7	Confident	61 Å²	61	80.3 Å²	80.3	33%	0.326	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-57.6	135.4	174.5	-54.4	-5.4	0	0	0	110.8	P790 D791 H814	P790-N799 HydrophobicContact CB-CB 4.21Å; P790-N799 HydrophobicContact CG-CB 4.14Å; P790-N799 VanDerWaalsContact CG-ND2 3.33Å; P790-N799 WeakPolarHBondContact CG-ND2 3.43Å; D791-N799 CarbonylContact O-C 3.56Å; D791-N799 VanDerWaalsContact O-CA 3.28Å; D791-N799 WeakPolarHBondContact O-CA 3.46Å; N799-H814 PolarHBondContact O-CE1 3.47Å; N799-H814 PolarHBondContact O-NE2 3.03Å
800	V	87	Confident	85.6	Confident	9 Å²	9	78.3 Å²	78.3	6%	0.055	42%	0.415	C	S	.	.			trans	-102.6	113.9	176.2	177.1	0	0	0	0	107.8	D791 C793 Q805	D791-V800 PolarHBondContact O-N 3.43Å; C793-V800 HydrophobicContact CB-CG2 3.53Å; C793-V800 VanDerWaalsContact N-CG2 3.35Å; V800-Q805 VanDerWaalsContact CG1-CA 3.4Å; V800-Q805 HydrophobicContact CG1-CB 3.54Å
801	Y	84.8	Confident	86.3	Confident	145 Å²	145	78 Å²	78	57%	0.569	41%	0.41	S	S	*	.			trans	-81	152.6	174.8	-62.6	-74.2	0	0	0	110.7	A803 E804 Q805	Y801-A803 PolarHBondContact O-N 2.73Å; Y801-E804 CarbonylContact O-C 3.54Å; Y801-E804 WeakPolarHBondContact O-CA 3.28Å; Y801-E804 PolarHBondContact O-N 3.37Å; Y801-Q805 PolarHBondContact O-N 3.3Å
802	R	81.4	Confident	86.5	Confident	119 Å²	119	75 Å²	75	45%	0.449	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.5	-173.7	-173.1	154	-179	72.8	-4.9	115.4	E153	E153-R802 WeakPolarHBondContact OE1-CD 3.38Å; E153-R802 IonicContact OE1-CZ 3.37Å; E153-R802 IonicContact OE1-NE 2.67Å; E153-R802 PolarHBondContact OE1-NE 3.49Å; E153-R802 IonicContact OE1-NH2 2.6Å; E153-R802 IonicContact OE2-CZ 3.42Å; E153-R802 VanDerWaalsContact OE2-CZ 3.23Å; E153-R802 IonicContact OE2-NE 2.68Å; E153-R802 PolarHBondContact OE2-NE 3.49Å; E153-R802 IonicContact OE2-NH2 2.66Å; E153-R802 PolarHBondContact OE2-NH2 3.36Å
803	A	81.9	Confident	86.6	Confident	103 Å²	103	68.8 Å²	68.8	85%	0.851	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-20.9	171.6	0	0	0	0	0	113.9	Y801	Y801-A803 PolarHBondContact O-N 2.73Å
804	E	83.6	Confident	86.6	Confident	82 Å²	82	69.5 Å²	69.5	38%	0.383	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-0.3	-179.8	-58.5	-173.1	140.7	0	0	112.6	Y801 H814 V815	Y801-E804 CarbonylContact O-C 3.54Å; Y801-E804 WeakPolarHBondContact O-CA 3.28Å; Y801-E804 PolarHBondContact O-N 3.37Å; E804-H814 CarbonylContact O-C 3.56Å; E804-H814 WeakPolarHBondContact O-CA 3.17Å; E804-H814 IonicContact OE2-CD2 2.87Å; E804-H814 PolarHBondContact OE2-CD2 2.92Å; E804-H814 VanDerWaalsContact OE2-CD2 3.28Å; E804-H814 IonicContact OE2-NE2 3.88Å; E804-V815 PolarHBondContact O-N 3.24Å
805	Q	85.6	Confident	86.6	Confident	70 Å²	70	71.1 Å²	71.1	33%	0.327	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	128.8	-172.9	77.3	175.2	68.9	0	0	112.7	V800 Y801	V800-Q805 VanDerWaalsContact CG1-CA 3.4Å; V800-Q805 HydrophobicContact CG1-CB 3.54Å; Y801-Q805 PolarHBondContact O-N 3.3Å
806	F	86	Confident	86.7	Confident	53 Å²	53	73.3 Å²	73.3	23%	0.232	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.9	174.4	-170.9	-91.8	0	0	0	108.9	C808 Y813 V815 F818 V829	F806-C808 HydrophobicContact CD1-CB 4.39Å; F806-C808 HydrophobicContact CE1-CB 4.03Å; F806-Y813 PolarHBondContact N-O 2.95Å; F806-Y813 PolarHBondContact O-N 3.41Å; F806-V815 HydrophobicContact CB-CG2 4.1Å; F806-V815 HydrophobicContact CD2-CG2 4.46Å; F806-F818 HydrophobicContact CD1-CB 4.08Å; F806-F818 HydrophobicContact CD1-CD1 4.02Å; F806-F818 AromaticContact CD1-CD2 3.73Å; F806-F818 HydrophobicContact CD1-CD2 3.73Å; F806-F818 HydrophobicContact CD1-CE1 4.43Å; F806-F818 HydrophobicContact CD1-CE2 4.18Å; F806-F818 AromaticContact CD1-CG 3.66Å; F806-F818 HydrophobicContact CD1-CG 3.66Å; F806-F818 HydrophobicContact CE1-CB 4.31Å; F806-F818 AromaticContact CE1-CD1 3.38Å; F806-F818 HydrophobicContact CE1-CD1 3.38Å; F806-F818 AromaticContact CE1-CD2 3.67Å; F806-F818 HydrophobicContact CE1-CD2 3.67Å; F806-F818 AromaticContact CE1-CE1 3.46Å; F806-F818 HydrophobicContact CE1-CE1 3.46Å; F806-F818 VanDerWaalsContact CE1-CE1 3.46Å; F806-F818 AromaticContact CE1-CE2 3.76Å; F806-F818 HydrophobicContact CE1-CE2 3.76Å; F806-F818 AromaticContact CE1-CG 3.5Å; F806-F818 HydrophobicContact CE1-CG 3.5Å; F806-F818 VanDerWaalsContact CE1-CG 3.5Å; F806-F818 AromaticContact CE1-CZ 3.67Å; F806-F818 HydrophobicContact CE1-CZ 3.67Å; F806-F818 AromaticContact CZ-CD1 3.86Å; F806-F818 HydrophobicContact CZ-CD1 3.86Å; F806-F818 AromaticContact CZ-CE1 3.92Å; F806-F818 HydrophobicContact CZ-CE1 3.92Å; F806-F818 HydrophobicContact CZ-CG 4.35Å; F806-F818 HydrophobicContact CZ-CZ 4.46Å; F806-V829 HydrophobicContact CE1-CG2 4.24Å; F806-V829 HydrophobicContact CE2-CG2 4.33Å; F806-V829 HydrophobicContact CZ-CG2 3.53Å
807	Q	89.1	Confident	86.8	Confident	134 Å²	134	73.1 Å²	73.1	63%	0.626	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.5	-177.9	-162.7	178	14.4	0	0	110.6	L811 L812	Q807-L811 WeakPolarHBondContact CA-O 3.23Å; Q807-L812 HydrophobicContact CB-CD2 3.82Å; Q807-L812 HydrophobicContact CG-CD2 3.92Å
808	C	83.8	Confident	87.1	Confident	12 Å²	12	68.2 Å²	68.2	8%	0.081	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	147.3	177	-161.7	0	0	0	0	110.1	F806 G810 L811 Y813 F818	F806-C808 HydrophobicContact CD1-CB 4.39Å; F806-C808 HydrophobicContact CE1-CB 4.03Å; C808-G810 PolarHBondContact O-N 2.89Å; C808-G810 VanDerWaalsContact O-N 3.09Å; C808-L811 PolarHBondContact N-O 3.09Å; C808-L811 PolarHBondContact O-N 2.92Å; C808-L811 VanDerWaalsContact O-O 3.07Å; C808-Y813 HydrophobicContact CB-CD2 4.42Å; C808-Y813 HydrophobicContact CB-CE2 4.08Å; C808-Y813 WeakPolarHBondContact O-CE2 3.36Å; C808-F818 HydrophobicContact CB-CD2 4.47Å; C808-F818 HydrophobicContact CB-CE2 3.58Å; C808-F818 HydrophobicContact CB-CZ 3.88Å
809	F	84.6	Confident	87.2	Confident	98 Å²	98	65.8 Å²	65.8	43%	0.43	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	31.1	-176.6	-49.2	-72.2	0	0	0	114.3	L811 A832 R834 L841	F809-L811 PolarHBondContact O-N 2.84Å; F809-A832 HydrophobicContact CE2-CB 4.06Å; F809-A832 HydrophobicContact CZ-CB 4.08Å; F809-R834 HydrophobicContact CD1-CB 4.36Å; F809-R834 HydrophobicContact CD2-CB 3.81Å; F809-R834 HydrophobicContact CE1-CB 4.44Å; F809-R834 HydrophobicContact CE2-CB 3.9Å; F809-R834 HydrophobicContact CG-CB 4.06Å; F809-R834 HydrophobicContact CZ-CB 4.22Å; F809-L841 HydrophobicContact CD2-CD2 4.22Å; F809-L841 HydrophobicContact CE2-CD2 4Å
810	G	84.6	Confident	87.3	Confident	65 Å²	65	63 Å²	63	67%	0.67	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-3.6	-174.3	0	0	0	0	0	115.6	C808	C808-G810 PolarHBondContact O-N 2.89Å; C808-G810 VanDerWaalsContact O-N 3.09Å
811	L	88.4	Confident	87.4	Confident	57 Å²	57	66.3 Å²	66.3	30%	0.298	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	156.1	-176.6	-63.7	175	0	0	0	112.1	Q807 C808 F809 Y813 R834	Q807-L811 WeakPolarHBondContact CA-O 3.23Å; C808-L811 PolarHBondContact N-O 3.09Å; C808-L811 PolarHBondContact O-N 2.92Å; C808-L811 VanDerWaalsContact O-O 3.07Å; F809-L811 PolarHBondContact O-N 2.84Å; L811-Y813 HydrophobicContact CB-CE2 3.86Å; L811-Y813 WeakPolarHBondContact O-CD2 3.19Å; L811-Y813 WeakPolarHBondContact O-CE2 3.25Å; L811-R834 VanDerWaalsContact CD1-CZ 3.45Å
812	L	89.8	Confident	87.6	Confident	31 Å²	31	63.6 Å²	63.6	16%	0.162	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	145.1	174.8	-67.8	170.2	0	0	0	111.7	D791 C793 S794 Q807	D791-L812 HydrophobicContact CB-CD1 3.57Å; C793-L812 WeakPolarHBondContact CA-O 3.47Å; S794-L812 PolarHBondContact N-O 2.92Å; S794-L812 PolarHBondContact OG-O 2.68Å; S794-L812 VanDerWaalsContact OG-O 3.08Å; Q807-L812 HydrophobicContact CB-CD2 3.82Å; Q807-L812 HydrophobicContact CG-CD2 3.92Å
813	Y	91.6	Very high	88.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.9	179.1	-54.2	-96.4	0	0	0	108.8	S794 L795 F806 C808 L811 F818 L841	S794-Y813 WeakPolarHBondContact OG-CD1 3.33Å; S794-Y813 WeakPolarHBondContact OG-CE1 3.4Å; S794-Y813 VanDerWaalsContact OG-CZ 3.28Å; L795-Y813 HydrophobicContact CD1-CD1 3.74Å; L795-Y813 HydrophobicContact CD1-CE1 3.94Å; L795-Y813 HydrophobicContact CD2-CE1 4.5Å; L795-Y813 HydrophobicContact CG-CD1 3.84Å; L795-Y813 HydrophobicContact CG-CE1 3.82Å; F806-Y813 PolarHBondContact N-O 2.95Å; F806-Y813 PolarHBondContact O-N 3.41Å; C808-Y813 HydrophobicContact CB-CD2 4.42Å; C808-Y813 HydrophobicContact CB-CE2 4.08Å; C808-Y813 WeakPolarHBondContact O-CE2 3.36Å; L811-Y813 HydrophobicContact CB-CE2 3.86Å; L811-Y813 WeakPolarHBondContact O-CD2 3.19Å; L811-Y813 WeakPolarHBondContact O-CE2 3.25Å; Y813-F818 HydrophobicContact CD1-CD2 4.2Å; Y813-F818 AromaticContact CD2-CD2 3.96Å; Y813-F818 HydrophobicContact CD2-CD2 3.96Å; Y813-F818 HydrophobicContact CD2-CE2 4.31Å; Y813-F818 HydrophobicContact CE2-CD2 4.33Å; Y813-F818 HydrophobicContact CE2-CE2 4.29Å; Y813-F818 AromaticContact CG-CD2 3.91Å; Y813-F818 HydrophobicContact CG-CD2 3.91Å; Y813-L841 HydrophobicContact CD1-CD1 4.07Å; Y813-L841 HydrophobicContact CE1-CD1 3.74Å; Y813-L841 HydrophobicContact CE1-CD2 4.25Å; Y813-L841 HydrophobicContact CE1-CG 4.12Å
814	H	90.7	Very high	88.4	Confident	17 Å²	17	63.2 Å²	63.2	8%	0.079	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144.1	156	-56.2	91.8	0	0	0	109.2	C793 C796 N799 E804 N816 C817 F818	C793-H814 WeakPolarHBondContact CB-CE1 3.45Å; C793-H814 WeakPolarHBondContact CB-ND1 3.28Å; C793-H814 PolarHBondContact SG-ND1 3.48Å; C796-H814 PolarHBondContact SG-CE1 2.76Å; C796-H814 PolarHBondContact SG-ND1 3.28Å; N799-H814 PolarHBondContact O-CE1 3.47Å; N799-H814 PolarHBondContact O-NE2 3.03Å; E804-H814 CarbonylContact O-C 3.56Å; E804-H814 WeakPolarHBondContact O-CA 3.17Å; E804-H814 IonicContact OE2-CD2 2.87Å; E804-H814 PolarHBondContact OE2-CD2 2.92Å; E804-H814 VanDerWaalsContact OE2-CD2 3.28Å; E804-H814 IonicContact OE2-NE2 3.88Å; H814-N816 PolarHBondContact O-N 3.19Å; H814-N816 VanDerWaalsContact O-N 3.15Å; H814-C817 HydrophobicContact CB-CB 4.08Å; H814-C817 WeakPolarHBondContact O-CA 3.24Å; H814-C817 PolarHBondContact O-N 2.67Å; H814-F818 PolarHBondContact O-N 3.45Å
815	V	87.8	Confident	88.6	Confident	82 Å²	82	65.5 Å²	65.5	50%	0.497	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-48.3	-42	168.7	174.4	0	0	0	0	111.3	E804 F806 C817 F818	E804-V815 PolarHBondContact O-N 3.24Å; F806-V815 HydrophobicContact CB-CG2 4.1Å; F806-V815 HydrophobicContact CD2-CG2 4.46Å; V815-C817 VanDerWaalsContact C-N 3.32Å; V815-C817 PolarHBondContact O-N 2.73Å; V815-F818 PolarHBondContact O-N 2.63Å
816	N	87.9	Confident	88.8	Confident	108 Å²	108	64.9 Å²	64.9	58%	0.578	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-70.6	-20.8	177.6	-81.5	-39.8	0	0	0	115.1	H814 R819	H814-N816 PolarHBondContact O-N 3.19Å; H814-N816 VanDerWaalsContact O-N 3.15Å; N816-R819 VanDerWaalsContact O-CD 3.26Å; N816-R819 WeakPolarHBondContact O-CD 3.49Å; N816-R819 PolarHBondContact O-NE 3.01Å
817	C	89.1	Confident	88.9	Confident	34 Å²	34	63.3 Å²	63.3	23%	0.23	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-88.9	-17	176.3	-69.5	0	0	0	0	113.1	L795 H814 V815 R819	L795-C817 HydrophobicContact CD1-CB 4.38Å; L795-C817 VanDerWaalsContact CD1-O 3.23Å; L795-C817 WeakPolarHBondContact CD1-O 3.05Å; H814-C817 HydrophobicContact CB-CB 4.08Å; H814-C817 WeakPolarHBondContact O-CA 3.24Å; H814-C817 PolarHBondContact O-N 2.67Å; V815-C817 VanDerWaalsContact C-N 3.32Å; V815-C817 PolarHBondContact O-N 2.73Å; C817-R819 PolarHBondContact O-N 2.67Å
818	F	91.6	Very high	88.7	Confident	3 Å²	3	66 Å²	66	1%	0.013	35%	0.346	C	S	.	.			trans	-77.4	69.8	-176.7	-162.6	-102.3	0	0	0	112	F806 C808 Y813 H814 V815 L827 A832 L841	F806-F818 HydrophobicContact CD1-CB 4.08Å; F806-F818 HydrophobicContact CD1-CD1 4.02Å; F806-F818 AromaticContact CD1-CD2 3.73Å; F806-F818 HydrophobicContact CD1-CD2 3.73Å; F806-F818 HydrophobicContact CD1-CE1 4.43Å; F806-F818 HydrophobicContact CD1-CE2 4.18Å; F806-F818 AromaticContact CD1-CG 3.66Å; F806-F818 HydrophobicContact CD1-CG 3.66Å; F806-F818 HydrophobicContact CE1-CB 4.31Å; F806-F818 AromaticContact CE1-CD1 3.38Å; F806-F818 HydrophobicContact CE1-CD1 3.38Å; F806-F818 AromaticContact CE1-CD2 3.67Å; F806-F818 HydrophobicContact CE1-CD2 3.67Å; F806-F818 AromaticContact CE1-CE1 3.46Å; F806-F818 HydrophobicContact CE1-CE1 3.46Å; F806-F818 VanDerWaalsContact CE1-CE1 3.46Å; F806-F818 AromaticContact CE1-CE2 3.76Å; F806-F818 HydrophobicContact CE1-CE2 3.76Å; F806-F818 AromaticContact CE1-CG 3.5Å; F806-F818 HydrophobicContact CE1-CG 3.5Å; F806-F818 VanDerWaalsContact CE1-CG 3.5Å; F806-F818 AromaticContact CE1-CZ 3.67Å; F806-F818 HydrophobicContact CE1-CZ 3.67Å; F806-F818 AromaticContact CZ-CD1 3.86Å; F806-F818 HydrophobicContact CZ-CD1 3.86Å; F806-F818 AromaticContact CZ-CE1 3.92Å; F806-F818 HydrophobicContact CZ-CE1 3.92Å; F806-F818 HydrophobicContact CZ-CG 4.35Å; F806-F818 HydrophobicContact CZ-CZ 4.46Å; C808-F818 HydrophobicContact CB-CD2 4.47Å; C808-F818 HydrophobicContact CB-CE2 3.58Å; C808-F818 HydrophobicContact CB-CZ 3.88Å; Y813-F818 HydrophobicContact CD1-CD2 4.2Å; Y813-F818 AromaticContact CD2-CD2 3.96Å; Y813-F818 HydrophobicContact CD2-CD2 3.96Å; Y813-F818 HydrophobicContact CD2-CE2 4.31Å; Y813-F818 HydrophobicContact CE2-CD2 4.33Å; Y813-F818 HydrophobicContact CE2-CE2 4.29Å; Y813-F818 AromaticContact CG-CD2 3.91Å; Y813-F818 HydrophobicContact CG-CD2 3.91Å; H814-F818 PolarHBondContact O-N 3.45Å; V815-F818 PolarHBondContact O-N 2.63Å; F818-L827 HydrophobicContact CD1-CB 3.67Å; F818-L827 WeakPolarHBondContact CD1-O 3.5Å; F818-L827 HydrophobicContact CE1-CB 3.48Å; F818-L827 VanDerWaalsContact CE1-CB 3.48Å; F818-L827 HydrophobicContact CZ-CB 4.34Å; F818-L827 PolarHBondContact O-N 3.37Å; F818-A832 HydrophobicContact CE1-CB 3.89Å; F818-A832 HydrophobicContact CZ-CB 3.49Å; F818-A832 VanDerWaalsContact CZ-CB 3.49Å; F818-L841 HydrophobicContact CD2-CD1 3.32Å; F818-L841 HydrophobicContact CE2-CD1 3.48Å; F818-L841 VanDerWaalsContact CE2-CD1 3.48Å; F818-L841 HydrophobicContact CE2-CD2 4.3Å; F818-L841 HydrophobicContact CG-CD1 4.09Å; F818-L841 HydrophobicContact CZ-CD1 4.37Å
819	R	91.7	Very high	88.6	Confident	99 Å²	99	69.6 Å²	69.6	37%	0.374	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-131.1	151.5	-172.6	-67.9	173.1	-178.1	-84.4	-4.3	110.7	N816 C817 K824 Q825	N816-R819 VanDerWaalsContact O-CD 3.26Å; N816-R819 WeakPolarHBondContact O-CD 3.49Å; N816-R819 PolarHBondContact O-NE 3.01Å; C817-R819 PolarHBondContact O-N 2.67Å; R819-K824 WeakPolarHBondContact CD-O 3.49Å; R819-K824 PolarHBondContact NH1-O 3.35Å; R819-K824 VanDerWaalsContact NH1-O 3.09Å; R819-Q825 VanDerWaalsContact CA-O 3.25Å; R819-Q825 WeakPolarHBondContact CA-O 3.08Å
820	C	92.6	Very high	88.4	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.007	38%	0.383	C	S	.	.			trans	-66.1	135.3	169.3	-179.4	0	0	0	0	109.5	C823 K824 Q825 L827 L841 C843 H846	C820-C823 VanDerWaalsContact CB-SG 3.55Å; C820-C823 VanDerWaalsContact SG-SG 3.61Å; C820-K824 WeakPolarHBondContact O-CA 3.35Å; C820-K824 PolarHBondContact O-N 3.1Å; C820-Q825 PolarHBondContact N-O 3.21Å; C820-L827 HydrophobicContact CB-CD1 4.4Å; C820-L827 HydrophobicContact CB-CD2 4.14Å; C820-L827 HydrophobicContact CB-CG 4.37Å; C820-L841 CarbonylContact C-O 3.58Å; C820-L841 WeakPolarHBondContact CA-O 3.38Å; C820-C843 HydrophobicContact CB-CB 4.27Å; C820-C843 PolarHBondContact SG-N 2.92Å; C820-H846 PolarHBondContact SG-ND1 3.07Å
821	I	89.7	Confident	88.2	Confident	79 Å²	79	75.6 Å²	75.6	41%	0.405	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-48.2	176.7	-65.6	-163.4	0	0	0	111.2	D840 L841	I821-D840 HydrophobicContact CD1-CB 3.56Å; I821-D840 WeakPolarHBondContact CD1-OD1 3.49Å; I821-D840 HydrophobicContact CG1-CB 4.37Å; I821-L841 PolarHBondContact N-O 3.31Å
822	D	88.1	Confident	88.2	Confident	88 Å²	88	73.3 Å²	73.3	47%	0.471	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-45.1	-171.4	-55.4	-21.8	0	0	0	114.3	Y842 H846	D822-Y842 WeakPolarHBondContact OD2-CD1 3.12Å; D822-Y842 VanDerWaalsContact OD2-CE1 3.28Å; D822-Y842 WeakPolarHBondContact OD2-CE1 3.46Å; D822-H846 HydrophobicContact CB-CB 4.34Å; D822-H846 WeakPolarHBondContact OD2-CB 3.42Å; D822-H846 IonicContact OD2-CG 3.77Å
823	C	91.3	Very high	88.1	Confident	57 Å²	57	74.5 Å²	74.5	39%	0.385	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-5.4	177	52.9	0	0	0	0	115.9	C820 Q825	C820-C823 VanDerWaalsContact CB-SG 3.55Å; C820-C823 VanDerWaalsContact SG-SG 3.61Å; C823-Q825 PolarHBondContact O-N 3.45Å
824	K	88.6	Confident	87.9	Confident	157 Å²	157	78.6 Å²	78.6	68%	0.683	39%	0.387	S	S	*	.			trans	58.8	5.2	-177.4	-55.5	173.8	-174.9	173.3	0	115.2	R819 C820	R819-K824 WeakPolarHBondContact CD-O 3.49Å; R819-K824 PolarHBondContact NH1-O 3.35Å; R819-K824 VanDerWaalsContact NH1-O 3.09Å; C820-K824 WeakPolarHBondContact O-CA 3.35Å; C820-K824 PolarHBondContact O-N 3.1Å
825	Q	89	Confident	87.7	Confident	130 Å²	130	78.3 Å²	78.3	61%	0.607	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-65.1	137.3	176.9	-166.1	65	5.9	0	0	110.5	R819 C820 C823 L827	R819-Q825 VanDerWaalsContact CA-O 3.25Å; R819-Q825 WeakPolarHBondContact CA-O 3.08Å; C820-Q825 PolarHBondContact N-O 3.21Å; C823-Q825 PolarHBondContact O-N 3.45Å; Q825-L827 PolarHBondContact O-N 3.27Å
826	A	89.2	Confident	87.3	Confident	57 Å²	57	83.4 Å²	83.4	47%	0.471	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-60.4	128.9	172.1	0	0	0	0	0	110.2
827	L	88.3	Confident	86.9	Confident	20 Å²	20	85 Å²	85	11%	0.105	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-90.3	148.6	-178.9	-68.1	172.5	0	0	0	110.6	F818 C820 Q825 A832 L841 C843	F818-L827 HydrophobicContact CD1-CB 3.67Å; F818-L827 WeakPolarHBondContact CD1-O 3.5Å; F818-L827 HydrophobicContact CE1-CB 3.48Å; F818-L827 VanDerWaalsContact CE1-CB 3.48Å; F818-L827 HydrophobicContact CZ-CB 4.34Å; F818-L827 PolarHBondContact O-N 3.37Å; C820-L827 HydrophobicContact CB-CD1 4.4Å; C820-L827 HydrophobicContact CB-CD2 4.14Å; C820-L827 HydrophobicContact CB-CG 4.37Å; Q825-L827 PolarHBondContact O-N 3.27Å; L827-A832 HydrophobicContact CB-CB 4.06Å; L827-A832 HydrophobicContact CD1-CB 3.97Å; L827-A832 HydrophobicContact CG-CB 4.48Å; L827-L841 HydrophobicContact CD1-CB 3.84Å; L827-L841 HydrophobicContact CD1-CD1 4.44Å; L827-C843 HydrophobicContact CD2-CB 3.64Å
828	R	84.1	Confident	86.6	Confident	192 Å²	192	86.7 Å²	86.7	73%	0.725	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-101.2	146.4	165.2	-62.2	-173.2	-176.6	-174.1	1	108.3	E830 K831 A832	R828-E830 VanDerWaalsContact C-N 3.26Å; R828-E830 PolarHBondContact O-N 3.35Å; R828-E830 VanDerWaalsContact O-N 3.14Å; R828-K831 PolarHBondContact O-N 3.08Å; R828-A832 PolarHBondContact O-N 3.44Å
829	V	82.4	Confident	86.1	Confident	86 Å²	86	87 Å²	87	52%	0.521	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-44.2	-51	-176.1	-177.2	0	0	0	0	112	F806 K831	F806-V829 HydrophobicContact CE1-CG2 4.24Å; F806-V829 HydrophobicContact CE2-CG2 4.33Å; F806-V829 HydrophobicContact CZ-CG2 3.53Å; V829-K831 PolarHBondContact O-N 3.16Å; V829-K831 VanDerWaalsContact O-N 3.16Å
830	E	80.4	Confident	85.9	Confident	165 Å²	165	84.3 Å²	84.3	77%	0.771	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-62.4	-18.5	-177.5	-56.4	170.1	168.6	0	0	115.9	R828	R828-E830 VanDerWaalsContact C-N 3.26Å; R828-E830 PolarHBondContact O-N 3.35Å; R828-E830 VanDerWaalsContact O-N 3.14Å
831	K	80.4	Confident	85.9	Confident	125 Å²	125	84.3 Å²	84.3	54%	0.543	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-129.4	5	-169.2	-61	-179.3	-173.4	177.3	0	113.1	R828 V829 R844	R828-K831 PolarHBondContact O-N 3.08Å; V829-K831 PolarHBondContact O-N 3.16Å; V829-K831 VanDerWaalsContact O-N 3.16Å; K831-R844 PolarHBondContact O-N 2.92Å
832	A	87.1	Confident	85.9	Confident	8 Å²	8	81.7 Å²	81.7	7%	0.066	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	146	166.1	0	0	0	0	0	109.8	F809 F818 L827 R828	F809-A832 HydrophobicContact CE2-CB 4.06Å; F809-A832 HydrophobicContact CZ-CB 4.08Å; F818-A832 HydrophobicContact CE1-CB 3.89Å; F818-A832 HydrophobicContact CZ-CB 3.49Å; F818-A832 VanDerWaalsContact CZ-CB 3.49Å; L827-A832 HydrophobicContact CB-CB 4.06Å; L827-A832 HydrophobicContact CD1-CB 3.97Å; L827-A832 HydrophobicContact CG-CB 4.48Å; R828-A832 PolarHBondContact O-N 3.44Å
833	H	88	Confident	86.1	Confident	57 Å²	57	78.7 Å²	78.7	26%	0.264	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.3	166.2	-66.9	-110.7	0	0	0	108	Y842 F847	H833-Y842 PolarHBondContact N-O 3.32Å; H833-Y842 PolarHBondContact O-N 3.01Å; H833-F847 HydrophobicContact CB-CB 3.73Å; H833-F847 HydrophobicContact CB-CD1 3.74Å; H833-F847 HydrophobicContact CB-CD2 3.38Å; H833-F847 HydrophobicContact CB-CE1 4.17Å; H833-F847 HydrophobicContact CB-CE2 3.86Å; H833-F847 HydrophobicContact CB-CG 3.31Å; H833-F847 HydrophobicContact CB-CZ 4.23Å; H833-F847 AromaticContact CG-CD1 3.65Å; H833-F847 AromaticContact CG-CG 3.68Å; H833-F847 AromaticContact ND1-CD1 3.4Å; H833-F847 WeakPolarHBondContact ND1-CD1 3.43Å; H833-F847 AromaticContact ND1-CE1 3.63Å; H833-F847 AromaticContact ND1-CG 3.93Å
834	R	88.3	Confident	86	Confident	86 Å²	86	84.6 Å²	84.6	33%	0.325	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.2	177.2	-174.1	172.7	-177.5	-98.8	1.5	110.2	F809 L811 Q836 G839 D840 L841	F809-R834 HydrophobicContact CD1-CB 4.36Å; F809-R834 HydrophobicContact CD2-CB 3.81Å; F809-R834 HydrophobicContact CE1-CB 4.44Å; F809-R834 HydrophobicContact CE2-CB 3.9Å; F809-R834 HydrophobicContact CG-CB 4.06Å; F809-R834 HydrophobicContact CZ-CB 4.22Å; L811-R834 VanDerWaalsContact CD1-CZ 3.45Å; R834-Q836 PolarHBondContact O-N 3.23Å; R834-G839 WeakPolarHBondContact CG-O 3.35Å; R834-G839 PolarHBondContact NE-O 3.25Å; R834-D840 CarbonylContact C-O 3.56Å; R834-D840 VanDerWaalsContact CA-O 3.32Å; R834-D840 WeakPolarHBondContact CA-O 3.24Å; R834-L841 HydrophobicContact CB-CD2 4.02Å; R834-L841 HydrophobicContact CG-CD2 4.14Å
835	C	85.9	Confident	86.1	Confident	10 Å²	10	81.7 Å²	81.7	7%	0.068	40%	0.397	C	S	.	.			trans	-65.5	123.9	170.9	177.9	0	0	0	0	109.7	Q837 S838 G839 D840 Y842 M850	C835-Q837 VanDerWaalsContact C-N 3.25Å; C835-Q837 PolarHBondContact O-N 3.01Å; C835-S838 WeakPolarHBondContact CB-OG 3.38Å; C835-S838 PolarHBondContact SG-OG 2.97Å; C835-G839 WeakPolarHBondContact O-CA 3.26Å; C835-G839 PolarHBondContact O-N 3.37Å; C835-D840 HydrophobicContact CB-CB 4.46Å; C835-D840 PolarHBondContact N-O 2.97Å; C835-Y842 HydrophobicContact CB-CD2 4.34Å; C835-Y842 HydrophobicContact CB-CE2 3.88Å; C835-M850 HydrophobicContact CB-CE 4.18Å
836	Q	80.5	Confident	86.2	Confident	189 Å²	189	78 Å²	78	88%	0.883	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.2	-177.9	-168.7	176.2	5.5	0	0	113.1	R834	R834-Q836 PolarHBondContact O-N 3.23Å
837	Q	78.9	Confident	86.2	Confident	143 Å²	143	76.7 Å²	76.7	67%	0.668	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-48.8	-175.9	-69.8	-172.2	-37.7	0	0	113.7	C835	C835-Q837 VanDerWaalsContact C-N 3.25Å; C835-Q837 PolarHBondContact O-N 3.01Å
838	S	81.6	Confident	86.2	Confident	69 Å²	69	81.5 Å²	81.5	48%	0.483	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-20.2	179.4	59.8	0	0	0	0	113.5	C835 D840	C835-S838 WeakPolarHBondContact CB-OG 3.38Å; C835-S838 PolarHBondContact SG-OG 2.97Å; S838-D840 VanDerWaalsContact C-N 3.25Å; S838-D840 WeakPolarHBondContact CB-OD2 3.41Å; S838-D840 PolarHBondContact O-N 3.18Å; S838-D840 VanDerWaalsContact OG-CG 3.25Å; S838-D840 PolarHBondContact OG-OD2 3.17Å
839	G	82.4	Confident	86.4	Confident	8 Å²	8	76.2 Å²	76.2	8%	0.082	37%	0.37	C	S	.	.			trans	82.1	-0.8	-176.8	0	0	0	0	0	115.2	R834 C835	R834-G839 WeakPolarHBondContact CG-O 3.35Å; R834-G839 PolarHBondContact NE-O 3.25Å; C835-G839 WeakPolarHBondContact O-CA 3.26Å; C835-G839 PolarHBondContact O-N 3.37Å
840	D	87.8	Confident	86.6	Confident	44 Å²	44	74.2 Å²	74.2	24%	0.235	36%	0.355	C	S	.	.			trans	-65.5	153.9	-178.3	-64.2	-40.6	0	0	0	113.5	I821 R834 C835 S838 Y842	I821-D840 HydrophobicContact CD1-CB 3.56Å; I821-D840 WeakPolarHBondContact CD1-OD1 3.49Å; I821-D840 HydrophobicContact CG1-CB 4.37Å; R834-D840 CarbonylContact C-O 3.56Å; R834-D840 VanDerWaalsContact CA-O 3.32Å; R834-D840 WeakPolarHBondContact CA-O 3.24Å; C835-D840 HydrophobicContact CB-CB 4.46Å; C835-D840 PolarHBondContact N-O 2.97Å; S838-D840 VanDerWaalsContact C-N 3.25Å; S838-D840 WeakPolarHBondContact CB-OD2 3.41Å; S838-D840 PolarHBondContact O-N 3.18Å; S838-D840 VanDerWaalsContact OG-CG 3.25Å; S838-D840 PolarHBondContact OG-OD2 3.17Å; D840-Y842 HydrophobicContact CB-CD2 4.4Å; D840-Y842 HydrophobicContact CB-CE2 3.64Å
841	L	91.1	Very high	86.8	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.1	176	-62	-175.5	0	0	0	112.2	L795 F809 Y813 F818 C820 I821 L827 R834	L795-L841 HydrophobicContact CD1-CD1 3.84Å; L795-L841 HydrophobicContact CD1-CG 4.15Å; F809-L841 HydrophobicContact CD2-CD2 4.22Å; F809-L841 HydrophobicContact CE2-CD2 4Å; Y813-L841 HydrophobicContact CD1-CD1 4.07Å; Y813-L841 HydrophobicContact CE1-CD1 3.74Å; Y813-L841 HydrophobicContact CE1-CD2 4.25Å; Y813-L841 HydrophobicContact CE1-CG 4.12Å; F818-L841 HydrophobicContact CD2-CD1 3.32Å; F818-L841 HydrophobicContact CE2-CD1 3.48Å; F818-L841 VanDerWaalsContact CE2-CD1 3.48Å; F818-L841 HydrophobicContact CE2-CD2 4.3Å; F818-L841 HydrophobicContact CG-CD1 4.09Å; F818-L841 HydrophobicContact CZ-CD1 4.37Å; C820-L841 CarbonylContact C-O 3.58Å; C820-L841 WeakPolarHBondContact CA-O 3.38Å; I821-L841 PolarHBondContact N-O 3.31Å; L827-L841 HydrophobicContact CD1-CB 3.84Å; L827-L841 HydrophobicContact CD1-CD1 4.44Å; R834-L841 HydrophobicContact CB-CD2 4.02Å; R834-L841 HydrophobicContact CG-CD2 4.14Å
842	Y	90.6	Very high	87.1	Confident	25 Å²	25	68 Å²	68	10%	0.098	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.3	177.1	-64.4	-85.1	0	0	0	110.9	D822 H833 C835 D840 H846 F847 M850	D822-Y842 WeakPolarHBondContact OD2-CD1 3.12Å; D822-Y842 VanDerWaalsContact OD2-CE1 3.28Å; D822-Y842 WeakPolarHBondContact OD2-CE1 3.46Å; H833-Y842 PolarHBondContact N-O 3.32Å; H833-Y842 PolarHBondContact O-N 3.01Å; C835-Y842 HydrophobicContact CB-CD2 4.34Å; C835-Y842 HydrophobicContact CB-CE2 3.88Å; D840-Y842 HydrophobicContact CB-CD2 4.4Å; D840-Y842 HydrophobicContact CB-CE2 3.64Å; Y842-H846 HydrophobicContact CD1-CB 4.06Å; Y842-F847 HydrophobicContact CD2-CD2 4.31Å; Y842-M850 HydrophobicContact CD2-CE 4.5Å; Y842-M850 HydrophobicContact CE2-CE 4.24Å
843	C	92.6	Very high	86.9	Confident	24 Å²	24	72.2 Å²	72.2	16%	0.162	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	157.9	162.2	73.7	0	0	0	0	109.7	C820 L827 V845 H846 F847	C820-C843 HydrophobicContact CB-CB 4.27Å; C820-C843 PolarHBondContact SG-N 2.92Å; L827-C843 HydrophobicContact CD2-CB 3.64Å; C843-V845 PolarHBondContact O-N 3.03Å; C843-H846 PolarHBondContact O-N 3.19Å; C843-H846 VanDerWaalsContact O-N 3.09Å; C843-H846 PolarHBondContact SG-ND1 3.2Å; C843-F847 WeakPolarHBondContact O-CB 3.34Å; C843-F847 PolarHBondContact O-N 2.88Å
844	R	89.3	Confident	86.5	Confident	182 Å²	182	75.1 Å²	75.1	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-47.7	-33.3	178.3	-175.3	175.5	177	-167.1	-0.4	115.1	K831 K848	K831-R844 PolarHBondContact O-N 2.92Å; R844-K848 PolarHBondContact O-N 2.98Å
845	V	90.2	Very high	86.1	Confident	96 Å²	96	74.3 Å²	74.3	58%	0.582	37%	0.365	S	S	*	.	H	α-helix	trans	-71.6	-54	178.2	-179.4	0	0	0	0	111	C843 F847 K848 L849	C843-V845 PolarHBondContact O-N 3.03Å; V845-F847 PolarHBondContact O-N 3.24Å; V845-K848 PolarHBondContact O-N 3.37Å; V845-L849 HydrophobicContact CG1-CD1 4.12Å; V845-L849 WeakPolarHBondContact O-CG 3.45Å; V845-L849 PolarHBondContact O-N 3.26Å; V845-L849 VanDerWaalsContact O-N 3.12Å
846	H	90.6	Very high	85.9	Confident	51 Å²	51	81.6 Å²	81.6	24%	0.236	39%	0.391	C	S	.	.	H	α-helix	trans	-69.4	-33	-178.4	-68.9	137.1	0	0	0	113.2	C820 D822 Y842 C843 L849 M850	C820-H846 PolarHBondContact SG-ND1 3.07Å; D822-H846 HydrophobicContact CB-CB 4.34Å; D822-H846 WeakPolarHBondContact OD2-CB 3.42Å; D822-H846 IonicContact OD2-CG 3.77Å; Y842-H846 HydrophobicContact CD1-CB 4.06Å; C843-H846 PolarHBondContact O-N 3.19Å; C843-H846 VanDerWaalsContact O-N 3.09Å; C843-H846 PolarHBondContact SG-ND1 3.2Å; H846-L849 PolarHBondContact O-N 3.41Å; H846-M850 WeakPolarHBondContact O-CB 3.35Å; H846-M850 PolarHBondContact O-N 3.38Å
847	F	90	Very high	85.8	Confident	31 Å²	31	79.2 Å²	79.2	14%	0.136	38%	0.378	C	S	.	.	H	α-helix	trans	-58.8	-49.2	173.1	-172.2	-104.4	0	0	0	111.4	H833 Y842 C843 V845 L849 M850 E851	H833-F847 HydrophobicContact CB-CB 3.73Å; H833-F847 HydrophobicContact CB-CD1 3.74Å; H833-F847 HydrophobicContact CB-CD2 3.38Å; H833-F847 HydrophobicContact CB-CE1 4.17Å; H833-F847 HydrophobicContact CB-CE2 3.86Å; H833-F847 HydrophobicContact CB-CG 3.31Å; H833-F847 HydrophobicContact CB-CZ 4.23Å; H833-F847 AromaticContact CG-CD1 3.65Å; H833-F847 AromaticContact CG-CG 3.68Å; H833-F847 AromaticContact ND1-CD1 3.4Å; H833-F847 WeakPolarHBondContact ND1-CD1 3.43Å; H833-F847 AromaticContact ND1-CE1 3.63Å; H833-F847 AromaticContact ND1-CG 3.93Å; Y842-F847 HydrophobicContact CD2-CD2 4.31Å; C843-F847 WeakPolarHBondContact O-CB 3.34Å; C843-F847 PolarHBondContact O-N 2.88Å; V845-F847 PolarHBondContact O-N 3.24Å; F847-L849 PolarHBondContact O-N 3.4Å; F847-M850 HydrophobicContact CD2-CE 4.08Å; F847-M850 HydrophobicContact CE2-CE 4.07Å; F847-M850 PolarHBondContact O-N 3.15Å; F847-E851 HydrophobicContact CD1-CG 4.36Å; F847-E851 HydrophobicContact CE1-CG 4.04Å; F847-E851 WeakPolarHBondContact CE1-OE1 3.44Å; F847-E851 VanDerWaalsContact CE1-OE2 3.3Å; F847-E851 WeakPolarHBondContact CE1-OE2 3.44Å; F847-E851 HydrophobicContact CZ-CG 4.23Å; F847-E851 WeakPolarHBondContact CZ-OE1 3.41Å; F847-E851 WeakPolarHBondContact O-CG 3.4Å; F847-E851 PolarHBondContact O-N 3.2Å
848	K	89.1	Confident	85.6	Confident	121 Å²	121	76.7 Å²	76.7	53%	0.526	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-40.5	177.6	-171.6	172.3	-171.7	-72.3	0	112.4	R844 V845 M850 E851 E852	R844-K848 PolarHBondContact O-N 2.98Å; V845-K848 PolarHBondContact O-N 3.37Å; K848-M850 VanDerWaalsContact C-N 3.35Å; K848-E851 PolarHBondContact O-N 3.16Å; K848-E852 IonicContact NZ-OE1 2.67Å; K848-E852 PolarHBondContact NZ-OE1 3.39Å; K848-E852 WeakPolarHBondContact O-CB 3.43Å; K848-E852 WeakPolarHBondContact O-CG 3.45Å; K848-E852 PolarHBondContact O-N 3.41Å
849	L	87.8	Confident	85.2	Confident	81 Å²	81	78.1 Å²	78.1	42%	0.424	37%	0.369	S	S	.	.	H	α-helix	trans	-65.5	-36.5	175	-70.2	168.7	0	0	0	112.4	V845 H846 F847 N853	V845-L849 HydrophobicContact CG1-CD1 4.12Å; V845-L849 WeakPolarHBondContact O-CG 3.45Å; V845-L849 PolarHBondContact O-N 3.26Å; V845-L849 VanDerWaalsContact O-N 3.12Å; H846-L849 PolarHBondContact O-N 3.41Å; F847-L849 PolarHBondContact O-N 3.4Å; L849-N853 VanDerWaalsContact O-CB 3.28Å; L849-N853 WeakPolarHBondContact O-CB 3.35Å; L849-N853 PolarHBondContact O-N 3.14Å; L849-N853 PolarHBondContact O-ND2 3.1Å; L849-N853 VanDerWaalsContact O-ND2 3.14Å
850	M	85.2	Confident	84.8	Confident	43 Å²	43	79.9 Å²	79.9	21%	0.212	38%	0.38	C	S	.	.	H	α-helix	trans	-68.6	-43.6	175.5	-174.9	-82.1	-67	0	0	111.3	C835 Y842 H846 F847 K848 N853 R854	C835-M850 HydrophobicContact CB-CE 4.18Å; Y842-M850 HydrophobicContact CD2-CE 4.5Å; Y842-M850 HydrophobicContact CE2-CE 4.24Å; H846-M850 WeakPolarHBondContact O-CB 3.35Å; H846-M850 PolarHBondContact O-N 3.38Å; F847-M850 HydrophobicContact CD2-CE 4.08Å; F847-M850 HydrophobicContact CE2-CE 4.07Å; F847-M850 PolarHBondContact O-N 3.15Å; K848-M850 VanDerWaalsContact C-N 3.35Å; M850-N853 PolarHBondContact O-N 2.87Å; M850-R854 VanDerWaalsContact O-CB 3.22Å; M850-R854 WeakPolarHBondContact O-CB 3.49Å; M850-R854 PolarHBondContact O-N 3.32Å
851	E	85.3	Confident	84.1	Confident	94 Å²	94	81.7 Å²	81.7	44%	0.439	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-45.7	173.3	-71.6	-176.2	135.2	0	0	112.4	F847 K848 R854 S855	F847-E851 HydrophobicContact CD1-CG 4.36Å; F847-E851 HydrophobicContact CE1-CG 4.04Å; F847-E851 WeakPolarHBondContact CE1-OE1 3.44Å; F847-E851 VanDerWaalsContact CE1-OE2 3.3Å; F847-E851 WeakPolarHBondContact CE1-OE2 3.44Å; F847-E851 HydrophobicContact CZ-CG 4.23Å; F847-E851 WeakPolarHBondContact CZ-OE1 3.41Å; F847-E851 WeakPolarHBondContact O-CG 3.4Å; F847-E851 PolarHBondContact O-N 3.2Å; K848-E851 PolarHBondContact O-N 3.16Å; E851-R854 PolarHBondContact O-N 2.81Å; E851-S855 WeakPolarHBondContact O-CB 3.4Å; E851-S855 PolarHBondContact O-N 3.29Å; E851-S855 PolarHBondContact O-OG 2.97Å
852	E	86.4	Confident	83.2	Confident	66 Å²	66	86.2 Å²	86.2	31%	0.308	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-46.9	175.7	-76.6	176.9	-154.5	0	0	112.6	K848 R854 S855 R856	K848-E852 IonicContact NZ-OE1 2.67Å; K848-E852 PolarHBondContact NZ-OE1 3.39Å; K848-E852 WeakPolarHBondContact O-CB 3.43Å; K848-E852 WeakPolarHBondContact O-CG 3.45Å; K848-E852 PolarHBondContact O-N 3.41Å; E852-R854 PolarHBondContact O-N 3.39Å; E852-S855 PolarHBondContact O-N 3.12Å; E852-R856 WeakPolarHBondContact O-CG 3.04Å; E852-R856 PolarHBondContact O-N 3.43Å; E852-R856 IonicContact OE2-NH2 2.68Å
853	N	82.7	Confident	82.4	Confident	97 Å²	97	90.9 Å²	90.9	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-65	-38.5	177.6	-75.1	-28	0	0	0	112	L849 M850 K857	L849-N853 VanDerWaalsContact O-CB 3.28Å; L849-N853 WeakPolarHBondContact O-CB 3.35Å; L849-N853 PolarHBondContact O-N 3.14Å; L849-N853 PolarHBondContact O-ND2 3.1Å; L849-N853 VanDerWaalsContact O-ND2 3.14Å; M850-N853 PolarHBondContact O-N 2.87Å; N853-K857 WeakPolarHBondContact O-CB 3.5Å; N853-K857 PolarHBondContact O-N 2.84Å
854	R	81	Confident	81.4	Confident	117 Å²	117	94.5 Å²	94.5	44%	0.442	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-40.9	174.3	-178.7	176.9	172.4	-162.4	-6.1	111.5	M850 E851 E852 K857 M858	M850-R854 VanDerWaalsContact O-CB 3.22Å; M850-R854 WeakPolarHBondContact O-CB 3.49Å; M850-R854 PolarHBondContact O-N 3.32Å; E851-R854 PolarHBondContact O-N 2.81Å; E852-R854 PolarHBondContact O-N 3.39Å; R854-K857 PolarHBondContact O-N 3.27Å; R854-M858 WeakPolarHBondContact O-CG 3.11Å; R854-M858 PolarHBondContact O-N 3.33Å
855	S	79.8	Confident	80.4	Confident	69 Å²	69	90.3 Å²	90.3	48%	0.483	44%	0.442	S	S	.	.	H	α-helix	trans	-64.9	-44.5	179.4	-56.9	0	0	0	0	111.2	E851 E852 K857 M858 L859	E851-S855 WeakPolarHBondContact O-CB 3.4Å; E851-S855 PolarHBondContact O-N 3.29Å; E851-S855 PolarHBondContact O-OG 2.97Å; E852-S855 PolarHBondContact O-N 3.12Å; S855-K857 VanDerWaalsContact C-N 3.31Å; S855-K857 PolarHBondContact O-N 3.25Å; S855-M858 PolarHBondContact O-N 3.25Å; S855-L859 WeakPolarHBondContact O-CG 3.36Å; S855-L859 PolarHBondContact O-N 3.46Å; S855-L859 VanDerWaalsContact O-N 3.14Å
856	R	82.3	Confident	79.3	Confident	163 Å²	163	90.5 Å²	90.5	62%	0.615	44%	0.44	S	S	*	.	H	α-helix	trans	-59.7	-40.3	171.4	-66.9	176.7	-162	-171.9	8.5	112.1	E852 L859 S860	E852-R856 WeakPolarHBondContact O-CG 3.04Å; E852-R856 PolarHBondContact O-N 3.43Å; E852-R856 IonicContact OE2-NH2 2.68Å; R856-L859 PolarHBondContact O-N 2.88Å; R856-S860 PolarHBondContact O-N 3.49Å; R856-S860 PolarHBondContact O-OG 2.86Å
857	K	76.9	Confident	78.2	Confident	140 Å²	140	92.2 Å²	92.2	61%	0.609	45%	0.451	S	S	*	.	H	α-helix	trans	-66.9	-38.3	179.2	-168.8	171.3	-178.1	178	0	112.7	N853 R854 S855 S860 L861	N853-K857 WeakPolarHBondContact O-CB 3.5Å; N853-K857 PolarHBondContact O-N 2.84Å; R854-K857 PolarHBondContact O-N 3.27Å; S855-K857 VanDerWaalsContact C-N 3.31Å; S855-K857 PolarHBondContact O-N 3.25Å; K857-S860 WeakPolarHBondContact CA-OG 3.32Å; K857-S860 PolarHBondContact O-N 3.39Å; K857-S860 PolarHBondContact O-OG 3.04Å; K857-L861 HydrophobicContact CG-CD1 4.3Å; K857-L861 WeakPolarHBondContact O-CG 3.44Å; K857-L861 PolarHBondContact O-N 2.87Å; K857-L861 VanDerWaalsContact O-N 3.11Å
858	M	74.4	Confident	76.8	Confident	90 Å²	90	95.4 Å²	95.4	44%	0.443	47%	0.469	S	S	.	.	H	α-helix	trans	-60.5	-52.2	172.8	-71.3	-62.3	-55	0	0	111.2	R854 S855 S860 L861 E862	R854-M858 WeakPolarHBondContact O-CG 3.11Å; R854-M858 PolarHBondContact O-N 3.33Å; S855-M858 PolarHBondContact O-N 3.25Å; M858-S860 VanDerWaalsContact C-N 3.31Å; M858-S860 PolarHBondContact O-N 3.21Å; M858-L861 WeakPolarHBondContact O-CA 3.22Å; M858-L861 WeakPolarHBondContact O-CB 3.39Å; M858-L861 PolarHBondContact O-N 3.31Å; M858-E862 PolarHBondContact O-N 3.43Å
859	L	74.1	Confident	75.5	Confident	99 Å²	99	95.7 Å²	95.7	52%	0.518	47%	0.473	S	S	.	.	H	α-helix	trans	-55.9	-45.4	177.7	-67.8	169.3	0	0	0	111.6	S855 R856 L861 E862 E863	S855-L859 WeakPolarHBondContact O-CG 3.36Å; S855-L859 PolarHBondContact O-N 3.46Å; S855-L859 VanDerWaalsContact O-N 3.14Å; R856-L859 PolarHBondContact O-N 2.88Å; L859-L861 PolarHBondContact O-N 3.17Å; L859-E862 PolarHBondContact O-N 2.91Å; L859-E863 WeakPolarHBondContact O-CB 3.15Å; L859-E863 WeakPolarHBondContact O-CG 3.29Å; L859-E863 PolarHBondContact O-N 3.36Å
860	S	73.8	Confident	74.2	Confident	44 Å²	44	96.9 Å²	96.9	31%	0.308	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-22	177.1	68.5	0	0	0	0	114.3	R856 K857 M858 N864	R856-S860 PolarHBondContact O-N 3.49Å; R856-S860 PolarHBondContact O-OG 2.86Å; K857-S860 WeakPolarHBondContact CA-OG 3.32Å; K857-S860 PolarHBondContact O-N 3.39Å; K857-S860 PolarHBondContact O-OG 3.04Å; M858-S860 VanDerWaalsContact C-N 3.31Å; M858-S860 PolarHBondContact O-N 3.21Å; S860-N864 WeakPolarHBondContact O-CB 3.25Å; S860-N864 PolarHBondContact O-N 3.26Å; S860-N864 PolarHBondContact O-ND2 2.85Å
861	L	73.3	Confident	72.9	Confident	83 Å²	83	100.8 Å²	100.8	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-80.9	-38.7	173.9	-81.1	161.3	0	0	0	111	K857 M858 L859 N864 N865	K857-L861 HydrophobicContact CG-CD1 4.3Å; K857-L861 WeakPolarHBondContact O-CG 3.44Å; K857-L861 PolarHBondContact O-N 2.87Å; K857-L861 VanDerWaalsContact O-N 3.11Å; M858-L861 WeakPolarHBondContact O-CA 3.22Å; M858-L861 WeakPolarHBondContact O-CB 3.39Å; M858-L861 PolarHBondContact O-N 3.31Å; L859-L861 PolarHBondContact O-N 3.17Å; L861-N864 PolarHBondContact O-N 3.04Å; L861-N865 WeakPolarHBondContact O-CB 3.34Å; L861-N865 PolarHBondContact O-N 3.11Å; L861-N865 PolarHBondContact O-OD1 3.02Å
862	E	72.5	Confident	71.7	Confident	95 Å²	95	99.9 Å²	99.9	44%	0.444	50%	0.496	S	S	.	.	H	α-helix	trans	-63.5	-45.8	173.3	-69.1	160.6	-167.3	0	0	110.7	M858 L859 N864 N865 N866	M858-E862 PolarHBondContact O-N 3.43Å; L859-E862 PolarHBondContact O-N 2.91Å; E862-N864 PolarHBondContact O-N 3.31Å; E862-N865 PolarHBondContact O-N 3.16Å; E862-N866 WeakPolarHBondContact O-CB 3.24Å; E862-N866 PolarHBondContact O-N 3.08Å; E862-N866 PolarHBondContact O-ND2 2.94Å; E862-N866 PolarHBondContact O-OD1 3.36Å
863	E	73	Confident	70.5	Confident	122 Å²	122	99.1 Å²	99.1	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-58.6	-46.2	173.9	-71.7	170.8	157.5	0	0	112.5	L859 N867	L859-E863 WeakPolarHBondContact O-CB 3.15Å; L859-E863 WeakPolarHBondContact O-CG 3.29Å; L859-E863 PolarHBondContact O-N 3.36Å; E863-N867 VanDerWaalsContact O-CG 3.25Å; E863-N867 PolarHBondContact O-N 3.46Å; E863-N867 PolarHBondContact O-ND2 3.47Å
864	N	71	Confident	69.4	Low	100 Å²	100	99.9 Å²	99.9	54%	0.535	50%	0.501	S	S	.	.	H	α-helix	trans	-70.2	-35.7	179.6	-79.3	-54	0	0	0	113.1	S860 L861 E862 N867 N868	S860-N864 WeakPolarHBondContact O-CB 3.25Å; S860-N864 PolarHBondContact O-N 3.26Å; S860-N864 PolarHBondContact O-ND2 2.85Å; L861-N864 PolarHBondContact O-N 3.04Å; E862-N864 PolarHBondContact O-N 3.31Å; N864-N867 PolarHBondContact O-N 2.82Å; N864-N868 WeakPolarHBondContact O-CB 3.3Å; N864-N868 PolarHBondContact O-N 3.48Å; N864-N868 VanDerWaalsContact O-N 3.11Å
865	N	69.9	Low	68.3	Low	94 Å²	94	98.4 Å²	98.4	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-45.9	175.1	-74	-2.2	0	0	0	111.1	L861 E862 N867 N868 E869	L861-N865 WeakPolarHBondContact O-CB 3.34Å; L861-N865 PolarHBondContact O-N 3.11Å; L861-N865 PolarHBondContact O-OD1 3.02Å; E862-N865 PolarHBondContact O-N 3.16Å; N865-N867 VanDerWaalsContact C-N 3.29Å; N865-N867 PolarHBondContact O-N 3.27Å; N865-N868 PolarHBondContact O-N 2.9Å; N865-N868 VanDerWaalsContact O-N 3.13Å; N865-E869 PolarHBondContact O-N 3.29Å
866	N	67.2	Low	67.3	Low	100 Å²	100	102 Å²	102	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-59.9	-38.6	178.2	-65.8	-19.4	0	0	0	112.2	E862 M870	E862-N866 WeakPolarHBondContact O-CB 3.24Å; E862-N866 PolarHBondContact O-N 3.08Å; E862-N866 PolarHBondContact O-ND2 2.94Å; E862-N866 PolarHBondContact O-OD1 3.36Å; N866-M870 PolarHBondContact O-N 3.44Å; N866-M870 VanDerWaalsContact O-N 3.16Å
867	N	67.3	Low	66.1	Low	88 Å²	88	101.7 Å²	101.7	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-43.7	175	-68.6	-26.9	0	0	0	111.7	E863 N864 N865 M870 E871	E863-N867 VanDerWaalsContact O-CG 3.25Å; E863-N867 PolarHBondContact O-N 3.46Å; E863-N867 PolarHBondContact O-ND2 3.47Å; N864-N867 PolarHBondContact O-N 2.82Å; N865-N867 VanDerWaalsContact C-N 3.29Å; N865-N867 PolarHBondContact O-N 3.27Å; N867-M870 PolarHBondContact O-N 3.25Å; N867-E871 PolarHBondContact O-N 2.9Å
868	N	59.8	Low	65.1	Low	97 Å²	97	102 Å²	102	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-67.8	-37.4	-180	-173.6	72.5	0	0	0	112.3	N864 N865 M870 E871 T872	N864-N868 WeakPolarHBondContact O-CB 3.3Å; N864-N868 PolarHBondContact O-N 3.48Å; N864-N868 VanDerWaalsContact O-N 3.11Å; N865-N868 PolarHBondContact O-N 2.9Å; N865-N868 VanDerWaalsContact O-N 3.13Å; N868-M870 VanDerWaalsContact C-N 3.34Å; N868-E871 PolarHBondContact O-N 2.76Å; N868-T872 PolarHBondContact O-N 3.2Å; N868-T872 PolarHBondContact O-OG1 3.48Å
869	E	61.1	Low	64.1	Low	127 Å²	127	104.6 Å²	104.6	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-40.1	172.1	-73.6	-180	-174.8	0	0	111.6	N865 T872 A873	N865-E869 PolarHBondContact O-N 3.29Å; E869-T872 WeakPolarHBondContact CA-OG1 3.38Å; E869-T872 PolarHBondContact O-N 2.95Å; E869-T872 PolarHBondContact O-OG1 3Å; E869-A873 PolarHBondContact O-N 3.03Å
870	M	60.4	Low	63.3	Low	107 Å²	107	105.4 Å²	105.4	53%	0.527	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-38.7	175.4	-172.2	179.6	67.4	0	0	112.8	N866 N867 N868 Q874	N866-M870 PolarHBondContact O-N 3.44Å; N866-M870 VanDerWaalsContact O-N 3.16Å; N867-M870 PolarHBondContact O-N 3.25Å; N868-M870 VanDerWaalsContact C-N 3.34Å; M870-Q874 WeakPolarHBondContact O-CG 3.48Å; M870-Q874 PolarHBondContact O-N 3.36Å
871	E	59.6	Low	62.3	Low	125 Å²	125	107.5 Å²	107.5	58%	0.584	56%	0.558	S	S	*	*	H	α-helix	trans	-65.5	-41.5	173.4	-73.4	-174.2	154.5	0	0	111.5	N867 N868 A873 Q874 V875	N867-E871 PolarHBondContact O-N 2.9Å; N868-E871 PolarHBondContact O-N 2.76Å; E871-A873 PolarHBondContact O-N 3.3Å; E871-Q874 PolarHBondContact O-N 2.99Å; E871-V875 PolarHBondContact O-N 3.09Å
872	T	59.8	Low	61.2	Low	74 Å²	74	111.1 Å²	111.1	45%	0.454	58%	0.578	S	S	.	*	H	α-helix	trans	-63.7	-38.8	176.4	47.5	0	0	0	0	113.2	N868 E869 Q874 V875 E876	N868-T872 PolarHBondContact O-N 3.2Å; N868-T872 PolarHBondContact O-OG1 3.48Å; E869-T872 WeakPolarHBondContact CA-OG1 3.38Å; E869-T872 PolarHBondContact O-N 2.95Å; E869-T872 PolarHBondContact O-OG1 3Å; T872-Q874 VanDerWaalsContact C-N 3.31Å; T872-Q874 PolarHBondContact O-N 3.35Å; T872-V875 PolarHBondContact O-N 3.44Å; T872-E876 PolarHBondContact O-N 2.83Å; T872-E876 VanDerWaalsContact O-N 3.16Å
873	A	60.4	Low	59.9	Low	50 Å²	50	116.5 Å²	116.5	41%	0.413	61%	0.608	S	S	.	*	H	α-helix	trans	-64.9	-33.8	177.6	0	0	0	0	0	112.7	E869 E871 E876 E877	E869-A873 PolarHBondContact O-N 3.03Å; E871-A873 PolarHBondContact O-N 3.3Å; A873-E876 PolarHBondContact O-N 3.26Å; A873-E877 PolarHBondContact O-N 3.37Å; A873-E877 VanDerWaalsContact O-N 3.12Å
874	Q	59.3	Low	59.3	Low	113 Å²	113	116.3 Å²	116.3	53%	0.528	61%	0.609	S	S	.	*	H	α-helix	trans	-70.8	-34.6	177.8	-72	174.1	11.1	0	0	112.4	M870 E871 T872 E877 E878	M870-Q874 WeakPolarHBondContact O-CG 3.48Å; M870-Q874 PolarHBondContact O-N 3.36Å; E871-Q874 PolarHBondContact O-N 2.99Å; T872-Q874 VanDerWaalsContact C-N 3.31Å; T872-Q874 PolarHBondContact O-N 3.35Å; Q874-E877 PolarHBondContact O-N 3.37Å; Q874-E878 PolarHBondContact O-N 3.05Å; Q874-E878 VanDerWaalsContact O-N 3.15Å
875	V	58.9	Low	58.7	Low	86 Å²	86	117.1 Å²	117.1	52%	0.521	61%	0.613	S	S	.	*	H	α-helix	trans	-69.3	-39.4	174.7	178.4	0	0	0	0	111.5	E871 T872 E877 E878 E879	E871-V875 PolarHBondContact O-N 3.09Å; T872-V875 PolarHBondContact O-N 3.44Å; V875-E877 VanDerWaalsContact C-N 3.33Å; V875-E877 PolarHBondContact O-N 3.13Å; V875-E878 PolarHBondContact O-N 3.31Å; V875-E879 PolarHBondContact O-N 3.42Å; V875-E879 VanDerWaalsContact O-N 3.1Å
876	E	58.1	Low	58.1	Low	145 Å²	145	118.4 Å²	118.4	68%	0.678	62%	0.619	S	S	*	*	H	α-helix	trans	-67.1	-30.4	175.3	-70.1	-171.9	171.9	0	0	112.8	T872 A873 V880	T872-E876 PolarHBondContact O-N 2.83Å; T872-E876 VanDerWaalsContact O-N 3.16Å; A873-E876 PolarHBondContact O-N 3.26Å; E876-V880 VanDerWaalsContact O-CG2 3.29Å; E876-V880 WeakPolarHBondContact O-CG2 3.13Å
877	E	57.2	Low	57.5	Low	156 Å²	156	119.5 Å²	119.5	73%	0.729	62%	0.624	S	S	*	*	H	α-helix	trans	-73.8	-32.7	172.4	-74.2	-167	155	0	0	113.3	A873 Q874 V875	A873-E877 PolarHBondContact O-N 3.37Å; A873-E877 VanDerWaalsContact O-N 3.12Å; Q874-E877 PolarHBondContact O-N 3.37Å; V875-E877 VanDerWaalsContact C-N 3.33Å; V875-E877 PolarHBondContact O-N 3.13Å
878	E	56	Low	56.9	Low	147 Å²	147	121.4 Å²	121.4	69%	0.687	63%	0.634	S	S	*	*	H	α-helix	trans	-71.8	-44.5	175	-74.3	-164.7	149.8	0	0	112.5	Q874 V875 V880 S881	Q874-E878 PolarHBondContact O-N 3.05Å; Q874-E878 VanDerWaalsContact O-N 3.15Å; V875-E878 PolarHBondContact O-N 3.31Å; E878-V880 PolarHBondContact O-N 2.79Å; E878-S881 WeakPolarHBondContact O-CB 3.27Å; E878-S881 PolarHBondContact O-N 3.38Å; E878-S881 PolarHBondContact O-OG 3.32Å
879	E	54.3	Low	56.7	Low	145 Å²	145	123.1 Å²	123.1	68%	0.678	64%	0.642	S	S	*	*	H	α-helix	trans	-63.7	-22.8	179.3	-75	-158	152.7	0	0	113.6	V875 S881	V875-E879 PolarHBondContact O-N 3.42Å; V875-E879 VanDerWaalsContact O-N 3.1Å; E879-S881 VanDerWaalsContact C-N 3.29Å
880	V	57.2	Low	56.4	Low	115 Å²	115	122.8 Å²	122.8	70%	0.697	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-6.8	175.2	174.2	0	0	0	0	112.5	E876 E878	E876-V880 VanDerWaalsContact O-CG2 3.29Å; E876-V880 WeakPolarHBondContact O-CG2 3.13Å; E878-V880 PolarHBondContact O-N 2.79Å
881	S	52.2	Low	56.1	Low	88 Å²	88	124 Å²	124	62%	0.615	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-15.2	-178.3	75.5	0	0	0	0	115.5	E878 E879	E878-S881 WeakPolarHBondContact O-CB 3.27Å; E878-S881 PolarHBondContact O-N 3.38Å; E878-S881 PolarHBondContact O-OG 3.32Å; E879-S881 VanDerWaalsContact C-N 3.29Å
882	D	50.1	Low	55.8	Low	160 Å²	160	123.9 Å²	123.9	86%	0.856	66%	0.66	S	S	*	*			trans	-104.6	21.3	-177.7	-103.9	-18	0	0	0	113.4
883	I	46.2	Very low	55.4	Low	208 Å²	208	128.5 Å²	128.5	100%	1.067	68%	0.679	S	S	*	*			trans	-124.3	0	179.9	-57.3	-178.4	0	0	0	111.9

Retrieved 883 of 883 residues in 336.3 ms (Link to these results)

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