A0A087XCZ6_POEFO Loading...

Adenosine deaminase domain containing 2

AlphaFold DB , UniProt , Accession A0A087XCZ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 525 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	29.3	Very low	233 Å²	233	164.5 Å²	164.5	100%	1.148	83%	0.829	S	S	*	*				0	147.8	0	-73	173.2	67.8	0	0	107.3
2	S	31.5	Very low	29.3	Very low	107 Å²	107	171.4 Å²	171.4	75%	0.748	84%	0.838	S	S	*	*			trans	57.1	146.9	-160.4	65.1	0	0	0	0	115.3
3	D	29	Very low	29.2	Very low	158 Å²	158	164.4 Å²	164.4	85%	0.845	84%	0.837	S	S	*	*			cis	-152	167.8	-32.8	-102.6	-40.8	0	0	0	109.7
4	Q	34.9	Very low	28.8	Very low	178 Å²	178	158.4 Å²	158.4	83%	0.832	84%	0.837	S	S	*	*			trans	-89.4	138.4	175	-66.1	179.9	-21.4	0	0	111.5
5	E	28.7	Very low	28.6	Very low	172 Å²	172	153.2 Å²	153.2	80%	0.804	84%	0.836	S	S	*	*			trans	-141.8	144.8	141	-82.6	-143.1	128	0	0	111
6	L	26.9	Very low	28.5	Very low	138 Å²	138	148.9 Å²	148.9	72%	0.723	83%	0.828	S	S	*	*			trans	-93.1	133	171.6	-91.7	71.9	0	0	0	109.7
7	F	25.7	Very low	28.4	Very low	192 Å²	192	150.5 Å²	150.5	84%	0.842	83%	0.83	S	S	*	*			trans	-112.7	114.3	154.5	-89.5	-89.3	0	0	0	111.2
8	K	24.5	Very low	28.4	Very low	179 Å²	179	153.2 Å²	153.2	78%	0.778	83%	0.832	S	S	*	*			trans	-78.9	139.2	171	-65.5	172.2	179.4	172	0	108.9
9	Y	24.8	Very low	28.3	Very low	226 Å²	226	156.5 Å²	156.5	89%	0.886	83%	0.831	S	S	*	*			trans	-125.8	136.4	162.6	-154.9	-97.4	0	0	0	109.7
10	S	25.7	Very low	28.3	Very low	94 Å²	94	154.5 Å²	154.5	66%	0.657	83%	0.83	S	S	*	*			trans	-117	126.9	-172.2	-62.1	0	0	0	0	111.5	R12	S10-R12 PolarHBondContact O-N 3.18Å
11	P	30.8	Very low	28.2	Very low	132 Å²	132	154.9 Å²	154.9	86%	0.857	83%	0.831	S	S	*	*			trans	-78.9	101.1	175.2	30.9	-32.6	0	0	0	111.3
12	R	29.4	Very low	27.7	Very low	248 Å²	248	152.1 Å²	152.1	94%	0.936	81%	0.813	S	S	*	*			trans	-93.5	140.4	142.9	-67.9	-179.9	175.2	-176.9	-1.6	106.7	S10	S10-R12 PolarHBondContact O-N 3.18Å
13	G	27	Very low	27.7	Very low	80 Å²	80	152.8 Å²	152.8	83%	0.825	82%	0.815	S	S	*	*			cis	159.3	117.2	-3.4	0	0	0	0	0	108.6
14	G	24.4	Very low	27.6	Very low	81 Å²	81	152.4 Å²	152.4	84%	0.835	81%	0.813	S	S	*	*			trans	-175.1	59.8	-168.4	0	0	0	0	0	113.9	A16	G14-A16 PolarHBondContact O-N 3.1Å
15	G	26.2	Very low	27.2	Very low	80 Å²	80	153.7 Å²	153.7	83%	0.825	82%	0.816	S	S	*	*			trans	-77.3	105.7	178.4	0	0	0	0	0	112.6	M17	G15-M17 PolarHBondContact O-N 3.31Å; G15-M17 VanDerWaalsContact O-N 3.1Å
16	A	26	Very low	27.3	Very low	85 Å²	85	154.2 Å²	154.2	70%	0.702	82%	0.818	S	S	*	*			trans	-80.4	81.2	173.3	0	0	0	0	0	111.4	G14 F18	G14-A16 PolarHBondContact O-N 3.1Å; A16-F18 PolarHBondContact O-N 3.09Å; A16-F18 VanDerWaalsContact O-N 3.14Å
17	M	27.8	Very low	27.9	Very low	175 Å²	175	153.7 Å²	153.7	86%	0.862	82%	0.823	S	S	*	*			trans	-75.2	96.9	176.2	-173.7	-173.6	-174.5	0	0	110.9	G15 R19	G15-M17 PolarHBondContact O-N 3.31Å; G15-M17 VanDerWaalsContact O-N 3.1Å; M17-R19 PolarHBondContact O-N 3.14Å; M17-R19 VanDerWaalsContact O-N 3.09Å
18	F	28.3	Very low	27.9	Very low	199 Å²	199	147.8 Å²	147.8	87%	0.873	82%	0.817	S	S	*	*			trans	-70.5	104.4	175.5	-90	-86.7	0	0	0	111.7	A16	A16-F18 PolarHBondContact O-N 3.09Å; A16-F18 VanDerWaalsContact O-N 3.14Å
19	R	26.4	Very low	28.1	Very low	217 Å²	217	146.8 Å²	146.8	82%	0.819	82%	0.819	S	S	*	*			trans	-66.1	139.8	165.7	-80.2	-179.6	166	-179	-5	110.2	M17 L21	M17-R19 PolarHBondContact O-N 3.14Å; M17-R19 VanDerWaalsContact O-N 3.09Å; R19-L21 PolarHBondContact O-N 3.38Å
20	S	27.9	Very low	28.2	Very low	115 Å²	115	143.8 Å²	143.8	80%	0.804	81%	0.813	S	S	*	*			trans	-66.2	123.2	162.2	179.2	0	0	0	0	109.2
21	L	26.5	Very low	28.3	Very low	163 Å²	163	148.7 Å²	148.7	85%	0.853	83%	0.825	S	S	*	*			trans	-87.3	114.3	170.5	-72.4	167.7	0	0	0	109	R19	R19-L21 PolarHBondContact O-N 3.38Å
22	K	28.8	Very low	28.2	Very low	175 Å²	175	150.6 Å²	150.6	76%	0.761	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.8	147.2	153.1	-71.8	-175.4	175.6	-176.2	0	108.2
23	P	32.3	Very low	28.9	Very low	122 Å²	122	143.2 Å²	143.2	79%	0.792	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.9	128.1	160.4	23.7	-15.4	0	0	0	109.3
24	D	26.8	Very low	29.4	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-78.2	147.2	169.4	-63.2	-57.1	0	0	0	110.5
25	F	26.4	Very low	29.7	Very low	206 Å²	206	148.1 Å²	148.1	90%	0.904	80%	0.796	S	S	*	*			trans	-143.7	109.1	172.2	-130	-84.3	0	0	0	107.8
26	E	31.6	Very low	29.7	Very low	183 Å²	183	151.3 Å²	151.3	86%	0.855	80%	0.799	S	S	*	*			trans	-86.5	157.4	-178.1	-85.4	-156.4	142.2	0	0	113.2
27	P	38.7	Very low	29.7	Very low	126 Å²	126	154 Å²	154	82%	0.818	80%	0.797	S	S	*	*			trans	-95	159.3	-163.9	37.1	-36.6	0	0	0	115.1
28	G	25.9	Very low	29.8	Very low	69 Å²	69	153.6 Å²	153.6	71%	0.711	80%	0.798	S	S	*	*			trans	-148.9	91.1	178.8	0	0	0	0	0	115.5
29	L	28.1	Very low	29.7	Very low	157 Å²	157	148.4 Å²	148.4	82%	0.822	79%	0.792	S	S	*	*			trans	40.2	115.7	157	-67.9	97.6	0	0	0	122.5
30	H	27.8	Very low	30	Very low	164 Å²	164	147 Å²	147	76%	0.759	79%	0.794	S	S	*	*				44	124.1	129.1	-66.1	-82.7	0	0	0	122.9
31	H	27.1	Very low	30	Very low	197 Å²	197	149.8 Å²	149.8	91%	0.912	80%	0.8	S	S	*	*				-156.9	154.3	118.8	-99	-71.5	0	0	0	111.2
32	H	28.1	Very low	30.2	Very low	171 Å²	171	146.5 Å²	146.5	79%	0.792	80%	0.796	S	S	*	*			trans	-153.7	167.8	-175.7	-103.1	-46.9	0	0	0	108.5
33	P	45.6	Very low	30.4	Very low	94 Å²	94	142.8 Å²	142.8	61%	0.61	80%	0.799	S	S	*	*			cis	-116.9	-132.7	-39	40.7	-23.6	0	0	0	107.6
34	P	37.2	Very low	30.2	Very low	120 Å²	120	143.8 Å²	143.8	78%	0.779	80%	0.802	S	S	*	*			cis	-96.8	164.7	6.8	7.2	16.7	0	0	0	112.8
35	E	29.4	Very low	30.3	Very low	144 Å²	144	145.9 Å²	145.9	67%	0.673	81%	0.807	S	S	*	*			cis	85.1	106	20.1	-162.8	-177	-87	0	0	116.8
36	V	26.8	Very low	30.3	Very low	146 Å²	146	139.9 Å²	139.9	89%	0.885	80%	0.803	S	S	*	*			trans	-146.6	124.6	155.4	177.5	0	0	0	0	108.3
37	H	27.3	Very low	30.2	Very low	143 Å²	143	136.6 Å²	136.6	66%	0.662	80%	0.8	S	S	*	*			trans	-83.5	159.4	171.3	-72.4	-98.7	0	0	0	111.2
38	L	28.4	Very low	29.7	Very low	166 Å²	166	137.5 Å²	137.5	87%	0.869	80%	0.804	S	S	*	*				163.5	158.5	92.5	-82.2	173.5	0	0	0	106.6
39	A	27.3	Very low	29.9	Very low	90 Å²	90	138.8 Å²	138.8	74%	0.744	81%	0.807	S	S	*	*			cis	-158.4	176.1	-11.8	0	0	0	0	0	109
40	E	32.2	Very low	29.8	Very low	188 Å²	188	134.8 Å²	134.8	88%	0.879	80%	0.804	S	S	*	*			trans	-77.6	163.5	171.4	-55.8	170	117.2	0	0	112
41	D	28.8	Very low	29.9	Very low	172 Å²	172	135.4 Å²	135.4	92%	0.92	81%	0.812	S	S	*	*			trans	-153.7	162.5	139.7	-138	-30.4	0	0	0	112.3
42	A	29.9	Very low	30.1	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	80%	0.804	S	S	*	*			trans	-109.7	177.9	-155.1	0	0	0	0	0	116.8
43	A	32.2	Very low	30.2	Very low	98 Å²	98	135.2 Å²	135.2	81%	0.81	81%	0.809	S	S	*	*			trans	-94.6	151.6	-173.9	0	0	0	0	0	114.6
44	V	28.5	Very low	29.5	Very low	143 Å²	143	136.6 Å²	136.6	87%	0.867	81%	0.811	S	S	*	*			trans	-138.7	153.1	171.4	-179.1	0	0	0	0	111.2
45	H	29.7	Very low	29.2	Very low	193 Å²	193	135.1 Å²	135.1	89%	0.894	81%	0.809	S	S	*	*			trans	-70.3	160.6	-172.5	-58.7	-74.4	0	0	0	116.9
46	G	26.7	Very low	29.2	Very low	80 Å²	80	136.5 Å²	136.5	83%	0.825	82%	0.82	S	S	*	*			trans	-158.4	136	155.7	0	0	0	0	0	111.2
47	S	27.8	Very low	29.3	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	82%	0.82	S	S	*	*			trans	-145.8	139.6	-177.2	172.6	0	0	0	0	111.1
48	T	29	Very low	29.6	Very low	145 Å²	145	133 Å²	133	89%	0.89	83%	0.831	S	S	*	*			trans	-177.3	171.1	137.5	18.1	0	0	0	0	112.9
49	A	30.4	Very low	29.5	Very low	96 Å²	96	129 Å²	129	79%	0.793	83%	0.83	S	S	*	*			trans	-60	165.9	179	0	0	0	0	0	114.2
50	G	26.8	Very low	29.5	Very low	72 Å²	72	128.6 Å²	128.6	74%	0.742	84%	0.835	S	S	*	*			cis	108.7	126.8	8.3	0	0	0	0	0	112.4
51	L	29.9	Very low	29.4	Very low	177 Å²	177	124.8 Å²	124.8	93%	0.927	83%	0.829	S	S	*	*			trans	-151.4	144.6	175.3	-109.1	171.5	0	0	0	110.5
52	R	30.2	Very low	29.4	Very low	197 Å²	197	123 Å²	123	74%	0.743	82%	0.819	S	S	*	*			trans	-97.8	165.8	171.5	-68.1	-177.8	177.6	176.1	-1.2	110.4	D54	R52-D54 WeakPolarHBondContact CD-OD2 3.18Å; R52-D54 IonicContact NH1-OD2 2.69Å
53	N	30.1	Very low	29.4	Very low	168 Å²	168	127 Å²	127	90%	0.898	82%	0.822	S	S	*	*				-151.2	145.8	119.5	-99.8	-24.3	0	0	0	110.9
54	D	30.8	Very low	29.2	Very low	122 Å²	122	130 Å²	130	65%	0.652	82%	0.816	S	S	*	*			trans	-108.1	-167.5	-175.2	-66.2	-70.1	0	0	0	111	R52	R52-D54 WeakPolarHBondContact CD-OD2 3.18Å; R52-D54 IonicContact NH1-OD2 2.69Å
55	A	30.3	Very low	29.3	Very low	89 Å²	89	131.8 Å²	131.8	74%	0.736	82%	0.815	S	S	*	*			trans	85.6	118.6	172.8	0	0	0	0	0	116.1
56	L	31	Very low	29.2	Very low	174 Å²	174	129 Å²	129	91%	0.911	80%	0.802	S	S	*	*			cis	105.8	114.5	30.6	-81.9	166	0	0	0	111.4
57	A	28.3	Very low	29.2	Very low	106 Å²	106	130 Å²	130	88%	0.876	80%	0.797	S	S	*	*			trans	-154.6	140.6	146.5	0	0	0	0	0	108.5
58	A	32.3	Very low	29.2	Very low	109 Å²	109	132.6 Å²	132.6	90%	0.901	80%	0.802	S	S	*	*			trans	-120.9	150.2	175.5	0	0	0	0	0	109.9
59	G	27	Very low	29.2	Very low	82 Å²	82	132 Å²	132	85%	0.845	80%	0.798	S	S	*	*			trans	-175.1	139	174.4	0	0	0	0	0	110.1
60	G	26.7	Very low	29	Very low	82 Å²	82	132.1 Å²	132.1	85%	0.845	79%	0.792	S	S	*	*			trans	-167.1	153.5	178.1	0	0	0	0	0	112.2
61	S	30	Very low	29	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	80%	0.797	S	S	*	*			trans	-162.7	128.2	167.5	57.3	0	0	0	0	111.6
62	N	30.6	Very low	28.9	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	79%	0.791	S	S	*	*			trans	38.3	132.4	135	-62.5	3.6	0	0	0	122.5
63	H	30	Very low	28.7	Very low	178 Å²	178	131.3 Å²	131.3	82%	0.824	80%	0.798	S	S	*	*			trans	62.4	140	148.3	-57.3	-49.3	0	0	0	117.3
64	K	27.8	Very low	28.7	Very low	161 Å²	161	131 Å²	131	70%	0.7	80%	0.797	S	S	*	*			cis	-148.3	174.6	43.6	-137.5	-172.4	172.8	-149.6	0	113.1	E66	K64-E66 WeakPolarHBondContact CD-OE2 3.4Å; K64-E66 WeakPolarHBondContact CE-OE1 3.34Å; K64-E66 WeakPolarHBondContact CE-OE2 3.36Å; K64-E66 IonicContact NZ-OE1 2.63Å; K64-E66 PolarHBondContact NZ-OE1 2.64Å; K64-E66 IonicContact NZ-OE2 2.67Å; K64-E66 PolarHBondContact NZ-OE2 2.79Å
65	Q	29.7	Very low	28.5	Very low	179 Å²	179	128.7 Å²	128.7	84%	0.836	80%	0.801	S	S	*	*			trans	-135.7	117.5	175.2	174.2	-176.4	-4.8	0	0	108.7
66	E	27.1	Very low	28.5	Very low	134 Å²	134	129.6 Å²	129.6	63%	0.626	80%	0.802	S	S	*	*			trans	-158.4	131.6	163.7	-87.7	127.7	-171.3	0	0	103.7	K64	K64-E66 WeakPolarHBondContact CD-OE2 3.4Å; K64-E66 WeakPolarHBondContact CE-OE1 3.34Å; K64-E66 WeakPolarHBondContact CE-OE2 3.36Å; K64-E66 IonicContact NZ-OE1 2.63Å; K64-E66 PolarHBondContact NZ-OE1 2.64Å; K64-E66 IonicContact NZ-OE2 2.67Å; K64-E66 PolarHBondContact NZ-OE2 2.79Å
67	S	28.2	Very low	28.4	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	80%	0.802	S	S	*	*			cis	70.8	102	27.8	86.1	0	0	0	0	114.7
68	D	26.8	Very low	28.5	Very low	168 Å²	168	132.6 Å²	132.6	90%	0.898	80%	0.799	S	S	*	*			trans	-137.7	140.8	163.4	-109.4	-36	0	0	0	109.8
69	V	28.1	Very low	28.2	Very low	134 Å²	134	134.4 Å²	134.4	81%	0.812	80%	0.799	S	S	*	*			trans	-150.8	126.9	-178.5	173.6	0	0	0	0	108.5
70	C	26.6	Very low	28.3	Very low	98 Å²	98	136 Å²	136	66%	0.662	80%	0.797	S	S	*	*			trans	178.9	138	151.2	-97.7	0	0	0	0	106.3
71	E	28.3	Very low	28.6	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	79%	0.794	S	S	*	*				54.9	122.1	77.2	-57.9	179	154.5	0	0	112.3
72	G	26.1	Very low	28.3	Very low	77 Å²	77	140.4 Å²	140.4	79%	0.794	80%	0.798	S	S	*	*			cis	138.4	136.4	-2.1	0	0	0	0	0	110.7
73	D	27	Very low	27.9	Very low	169 Å²	169	141.6 Å²	141.6	90%	0.904	80%	0.803	S	S	*	*			trans	-159.9	167.6	168.6	-148.3	-8.7	0	0	0	112.8
74	D	30.5	Very low	27.8	Very low	162 Å²	162	140.9 Å²	140.9	87%	0.866	80%	0.804	S	S	*	*			trans	-83.3	166.5	-176	-130.5	-36.6	0	0	0	113.5
75	G	26.8	Very low	27.6	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	81%	0.812	S	S	*	*			trans	169.4	89.6	175	0	0	0	0	0	117.6
76	S	30.3	Very low	27.5	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	81%	0.81	S	S	*	*			trans	-83	136.3	174.6	59.8	0	0	0	0	113.9
77	N	28.8	Very low	27.4	Very low	168 Å²	168	146 Å²	146	90%	0.898	82%	0.823	S	S	*	*			trans	-168.3	152	136.6	-108.7	-24.5	0	0	0	114.1
78	E	29.1	Very low	27.2	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	82%	0.821	S	S	*	*			trans	-85.3	148.7	167.7	-56.6	-178.7	126.3	0	0	111.1
79	T	27.7	Very low	27.3	Very low	147 Å²	147	148.9 Å²	148.9	90%	0.902	82%	0.82	S	S	*	*				-178	163.6	128.3	21.1	0	0	0	0	111.8
80	S	27.9	Very low	27.1	Very low	115 Å²	115	149.1 Å²	149.1	80%	0.804	82%	0.817	S	S	*	*			trans	-102	-161.8	-161.2	-41.7	0	0	0	0	113.4
81	P	32.2	Very low	27.3	Very low	121 Å²	121	148.9 Å²	148.9	79%	0.786	82%	0.817	S	S	*	*			trans	-108.6	168.3	-131.2	29.3	-8.8	0	0	0	115.5
82	I	24.5	Very low	27.1	Very low	163 Å²	163	147 Å²	147	84%	0.836	81%	0.812	S	S	*	*			trans	-111.7	135.1	179.7	-65	178.8	0	0	0	111.7
83	L	23.3	Very low	27.2	Very low	160 Å²	160	149.9 Å²	149.9	84%	0.838	81%	0.81	S	S	*	*			trans	-79	135.4	174.2	-84.1	68.1	0	0	0	112.5
84	I	27	Very low	27.3	Very low	162 Å²	162	149.7 Å²	149.7	83%	0.831	81%	0.808	S	S	*	*			trans	-137.2	95.2	146.8	-58.5	-176.5	0	0	0	106.1
85	R	24.7	Very low	27	Very low	231 Å²	231	146.3 Å²	146.3	87%	0.872	80%	0.797	S	S	*	*				96.8	117	71.8	-169.5	-179.8	-163.1	174.1	6.5	110.8
86	K	25.7	Very low	27.1	Very low	183 Å²	183	148.7 Å²	148.7	80%	0.796	80%	0.797	S	S	*	*			trans	-59.7	148.8	172.3	-68.1	-179	175.3	-176.9	0	111
87	N	24.9	Very low	26.8	Very low	167 Å²	167	150.2 Å²	150.2	89%	0.893	79%	0.792	S	S	*	*			trans	-116	152.1	139.9	-87.5	-15.7	0	0	0	108.2
88	L	25.6	Very low	26.8	Very low	128 Å²	128	150 Å²	150	67%	0.67	79%	0.791	S	S	*	*			trans	-138.1	141.6	-172.1	-173.4	84.4	0	0	0	107.9
89	F	28	Very low	26.7	Very low	203 Å²	203	149.8 Å²	149.8	89%	0.89	79%	0.79	S	S	*	*			trans	-154.6	138.9	157.6	-95.5	-69.4	0	0	0	109.7
90	D	25.3	Very low	26.6	Very low	139 Å²	139	150.7 Å²	150.7	74%	0.743	79%	0.789	S	S	*	*			trans	-76.5	-179.2	172.5	-44.3	-80.4	0	0	0	110.2
91	S	28.8	Very low	26.7	Very low	94 Å²	94	153.7 Å²	153.7	66%	0.657	79%	0.79	S	S	*	*			cis	-147.6	-172.2	10.8	51.8	0	0	0	0	108.7
92	D	26	Very low	26.4	Very low	142 Å²	142	153.7 Å²	153.7	76%	0.759	78%	0.784	S	S	*	*			cis	-140.4	138.1	8.6	-69.2	-85.6	0	0	0	107.8
93	D	27.7	Very low	26.4	Very low	139 Å²	139	155.2 Å²	155.2	74%	0.743	78%	0.784	S	S	*	*				61.3	120.7	93	-164.1	34.3	0	0	0	118.5
94	L	28.7	Very low	26.6	Very low	165 Å²	165	155.7 Å²	155.7	86%	0.864	78%	0.783	S	S	*	*			trans	-177	133.1	131.5	-101.5	175.8	0	0	0	110.5
95	S	24.2	Very low	26.7	Very low	90 Å²	90	156.3 Å²	156.3	63%	0.629	78%	0.782	S	S	*	*			trans	-99.8	171.4	179.8	60.7	0	0	0	0	113.6
96	V	28.2	Very low	26.7	Very low	123 Å²	123	149.8 Å²	149.8	75%	0.745	78%	0.777	S	S	*	*				-166.7	145.1	116.4	159.5	0	0	0	0	108.8
97	E	25.4	Very low	26.7	Very low	140 Å²	140	144.8 Å²	144.8	65%	0.654	77%	0.77	S	S	*	*			trans	-65.7	164.9	-176.6	-52.6	91.2	-169.7	0	0	115.1
98	N	27.5	Very low	26.8	Very low	163 Å²	163	142.6 Å²	142.6	87%	0.872	76%	0.763	S	S	*	*				-157.6	152.5	102.7	-97	-79.8	0	0	0	109.9
99	E	26.7	Very low	26.9	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	77%	0.774	S	S	*	*			trans	-102.8	164.7	-174.8	-61.1	170.5	134.2	0	0	110.7
100	D	26.5	Very low	26.8	Very low	165 Å²	165	141.3 Å²	141.3	88%	0.882	76%	0.763	S	S	*	*				-174.6	150	129	-97.6	-21.4	0	0	0	111.3
101	E	29.4	Very low	26.9	Very low	179 Å²	179	141.8 Å²	141.8	84%	0.836	77%	0.765	S	S	*	*			trans	-92.5	178.6	-172.6	-39.1	170.9	131.1	0	0	110.6
102	D	25.6	Very low	26.8	Very low	121 Å²	121	148.4 Å²	148.4	65%	0.647	78%	0.776	S	S	*	*			cis	-161.9	-175	-1.9	-151.8	-9.3	0	0	0	110.8
103	F	25.6	Very low	26.7	Very low	194 Å²	194	145.3 Å²	145.3	85%	0.851	78%	0.778	S	S	*	*			trans	126.7	126.3	144.3	-77.5	-76.5	0	0	0	117.9
104	E	27.8	Very low	26.8	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	78%	0.784	S	S	*	*			trans	-112	170.8	-177	-59.5	-168.2	115.2	0	0	114.8
105	E	28	Very low	26.7	Very low	175 Å²	175	143.8 Å²	143.8	82%	0.818	78%	0.777	S	S	*	*			trans	66.1	164.9	152.1	-77	-131.5	115.7	0	0	118.6
106	A	26.1	Very low	28.1	Very low	94 Å²	94	144.7 Å²	144.7	78%	0.777	78%	0.781	S	S	*	*			cis	-136.9	-175.3	12.7	0	0	0	0	0	114.1
107	A	25.6	Very low	28	Very low	78 Å²	78	146 Å²	146	65%	0.645	79%	0.789	S	S	*	*			trans	-106.9	156.8	-159.8	0	0	0	0	0	117.6
108	V	26.7	Very low	28.2	Very low	121 Å²	121	144 Å²	144	73%	0.733	80%	0.797	S	S	*	*			trans	35.4	127	137.1	179.5	0	0	0	0	120.1
109	F	26.4	Very low	28.3	Very low	209 Å²	209	141.6 Å²	141.6	92%	0.917	79%	0.793	S	S	*	*			trans	-145.3	167.7	136.9	-110.5	-77.5	0	0	0	111.8
110	S	26.3	Very low	28.4	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	79%	0.787	S	S	*	*			trans	-146.6	170.4	-165.5	-69.4	0	0	0	0	114.4
111	L	28.1	Very low	28.4	Very low	150 Å²	150	138.1 Å²	138.1	79%	0.785	78%	0.784	S	S	*	*			trans	103.4	115.7	154.6	-69.4	158	0	0	0	121.1
112	R	25.9	Very low	28.3	Very low	233 Å²	233	134.1 Å²	134.1	88%	0.879	78%	0.776	S	S	*	*			trans	52.6	128.3	133.5	-80	-177.3	170.6	177.1	-2.7	122.2
113	G	25.5	Very low	28.5	Very low	77 Å²	77	135.5 Å²	135.5	79%	0.794	78%	0.783	S	S	*	*			trans	-141.5	161.7	147.7	0	0	0	0	0	110.1
114	L	28	Very low	29	Very low	169 Å²	169	135.1 Å²	135.1	89%	0.885	78%	0.784	S	S	*	*			trans	-126.5	161.8	-175.1	-83.2	160.1	0	0	0	112.6
115	S	28.2	Very low	29.3	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	79%	0.787	S	S	*	*			trans	-87	-167	177	63.4	0	0	0	0	112.2
116	P	52.8	Low	29.4	Very low	109 Å²	109	135.5 Å²	135.5	71%	0.708	78%	0.784	S	S	*	*			cis	-127.7	-171.4	-24.7	37.7	-21.1	0	0	0	112.3
117	T	27	Very low	29.9	Very low	150 Å²	150	138.7 Å²	138.7	92%	0.92	79%	0.787	S	S	*	*			trans	-174.3	173	133.6	18	0	0	0	0	110.9
118	A	28.6	Very low	30.3	Very low	99 Å²	99	140.6 Å²	140.6	82%	0.818	79%	0.79	S	S	*	*			trans	-145.9	153.6	-166.3	0	0	0	0	0	114.3
119	S	30.4	Very low	30.5	Very low	112 Å²	112	141 Å²	141	78%	0.783	79%	0.788	S	S	*	*			trans	-179.8	167.6	158.7	50.4	0	0	0	0	109.8
120	T	27.2	Very low	30.9	Very low	110 Å²	110	139.1 Å²	139.1	68%	0.675	78%	0.782	S	S	*	*			cis	-174	131.8	-34.6	-80.6	0	0	0	0	106.4
121	D	26.9	Very low	31.2	Very low	153 Å²	153	141.9 Å²	141.9	82%	0.818	79%	0.789	S	S	*	*			trans	61.7	156.6	167.3	-62.7	-13.7	0	0	0	116.9
122	S	28.3	Very low	31.5	Very low	95 Å²	95	143 Å²	143	66%	0.664	79%	0.787	S	S	*	*			cis	-155.1	-158.8	-13.9	49.3	0	0	0	0	109.9
123	D	28.3	Very low	31.8	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	79%	0.785	S	S	*	*			trans	92.2	100.5	158.8	-54.1	-3.1	0	0	0	118.2
124	E	37.3	Very low	32.1	Very low	186 Å²	186	142.2 Å²	142.2	87%	0.869	78%	0.782	S	S	*	*			trans	-85.5	110.4	160.5	-69.7	-170.4	149	0	0	110.7
125	E	34.5	Very low	32.3	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	78%	0.78	S	S	*	*			trans	-161.2	65.4	149.5	-140	178.3	-171.1	0	0	114.7
126	F	29.7	Very low	32.4	Very low	169 Å²	169	142.9 Å²	142.9	74%	0.741	78%	0.776	S	S	*	*			trans	-154.2	50.1	165.3	-133.6	-83.5	0	0	0	116
127	L	36	Very low	31.5	Very low	161 Å²	161	143.6 Å²	143.6	84%	0.843	78%	0.778	S	S	*	*			trans	-111	68.5	-178.9	-70.4	179	0	0	0	114
128	V	34.7	Very low	31.6	Very low	117 Å²	117	147.3 Å²	147.3	71%	0.709	78%	0.777	S	S	*	*	S	Bend	trans	-136.6	-48.3	165.1	-167.8	0	0	0	0	112.8	Q130	V128-Q130 PolarHBondContact O-N 3.46Å
129	D	31.3	Very low	31.9	Very low	129 Å²	129	150.1 Å²	150.1	69%	0.69	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-1.5	-163.8	-78.8	-34.5	0	0	0	117.2
130	Q	33.1	Very low	32.1	Very low	171 Å²	171	149.4 Å²	149.4	80%	0.799	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	5.6	177.3	-72.6	-165.8	83.4	0	0	115.2	V128	V128-Q130 PolarHBondContact O-N 3.46Å
131	L	34.3	Very low	32.6	Very low	152 Å²	152	150.1 Å²	150.1	80%	0.796	77%	0.773	S	S	*	*	S	Bend	trans	-95.6	25.7	-179.4	-78	170.6	0	0	0	114.7
132	K	33.3	Very low	34.2	Very low	174 Å²	174	150.7 Å²	150.7	76%	0.757	77%	0.77	S	S	*	*	S	Bend	trans	-121.7	-28.1	175.8	-80.7	178.9	177.5	168.1	0	115.9
133	D	31.6	Very low	35.8	Very low	155 Å²	155	150.6 Å²	150.6	83%	0.829	77%	0.766	S	S	*	*	S	Bend	trans	-91.6	6.4	-176.9	-71.4	-6	0	0	0	114.2	Q135	D133-Q135 PolarHBondContact O-N 3.49Å
134	L	33.1	Very low	38.3	Very low	138 Å²	138	148 Å²	148	72%	0.723	75%	0.749	S	S	*	*			trans	-89.2	30.3	168.1	-81.8	169	0	0	0	113.3	T136	L134-T136 PolarHBondContact O-N 2.71Å
135	Q	32.2	Very low	40.3	Very low	183 Å²	183	140.6 Å²	140.6	86%	0.855	72%	0.717	S	S	*	*			trans	-89.5	39.6	158.4	-67.3	-165.6	-17.4	0	0	111.5	D133 T137	D133-Q135 PolarHBondContact O-N 3.49Å; Q135-T137 PolarHBondContact O-N 3Å
136	T	30.9	Very low	42.5	Very low	103 Å²	103	133.6 Å²	133.6	63%	0.632	68%	0.682	S	S	*	*			trans	-57.8	132.8	158.3	23.2	0	0	0	0	109	L134 Y138	L134-T136 PolarHBondContact O-N 2.71Å; T136-Y138 PolarHBondContact O-N 3.36Å
137	T	33.4	Very low	44.9	Very low	124 Å²	124	130.6 Å²	130.6	76%	0.761	67%	0.671	S	S	*	*			trans	-54.5	107.2	-171.4	-46.3	0	0	0	0	111.7	Q135 E139	Q135-T137 PolarHBondContact O-N 3Å; T137-E139 HydrophobicContact CG2-CG 3.9Å; T137-E139 PolarHBondContact O-N 2.97Å
138	Y	29.1	Very low	47.2	Very low	227 Å²	227	127 Å²	127	89%	0.89	65%	0.651	S	S	*	*			trans	-72.4	77.2	162.9	-112.2	-93.2	0	0	0	108.2	T136 S140	T136-Y138 PolarHBondContact O-N 3.36Å; Y138-S140 VanDerWaalsContact C-N 3.34Å; Y138-S140 PolarHBondContact O-N 3.24Å
139	E	34.1	Very low	49.4	Very low	158 Å²	158	127.6 Å²	127.6	74%	0.738	65%	0.65	S	S	*	*			trans	-61.4	104.5	156.3	-72.8	-165.9	141.6	0	0	106.5	T137 T141	T137-E139 HydrophobicContact CG2-CG 3.9Å; T137-E139 PolarHBondContact O-N 2.97Å; E139-T141 VanDerWaalsContact C-N 3.3Å; E139-T141 PolarHBondContact O-N 3.46Å
140	S	34.9	Very low	52.2	Low	97 Å²	97	126.9 Å²	126.9	68%	0.678	64%	0.637	S	S	*	*			trans	-67.6	94.6	175	56.3	0	0	0	0	108.2	Y138 E142	Y138-S140 VanDerWaalsContact C-N 3.34Å; Y138-S140 PolarHBondContact O-N 3.24Å; S140-E142 PolarHBondContact O-N 2.88Å
141	T	38.6	Very low	55	Low	126 Å²	126	118.8 Å²	118.8	77%	0.773	60%	0.599	S	S	*	*			trans	-69.7	72.2	171.6	42.9	0	0	0	0	109.3	E139 T143	E139-T141 VanDerWaalsContact C-N 3.3Å; E139-T141 PolarHBondContact O-N 3.46Å; T141-T143 PolarHBondContact O-N 3.03Å; T141-T143 VanDerWaalsContact O-N 3.07Å
142	E	58.5	Low	57.7	Low	164 Å²	164	113.8 Å²	113.8	77%	0.766	57%	0.571	S	S	*	*			trans	-50	118.4	168.5	-71.9	-162.2	139	0	0	107.9	S140 E144	S140-E142 PolarHBondContact O-N 2.88Å; E142-E144 PolarHBondContact O-N 3.02Å
143	T	63.8	Low	60.6	Low	93 Å²	93	107.9 Å²	107.9	57%	0.571	55%	0.552	S	S	*	*			trans	-58.1	114.9	-172.6	-52	0	0	0	0	109.3	T141 V145 Q147	T141-T143 PolarHBondContact O-N 3.03Å; T141-T143 VanDerWaalsContact O-N 3.07Å; T143-V145 PolarHBondContact O-N 3.29Å; T143-Q147 HydrophobicContact CG2-CB 4Å
144	E	79.1	Confident	63.6	Low	95 Å²	95	104 Å²	104	44%	0.444	53%	0.529	S	S	.	.			trans	-52.5	134.3	-171.3	-53.9	175.9	127.9	0	0	110	E142 W146 Q147	E142-E144 PolarHBondContact O-N 3.02Å; E144-W146 HydrophobicContact CB-CD2 4.13Å; E144-W146 HydrophobicContact CB-CG 4.49Å; E144-W146 HydrophobicContact CB-CH2 4.49Å; E144-W146 HydrophobicContact CB-CZ2 3.79Å; E144-W146 VanDerWaalsContact CD-CZ2 3.44Å; E144-W146 HydrophobicContact CG-CZ2 4Å; E144-W146 PolarHBondContact O-N 3.33Å; E144-W146 WeakPolarHBondContact OE1-CZ2 3.29Å; E144-W146 PolarHBondContact OE2-NE1 3.41Å; E144-Q147 HydrophobicContact CB-CG 4.13Å; E144-Q147 WeakPolarHBondContact O-CA 3.28Å; E144-Q147 VanDerWaalsContact O-CB 3.26Å; E144-Q147 WeakPolarHBondContact O-CB 3.36Å; E144-Q147 PolarHBondContact O-N 3.47Å; E144-Q147 PolarHBondContact OE2-NE2 3.24Å
145	V	79.3	Confident	66.6	Low	31 Å²	31	97.5 Å²	97.5	19%	0.188	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-63.8	-21.2	-163.1	178.1	0	0	0	0	113.6	T143 Q147 M148 W150 Q198	T143-V145 PolarHBondContact O-N 3.29Å; V145-Q147 VanDerWaalsContact C-N 3.3Å; V145-Q147 PolarHBondContact O-N 3.2Å; V145-M148 HydrophobicContact CG1-SD 4.19Å; V145-M148 WeakPolarHBondContact O-CB 3.23Å; V145-M148 PolarHBondContact O-N 3.42Å; V145-W150 HydrophobicContact CG1-CH2 3.69Å; V145-W150 HydrophobicContact CG1-CZ2 3.32Å; V145-Q198 HydrophobicContact CB-CG 3.83Å; V145-Q198 HydrophobicContact CG1-CB 4.44Å; V145-Q198 HydrophobicContact CG1-CG 3.9Å; V145-Q198 HydrophobicContact CG2-CG 3.64Å
146	W	81.4	Confident	69.7	Low	39 Å²	39	88.9 Å²	88.9	15%	0.148	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-75.4	-11.9	172.4	49	77.2	0	0	0	115.4	E144 M148 H151 S276 H278 T362 T363 L404	E144-W146 HydrophobicContact CB-CD2 4.13Å; E144-W146 HydrophobicContact CB-CG 4.49Å; E144-W146 HydrophobicContact CB-CH2 4.49Å; E144-W146 HydrophobicContact CB-CZ2 3.79Å; E144-W146 VanDerWaalsContact CD-CZ2 3.44Å; E144-W146 HydrophobicContact CG-CZ2 4Å; E144-W146 PolarHBondContact O-N 3.33Å; E144-W146 WeakPolarHBondContact OE1-CZ2 3.29Å; E144-W146 PolarHBondContact OE2-NE1 3.41Å; W146-M148 VanDerWaalsContact C-N 3.34Å; W146-H151 VanDerWaalsContact CB-CE1 3.45Å; W146-H151 WeakPolarHBondContact CB-CE1 3.47Å; W146-S276 WeakPolarHBondContact CZ3-OG 3.35Å; W146-H278 AromaticContact CD2-CE1 3.57Å; W146-H278 AromaticContact CE3-CE1 3.48Å; W146-H278 VanDerWaalsContact CE3-CE1 3.48Å; W146-H278 AromaticContact CE3-NE2 3.62Å; W146-H278 AromaticContact CG-CE1 3.78Å; W146-H278 AromaticContact CZ3-NE2 4Å; W146-T362 HydrophobicContact CD2-CG2 4.12Å; W146-T362 HydrophobicContact CG-CG2 4.47Å; W146-T362 HydrophobicContact CZ2-CG2 3.86Å; W146-T363 HydrophobicContact CB-CG2 3.71Å; W146-T363 HydrophobicContact CG-CG2 3.75Å; W146-L404 WeakPolarHBondContact O-CD1 3.42Å
147	Q	79.6	Confident	72.8	Confident	106 Å²	106	86.5 Å²	86.5	50%	0.495	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-81.8	-14.1	169.5	-54.2	178	19.5	0	0	111.9	T143 E144 V145	T143-Q147 HydrophobicContact CG2-CB 4Å; E144-Q147 HydrophobicContact CB-CG 4.13Å; E144-Q147 WeakPolarHBondContact O-CA 3.28Å; E144-Q147 VanDerWaalsContact O-CB 3.26Å; E144-Q147 WeakPolarHBondContact O-CB 3.36Å; E144-Q147 PolarHBondContact O-N 3.47Å; E144-Q147 PolarHBondContact OE2-NE2 3.24Å; V145-Q147 VanDerWaalsContact C-N 3.3Å; V145-Q147 PolarHBondContact O-N 3.2Å
148	M	83.9	Confident	75.8	Confident	86 Å²	86	82.4 Å²	82.4	42%	0.424	42%	0.419	S	S	.	.	S	Bend	trans	-74	141.3	179.5	-56.4	-171.6	88.9	0	0	112.3	V145 W146 W150 H151	V145-M148 HydrophobicContact CG1-SD 4.19Å; V145-M148 WeakPolarHBondContact O-CB 3.23Å; V145-M148 PolarHBondContact O-N 3.42Å; W146-M148 VanDerWaalsContact C-N 3.34Å; M148-W150 HydrophobicContact CB-CG 4.5Å; M148-W150 PolarHBondContact O-N 3.32Å; M148-W150 HydrophobicContact SD-CZ2 4.34Å; M148-W150 PolarHBondContact SD-NE1 3.27Å; M148-H151 WeakPolarHBondContact O-CB 3.43Å; M148-H151 PolarHBondContact O-N 2.72Å
149	D	81.9	Confident	79.1	Confident	129 Å²	129	71.6 Å²	71.6	69%	0.69	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.9	-174.9	-102.1	-49.2	0	0	0	115.1	K152	D149-K152 WeakPolarHBondContact O-CE 3.32Å; D149-K152 WeakPolarHBondContact O-CG 3.12Å; D149-K152 PolarHBondContact O-NZ 3.02Å; D149-K152 IonicContact OD1-NZ 2.67Å; D149-K152 PolarHBondContact OD1-NZ 3.15Å
150	W	89.1	Confident	82.1	Confident	114 Å²	114	65 Å²	65	43%	0.432	35%	0.348	S	S	.	.	H	α-helix	trans	-77.9	-20	-178.5	64.6	-96.2	0	0	0	114.1	V145 M148 K152 S153 H154 Y200	V145-W150 HydrophobicContact CG1-CH2 3.69Å; V145-W150 HydrophobicContact CG1-CZ2 3.32Å; M148-W150 HydrophobicContact CB-CG 4.5Å; M148-W150 PolarHBondContact O-N 3.32Å; M148-W150 HydrophobicContact SD-CZ2 4.34Å; M148-W150 PolarHBondContact SD-NE1 3.27Å; W150-K152 VanDerWaalsContact C-N 3.33Å; W150-K152 PolarHBondContact O-N 3.1Å; W150-S153 PolarHBondContact O-N 3.46Å; W150-H154 HydrophobicContact CE3-CB 3.79Å; W150-H154 HydrophobicContact CZ3-CB 4.03Å; W150-H154 WeakPolarHBondContact O-CB 3.38Å; W150-H154 PolarHBondContact O-N 2.7Å; W150-Y200 AromaticContact CH2-CE2 3.76Å; W150-Y200 HydrophobicContact CH2-CE2 3.76Å; W150-Y200 AromaticContact CH2-CZ 3.94Å; W150-Y200 WeakPolarHBondContact CH2-OH 3.35Å; W150-Y200 AromaticContact CZ3-CE2 3.89Å; W150-Y200 HydrophobicContact CZ3-CE2 3.89Å; W150-Y200 AromaticContact CZ3-CZ 3.79Å; W150-Y200 WeakPolarHBondContact CZ3-OH 3.44Å
151	H	92.3	Very high	85.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-57.4	-44.4	-177.1	167.3	89.7	0	0	0	111.9	W146 M148 S153 H154 M155 Y200 H278 T363	W146-H151 VanDerWaalsContact CB-CE1 3.45Å; W146-H151 WeakPolarHBondContact CB-CE1 3.47Å; M148-H151 WeakPolarHBondContact O-CB 3.43Å; M148-H151 PolarHBondContact O-N 2.72Å; H151-S153 PolarHBondContact O-N 2.86Å; H151-H154 PolarHBondContact O-N 2.9Å; H151-M155 VanDerWaalsContact O-CB 3.3Å; H151-M155 WeakPolarHBondContact O-CB 3.36Å; H151-M155 VanDerWaalsContact O-CG 3.26Å; H151-M155 WeakPolarHBondContact O-CG 3.47Å; H151-M155 PolarHBondContact O-N 2.85Å; H151-Y200 AromaticContact ND1-CE1 3.55Å; H151-Y200 AromaticContact ND1-CZ 3.68Å; H151-Y200 PolarHBondContact ND1-OH 2.9Å; H151-H278 AromaticContact CE1-ND1 3.86Å; H151-T363 PolarHBondContact NE2-OG1 2.8Å; H151-T363 VanDerWaalsContact NE2-OG1 3.07Å
152	K	92.4	Very high	87.9	Confident	48 Å²	48	62.9 Å²	62.9	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-57.9	-49.8	179.8	42.4	163.9	174.5	-82	0	112.8	D149 W150 A156 V365 P405	D149-K152 WeakPolarHBondContact O-CE 3.32Å; D149-K152 WeakPolarHBondContact O-CG 3.12Å; D149-K152 PolarHBondContact O-NZ 3.02Å; D149-K152 IonicContact OD1-NZ 2.67Å; D149-K152 PolarHBondContact OD1-NZ 3.15Å; W150-K152 VanDerWaalsContact C-N 3.33Å; W150-K152 PolarHBondContact O-N 3.1Å; K152-A156 PolarHBondContact O-N 2.64Å; K152-A156 VanDerWaalsContact O-N 3.15Å; K152-V365 HydrophobicContact CB-CG1 4.18Å; K152-P405 WeakPolarHBondContact CD-O 3.5Å
153	S	93.4	Very high	89.7	Confident	50 Å²	50	55.2 Å²	55.2	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-75.4	-31.1	-179.2	-55.5	0	0	0	0	112	W150 H151 A156 A157 D407	W150-S153 PolarHBondContact O-N 3.46Å; H151-S153 PolarHBondContact O-N 2.86Å; S153-A156 PolarHBondContact O-N 2.98Å; S153-A157 VanDerWaalsContact O-CB 3.3Å; S153-A157 WeakPolarHBondContact O-CB 3.24Å; S153-A157 PolarHBondContact O-N 3.26Å; S153-D407 WeakPolarHBondContact CB-OD2 3.4Å; S153-D407 PolarHBondContact OG-OD2 3.07Å
154	H	95.1	Very high	91.3	Very high	74 Å²	74	53.4 Å²	53.4	34%	0.343	27%	0.268	S	S	.	.	H	α-helix	trans	-67.5	-44.4	173.2	-173.7	77.4	0	0	0	112.3	W150 H151 A156 A157 L158 Y200	W150-H154 HydrophobicContact CE3-CB 3.79Å; W150-H154 HydrophobicContact CZ3-CB 4.03Å; W150-H154 WeakPolarHBondContact O-CB 3.38Å; W150-H154 PolarHBondContact O-N 2.7Å; H151-H154 PolarHBondContact O-N 2.9Å; H154-A156 VanDerWaalsContact C-N 3.3Å; H154-A156 PolarHBondContact O-N 2.82Å; H154-A157 PolarHBondContact O-N 3.49Å; H154-L158 VanDerWaalsContact O-CB 3.23Å; H154-L158 WeakPolarHBondContact O-CB 3.38Å; H154-L158 PolarHBondContact O-N 3.29Å; H154-Y200 AromaticContact CD2-CD1 3.55Å; H154-Y200 AromaticContact CD2-CE1 3.71Å; H154-Y200 AromaticContact CD2-CG 3.72Å; H154-Y200 AromaticContact NE2-CG 3.73Å
155	M	96.5	Very high	92.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57	-42.4	172.7	-79	-73.1	-68.3	0	0	112.1	H151 S159 V184 Y200 H278 V365	H151-M155 VanDerWaalsContact O-CB 3.3Å; H151-M155 WeakPolarHBondContact O-CB 3.36Å; H151-M155 VanDerWaalsContact O-CG 3.26Å; H151-M155 WeakPolarHBondContact O-CG 3.47Å; H151-M155 PolarHBondContact O-N 2.85Å; M155-S159 VanDerWaalsContact O-CB 3.23Å; M155-S159 WeakPolarHBondContact O-CB 3.14Å; M155-S159 PolarHBondContact O-N 3.31Å; M155-S159 VanDerWaalsContact O-N 3.17Å; M155-S159 PolarHBondContact O-OG 3.06Å; M155-V184 HydrophobicContact CE-CB 3.9Å; M155-V184 HydrophobicContact CE-CG2 3.73Å; M155-V184 HydrophobicContact SD-CB 3.83Å; M155-V184 HydrophobicContact SD-CG1 3.92Å; M155-V184 HydrophobicContact SD-CG2 3.85Å; M155-Y200 HydrophobicContact CG-CD1 4.48Å; M155-Y200 HydrophobicContact CG-CE1 4.07Å; M155-Y200 HydrophobicContact SD-CD1 3.93Å; M155-Y200 HydrophobicContact SD-CE1 3.98Å; M155-H278 HydrophobicContact CE-CB 3.56Å; M155-H278 HydrophobicContact SD-CB 4.21Å; M155-V365 HydrophobicContact CB-CB 4.27Å; M155-V365 HydrophobicContact CB-CG1 4.41Å; M155-V365 HydrophobicContact CB-CG2 3.89Å; M155-V365 HydrophobicContact CG-CG2 4.01Å
156	A	95.8	Very high	93	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-66.7	-49	176.7	0	0	0	0	0	112.1	K152 S153 H154 S159 S160 Y280 V409	K152-A156 PolarHBondContact O-N 2.64Å; K152-A156 VanDerWaalsContact O-N 3.15Å; S153-A156 PolarHBondContact O-N 2.98Å; H154-A156 VanDerWaalsContact C-N 3.3Å; H154-A156 PolarHBondContact O-N 2.82Å; A156-S159 PolarHBondContact O-N 2.9Å; A156-S160 WeakPolarHBondContact O-CB 3.33Å; A156-S160 PolarHBondContact O-N 3.33Å; A156-Y280 HydrophobicContact CB-CD2 4.06Å; A156-Y280 HydrophobicContact CB-CE2 3.48Å; A156-Y280 VanDerWaalsContact CB-CE2 3.48Å; A156-V409 HydrophobicContact CB-CG1 4.05Å
157	A	96.6	Very high	93.6	Very high	53 Å²	53	50 Å²	50	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-49.8	-179.8	0	0	0	0	0	112.4	S153 H154 S159 S160 E161	S153-A157 VanDerWaalsContact O-CB 3.3Å; S153-A157 WeakPolarHBondContact O-CB 3.24Å; S153-A157 PolarHBondContact O-N 3.26Å; H154-A157 PolarHBondContact O-N 3.49Å; A157-S159 VanDerWaalsContact C-N 3.31Å; A157-S159 PolarHBondContact O-N 3.11Å; A157-S160 WeakPolarHBondContact O-CB 3.49Å; A157-S160 PolarHBondContact O-N 3.02Å; A157-S160 VanDerWaalsContact O-N 3.15Å; A157-E161 WeakPolarHBondContact O-CB 3.38Å; A157-E161 PolarHBondContact O-N 3.23Å
158	L	97.1	Very high	94.4	Very high	38 Å²	38	53.8 Å²	53.8	20%	0.199	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-39.5	178.9	-177.1	70.2	0	0	0	111.9	H154 K162 V184 V202	H154-L158 VanDerWaalsContact O-CB 3.23Å; H154-L158 WeakPolarHBondContact O-CB 3.38Å; H154-L158 PolarHBondContact O-N 3.29Å; L158-K162 WeakPolarHBondContact O-CB 3.28Å; L158-K162 PolarHBondContact O-N 2.72Å; L158-K162 VanDerWaalsContact O-N 3.12Å; L158-V184 HydrophobicContact CD2-CG1 4.27Å; L158-V202 HydrophobicContact CD2-CG2 4Å; L158-V202 HydrophobicContact CG-CG2 3.79Å
159	S	97.8	Very high	94.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.4	-42.1	175.2	-60	0	0	0	0	111.6	M155 A156 A157 F163 M205 Y280	M155-S159 VanDerWaalsContact O-CB 3.23Å; M155-S159 WeakPolarHBondContact O-CB 3.14Å; M155-S159 PolarHBondContact O-N 3.31Å; M155-S159 VanDerWaalsContact O-N 3.17Å; M155-S159 PolarHBondContact O-OG 3.06Å; A156-S159 PolarHBondContact O-N 2.9Å; A157-S159 VanDerWaalsContact C-N 3.31Å; A157-S159 PolarHBondContact O-N 3.11Å; S159-F163 PolarHBondContact O-N 3.46Å; S159-M205 VanDerWaalsContact O-CE 3.26Å; S159-M205 WeakPolarHBondContact O-CE 3.35Å; S159-Y280 WeakPolarHBondContact OG-CB 3.43Å
160	S	97.2	Very high	95.4	Very high	20 Å²	20	53.7 Å²	53.7	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-58.8	-58.8	175	-174.2	0	0	0	0	111.2	A156 A157 K162 F163 D164 K177	A156-S160 WeakPolarHBondContact O-CB 3.33Å; A156-S160 PolarHBondContact O-N 3.33Å; A157-S160 WeakPolarHBondContact O-CB 3.49Å; A157-S160 PolarHBondContact O-N 3.02Å; A157-S160 VanDerWaalsContact O-N 3.15Å; S160-K162 VanDerWaalsContact C-N 3.27Å; S160-K162 PolarHBondContact O-N 2.93Å; S160-F163 WeakPolarHBondContact O-CA 3.27Å; S160-F163 VanDerWaalsContact O-CB 3.31Å; S160-F163 WeakPolarHBondContact O-CB 3.45Å; S160-F163 PolarHBondContact O-N 3.13Å; S160-D164 PolarHBondContact O-N 3.39Å; S160-D164 PolarHBondContact OG-OD2 3.07Å; S160-K177 PolarHBondContact OG-NZ 3.43Å
161	E	97.6	Very high	95.6	Very high	124 Å²	124	52.6 Å²	52.6	58%	0.579	27%	0.268	S	S	*	.	H	α-helix	trans	-56.6	-43.2	-175.9	-176	-174.2	-179.2	0	0	110.9	A157 F163 D164 V165	A157-E161 WeakPolarHBondContact O-CB 3.38Å; A157-E161 PolarHBondContact O-N 3.23Å; E161-F163 VanDerWaalsContact C-N 3.31Å; E161-F163 PolarHBondContact O-N 3.42Å; E161-D164 PolarHBondContact O-N 3.19Å; E161-V165 HydrophobicContact CG-CG2 4.36Å; E161-V165 WeakPolarHBondContact O-CB 3.44Å; E161-V165 WeakPolarHBondContact O-CG2 3.39Å; E161-V165 PolarHBondContact O-N 3.15Å
162	K	97.9	Very high	95.6	Very high	54 Å²	54	58.8 Å²	58.8	24%	0.235	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-34.5	177.9	-177.3	54.2	-178.5	159.9	0	112.6	L158 S160 L166 V202 M205 W425	L158-K162 WeakPolarHBondContact O-CB 3.28Å; L158-K162 PolarHBondContact O-N 2.72Å; L158-K162 VanDerWaalsContact O-N 3.12Å; S160-K162 VanDerWaalsContact C-N 3.27Å; S160-K162 PolarHBondContact O-N 2.93Å; K162-L166 HydrophobicContact CD-CD1 4.4Å; K162-L166 HydrophobicContact CD-CG 4.44Å; K162-L166 HydrophobicContact CG-CD1 4.41Å; K162-L166 WeakPolarHBondContact O-CD1 3.42Å; K162-L166 VanDerWaalsContact O-CG 3.24Å; K162-L166 WeakPolarHBondContact O-CG 3.38Å; K162-L166 PolarHBondContact O-N 2.95Å; K162-V202 HydrophobicContact CB-CB 4.45Å; K162-V202 HydrophobicContact CB-CG2 4.14Å; K162-V202 HydrophobicContact CG-CB 4.1Å; K162-V202 HydrophobicContact CG-CG1 4.02Å; K162-V202 HydrophobicContact CG-CG2 4.34Å; K162-M205 HydrophobicContact CB-CE 4.03Å; K162-M205 HydrophobicContact CG-CE 4.07Å; K162-W425 VanDerWaalsContact CE-CZ2 3.41Å; K162-W425 VanDerWaalsContact CE-CZ3 3.46Å; K162-W425 HydrophobicContact CG-CZ3 4.46Å
163	F	96.9	Very high	95.6	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-42.8	173.1	-155.9	-81.8	0	0	0	111.2	S159 S160 E161 L166 L167 K177 M180 M205 A207 I423	S159-F163 PolarHBondContact O-N 3.46Å; S160-F163 WeakPolarHBondContact O-CA 3.27Å; S160-F163 VanDerWaalsContact O-CB 3.31Å; S160-F163 WeakPolarHBondContact O-CB 3.45Å; S160-F163 PolarHBondContact O-N 3.13Å; E161-F163 VanDerWaalsContact C-N 3.31Å; E161-F163 PolarHBondContact O-N 3.42Å; F163-L166 PolarHBondContact O-N 3.02Å; F163-L167 HydrophobicContact CD1-CD1 3.86Å; F163-L167 HydrophobicContact CD1-CG 4.08Å; F163-L167 HydrophobicContact CE1-CD1 3.35Å; F163-L167 HydrophobicContact CE1-CG 3.95Å; F163-L167 HydrophobicContact CZ-CD1 4.27Å; F163-L167 PolarHBondContact O-N 3.33Å; F163-K177 HydrophobicContact CD1-CB 3.82Å; F163-K177 HydrophobicContact CD1-CD 3.79Å; F163-K177 HydrophobicContact CD1-CG 3.59Å; F163-K177 HydrophobicContact CE1-CB 3.43Å; F163-K177 VanDerWaalsContact CE1-CB 3.43Å; F163-K177 HydrophobicContact CE1-CD 4.31Å; F163-K177 HydrophobicContact CE1-CG 3.73Å; F163-K177 HydrophobicContact CG-CD 4.37Å; F163-K177 HydrophobicContact CG-CG 4.09Å; F163-K177 HydrophobicContact CZ-CB 4.06Å; F163-K177 HydrophobicContact CZ-CG 4.37Å; F163-M180 HydrophobicContact CB-CE 4.09Å; F163-M180 HydrophobicContact CB-SD 4.13Å; F163-M180 HydrophobicContact CD2-CB 4.08Å; F163-M180 HydrophobicContact CD2-CE 3.77Å; F163-M180 HydrophobicContact CD2-SD 3.77Å; F163-M180 HydrophobicContact CE2-CB 3.81Å; F163-M180 HydrophobicContact CE2-SD 4.38Å; F163-M180 HydrophobicContact CG-CE 4.23Å; F163-M180 HydrophobicContact CG-SD 3.97Å; F163-M180 HydrophobicContact CZ-CB 4.48Å; F163-M205 HydrophobicContact CB-CE 4.04Å; F163-M205 HydrophobicContact CB-SD 3.98Å; F163-M205 HydrophobicContact CD2-CE 4.15Å; F163-M205 HydrophobicContact CD2-CG 3.98Å; F163-M205 HydrophobicContact CD2-SD 3.46Å; F163-M205 WeakPolarHBondContact CD2-SD 3.1Å; F163-M205 HydrophobicContact CE2-CG 4.39Å; F163-M205 HydrophobicContact CE2-SD 4.32Å; F163-M205 HydrophobicContact CG-SD 4.1Å; F163-A207 HydrophobicContact CE2-CB 3.74Å; F163-A207 HydrophobicContact CZ-CB 3.75Å; F163-I423 HydrophobicContact CZ-CD1 4.18Å
164	D	96.9	Very high	95.6	Very high	54 Å²	54	60.3 Å²	60.3	29%	0.289	30%	0.3	S	S	.	.	H	α-helix	trans	-70.2	-35.2	-177.5	-60	-34	0	0	0	112.5	S160 E161 R168 Y174 K177	S160-D164 PolarHBondContact O-N 3.39Å; S160-D164 PolarHBondContact OG-OD2 3.07Å; E161-D164 PolarHBondContact O-N 3.19Å; D164-R168 PolarHBondContact O-N 3.32Å; D164-R168 VanDerWaalsContact O-N 3.13Å; D164-Y174 WeakPolarHBondContact OD1-CE2 3.47Å; D164-K177 WeakPolarHBondContact OD1-CE 3.45Å; D164-K177 IonicContact OD1-NZ 2.73Å; D164-K177 PolarHBondContact OD1-NZ 3.28Å; D164-K177 IonicContact OD2-NZ 2.65Å; D164-K177 PolarHBondContact OD2-NZ 3.47Å
165	V	97.1	Very high	95.5	Very high	66 Å²	66	57.5 Å²	57.5	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-65.6	-40.9	171.2	168.6	0	0	0	0	111.2	E161	E161-V165 HydrophobicContact CG-CG2 4.36Å; E161-V165 WeakPolarHBondContact O-CB 3.44Å; E161-V165 WeakPolarHBondContact O-CG2 3.39Å; E161-V165 PolarHBondContact O-N 3.15Å
166	L	96.4	Very high	95.4	Very high	20 Å²	20	57.6 Å²	57.6	11%	0.105	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-32.1	177.9	-74.7	169.9	0	0	0	112.9	K162 F163 M205 W425 I432	K162-L166 HydrophobicContact CD-CD1 4.4Å; K162-L166 HydrophobicContact CD-CG 4.44Å; K162-L166 HydrophobicContact CG-CD1 4.41Å; K162-L166 WeakPolarHBondContact O-CD1 3.42Å; K162-L166 VanDerWaalsContact O-CG 3.24Å; K162-L166 WeakPolarHBondContact O-CG 3.38Å; K162-L166 PolarHBondContact O-N 2.95Å; F163-L166 PolarHBondContact O-N 3.02Å; L166-M205 HydrophobicContact CD1-SD 3.82Å; L166-W425 HydrophobicContact CD1-CB 3.91Å; L166-W425 HydrophobicContact CD1-CD2 3.74Å; L166-W425 HydrophobicContact CD1-CE3 4.06Å; L166-W425 HydrophobicContact CD1-CG 3.66Å; L166-W425 HydrophobicContact CD2-CD2 4.23Å; L166-W425 HydrophobicContact CD2-CG 3.97Å; L166-I432 HydrophobicContact CB-CG2 3.85Å; L166-I432 HydrophobicContact CD1-CG2 4.39Å; L166-I432 HydrophobicContact CD2-CG2 4.17Å; L166-I432 HydrophobicContact CG-CG2 4.36Å
167	L	95	Very high	95.4	Very high	8 Å²	8	57.7 Å²	57.7	4%	0.042	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	4.5	178.6	-62.4	-161.3	0	0	0	114.8	F163 M169 Y170 F173 I423 I432	F163-L167 HydrophobicContact CD1-CD1 3.86Å; F163-L167 HydrophobicContact CD1-CG 4.08Å; F163-L167 HydrophobicContact CE1-CD1 3.35Å; F163-L167 HydrophobicContact CE1-CG 3.95Å; F163-L167 HydrophobicContact CZ-CD1 4.27Å; F163-L167 PolarHBondContact O-N 3.33Å; L167-M169 PolarHBondContact O-N 3.49Å; L167-M169 VanDerWaalsContact O-N 3.12Å; L167-Y170 CarbonylContact O-C 3.04Å; L167-Y170 VanDerWaalsContact O-C 3.28Å; L167-Y170 PolarHBondContact O-N 2.81Å; L167-F173 HydrophobicContact CD1-CB 4.25Å; L167-F173 WeakPolarHBondContact CD1-O 3.37Å; L167-F173 HydrophobicContact CD2-CB 4.31Å; L167-I423 HydrophobicContact CD1-CD1 4.19Å; L167-I423 HydrophobicContact CD2-CD1 4.11Å; L167-I432 HydrophobicContact CD2-CD1 3.41Å; L167-I432 VanDerWaalsContact CD2-CD1 3.41Å; L167-I432 HydrophobicContact CD2-CG2 4.43Å
168	R	94.6	Very high	95.2	Very high	186 Å²	186	55.4 Å²	55.4	70%	0.702	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-34.2	-178.5	-176.9	177.4	-66.2	-178.1	0.1	113.8	D164	D164-R168 PolarHBondContact O-N 3.32Å; D164-R168 VanDerWaalsContact O-N 3.13Å
169	M	93.8	Very high	95.1	Very high	142 Å²	142	54.7 Å²	54.7	70%	0.7	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.2	178	-59	-54.2	-60.6	0	0	113.4	L167	L167-M169 PolarHBondContact O-N 3.49Å; L167-M169 VanDerWaalsContact O-N 3.12Å
170	Y	94.2	Very high	95	Very high	71 Å²	71	54.7 Å²	54.7	28%	0.278	27%	0.268	S	S	.	.			trans	-135.6	59.3	-170.2	-49.9	-64.7	0	0	0	111.8	L167 D172 F173 D431 I432 P447	L167-Y170 CarbonylContact O-C 3.04Å; L167-Y170 VanDerWaalsContact O-C 3.28Å; L167-Y170 PolarHBondContact O-N 2.81Å; Y170-D172 PolarHBondContact O-N 3.15Å; Y170-F173 PolarHBondContact O-N 3.41Å; Y170-F173 VanDerWaalsContact O-N 3.13Å; Y170-D431 WeakPolarHBondContact CE2-OD1 3.38Å; Y170-D431 WeakPolarHBondContact CE2-OD2 3.27Å; Y170-D431 PolarHBondContact OH-OD2 3.16Å; Y170-I432 HydrophobicContact CD2-CD1 4.15Å; Y170-P447 HydrophobicContact CD1-CG 3.74Å; Y170-P447 HydrophobicContact CD2-CB 4.41Å; Y170-P447 HydrophobicContact CD2-CG 3.76Å; Y170-P447 HydrophobicContact CE1-CB 4.1Å; Y170-P447 HydrophobicContact CE1-CG 3.63Å; Y170-P447 HydrophobicContact CE2-CB 3.82Å; Y170-P447 HydrophobicContact CE2-CG 3.65Å; Y170-P447 HydrophobicContact CG-CG 3.82Å
171	P	92.4	Very high	95	Very high	90 Å²	90	53.8 Å²	53.8	58%	0.584	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28.4	-174.5	26.2	-35.7	0	0	0	113.2	F173 Y174	P171-F173 PolarHBondContact O-N 2.91Å; P171-F173 VanDerWaalsContact O-N 3.11Å; P171-Y174 WeakPolarHBondContact O-CB 3.46Å; P171-Y174 PolarHBondContact O-N 2.88Å
172	D	92.5	Very high	95.1	Very high	131 Å²	131	47.9 Å²	47.9	70%	0.701	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-60.7	-21	178.5	-57.2	-25.5	0	0	0	113.2	Y170 H418	Y170-D172 PolarHBondContact O-N 3.15Å; D172-H418 PolarHBondContact O-CE1 2.88Å
173	F	93.6	Very high	95.1	Very high	35 Å²	35	45.3 Å²	45.3	15%	0.154	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-94.3	0.1	175.6	-56.9	-45.8	0	0	0	113.6	L167 Y170 P171 G175 C176 L421 I423 I432 V434 P447	L167-F173 HydrophobicContact CD1-CB 4.25Å; L167-F173 WeakPolarHBondContact CD1-O 3.37Å; L167-F173 HydrophobicContact CD2-CB 4.31Å; Y170-F173 PolarHBondContact O-N 3.41Å; Y170-F173 VanDerWaalsContact O-N 3.13Å; P171-F173 PolarHBondContact O-N 2.91Å; P171-F173 VanDerWaalsContact O-N 3.11Å; F173-G175 VanDerWaalsContact C-N 3.26Å; F173-G175 PolarHBondContact O-N 2.79Å; F173-C176 VanDerWaalsContact O-CB 3.25Å; F173-C176 WeakPolarHBondContact O-CB 3.3Å; F173-C176 PolarHBondContact O-N 3.15Å; F173-C176 PolarHBondContact O-SG 3.05Å; F173-L421 HydrophobicContact CD1-CD1 4.16Å; F173-L421 HydrophobicContact CE1-CD1 4.45Å; F173-I423 HydrophobicContact CB-CD1 3.83Å; F173-I432 HydrophobicContact CD2-CD1 4.14Å; F173-V434 HydrophobicContact CD1-CG1 4.33Å; F173-V434 HydrophobicContact CD2-CG2 3.89Å; F173-V434 HydrophobicContact CE1-CG1 4.16Å; F173-V434 HydrophobicContact CE2-CG2 3.88Å; F173-V434 HydrophobicContact CG-CG2 4.25Å; F173-V434 HydrophobicContact CZ-CG1 4.46Å; F173-V434 HydrophobicContact CZ-CG2 4.2Å; F173-P447 HydrophobicContact CE2-CG 4.39Å
174	Y	93.1	Very high	95.2	Very high	94 Å²	94	45.1 Å²	45.1	37%	0.369	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-59.3	-33.9	-176.1	-175.5	-103.6	0	0	0	113.4	D164 P171 C176 K177 P411	D164-Y174 WeakPolarHBondContact OD1-CE2 3.47Å; P171-Y174 WeakPolarHBondContact O-CB 3.46Å; P171-Y174 PolarHBondContact O-N 2.88Å; Y174-C176 PolarHBondContact O-N 3.17Å; Y174-C176 VanDerWaalsContact O-N 3.16Å; Y174-K177 HydrophobicContact CD2-CD 4.42Å; Y174-K177 HydrophobicContact CE2-CD 3.67Å; Y174-K177 WeakPolarHBondContact O-CB 3.46Å; Y174-K177 PolarHBondContact O-N 3.24Å; Y174-P411 HydrophobicContact CE1-CB 4.2Å
175	G	92.9	Very high	95.3	Very high	15 Å²	15	43.1 Å²	43.1	16%	0.155	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-60.8	-23.5	177	0	0	0	0	0	114.4	F173 K177 S178	F173-G175 VanDerWaalsContact C-N 3.26Å; F173-G175 PolarHBondContact O-N 2.79Å; G175-K177 PolarHBondContact O-N 2.98Å; G175-S178 VanDerWaalsContact O-CB 3.29Å; G175-S178 WeakPolarHBondContact O-CB 3.35Å; G175-S178 PolarHBondContact O-N 2.99Å; G175-S178 VanDerWaalsContact O-N 3.16Å; G175-S178 PolarHBondContact O-OG 3.09Å
176	C	94.4	Very high	95.3	Very high	3 Å²	3	40 Å²	40	2%	0.02	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-61.5	-26	172	-61.8	0	0	0	0	112.5	F173 Y174 S178 H179 A207 I423	F173-C176 VanDerWaalsContact O-CB 3.25Å; F173-C176 WeakPolarHBondContact O-CB 3.3Å; F173-C176 PolarHBondContact O-N 3.15Å; F173-C176 PolarHBondContact O-SG 3.05Å; Y174-C176 PolarHBondContact O-N 3.17Å; Y174-C176 VanDerWaalsContact O-N 3.16Å; C176-S178 PolarHBondContact O-N 2.72Å; C176-H179 PolarHBondContact O-N 2.73Å; C176-A207 HydrophobicContact CB-CB 4.28Å; C176-I423 HydrophobicContact CB-CD1 3.51Å; C176-I423 HydrophobicContact CB-CG1 3.86Å
177	K	95	Very high	95.2	Very high	4 Å²	4	40 Å²	40	2%	0.017	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-57.6	-21	175.8	-162.8	179.3	175.3	-174.1	0	112.7	S160 F163 D164 Y174 G175 H179 M180 N282	S160-K177 PolarHBondContact OG-NZ 3.43Å; F163-K177 HydrophobicContact CD1-CB 3.82Å; F163-K177 HydrophobicContact CD1-CD 3.79Å; F163-K177 HydrophobicContact CD1-CG 3.59Å; F163-K177 HydrophobicContact CE1-CB 3.43Å; F163-K177 VanDerWaalsContact CE1-CB 3.43Å; F163-K177 HydrophobicContact CE1-CD 4.31Å; F163-K177 HydrophobicContact CE1-CG 3.73Å; F163-K177 HydrophobicContact CG-CD 4.37Å; F163-K177 HydrophobicContact CG-CG 4.09Å; F163-K177 HydrophobicContact CZ-CB 4.06Å; F163-K177 HydrophobicContact CZ-CG 4.37Å; D164-K177 WeakPolarHBondContact OD1-CE 3.45Å; D164-K177 IonicContact OD1-NZ 2.73Å; D164-K177 PolarHBondContact OD1-NZ 3.28Å; D164-K177 IonicContact OD2-NZ 2.65Å; D164-K177 PolarHBondContact OD2-NZ 3.47Å; Y174-K177 HydrophobicContact CD2-CD 4.42Å; Y174-K177 HydrophobicContact CE2-CD 3.67Å; Y174-K177 WeakPolarHBondContact O-CB 3.46Å; Y174-K177 PolarHBondContact O-N 3.24Å; G175-K177 PolarHBondContact O-N 2.98Å; K177-H179 PolarHBondContact O-N 2.85Å; K177-M180 HydrophobicContact CD-SD 4.4Å; K177-M180 HydrophobicContact CG-CG 4.3Å; K177-M180 HydrophobicContact CG-SD 3.61Å; K177-N282 PolarHBondContact O-ND2 3.39Å
178	S	93.4	Very high	95.1	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.028	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-52.7	-25.7	175.5	59.5	0	0	0	0	114.8	G175 C176 R283	G175-S178 VanDerWaalsContact O-CB 3.29Å; G175-S178 WeakPolarHBondContact O-CB 3.35Å; G175-S178 PolarHBondContact O-N 2.99Å; G175-S178 VanDerWaalsContact O-N 3.16Å; G175-S178 PolarHBondContact O-OG 3.09Å; C176-S178 PolarHBondContact O-N 2.72Å; S178-R283 WeakPolarHBondContact O-CG 3.33Å; S178-R283 PolarHBondContact O-NE 3.18Å
179	H	94.2	Very high	94.8	Very high	24 Å²	24	36.1 Å²	36.1	11%	0.111	19%	0.187	C	C	.	.	S	Bend	trans	-139.1	86.2	177.9	-62	72.3	0	0	0	108.4	C176 K177 A207 G208 R209 A228 N282 R283	C176-H179 PolarHBondContact O-N 2.73Å; K177-H179 PolarHBondContact O-N 2.85Å; H179-A207 CarbonylContact O-C 3.41Å; H179-A207 WeakPolarHBondContact O-CA 3.38Å; H179-A207 VanDerWaalsContact O-CB 3.31Å; H179-A207 WeakPolarHBondContact O-CB 3.49Å; H179-G208 PolarHBondContact O-N 2.83Å; H179-R209 HydrophobicContact CB-CB 4.01Å; H179-A228 WeakPolarHBondContact O-CB 3.31Å; H179-N282 WeakPolarHBondContact CA-OD1 3.46Å; H179-R283 HydrophobicContact CB-CG 4.42Å
180	M	95.8	Very high	94.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.3	-178.1	66.4	164.6	-73.3	0	0	112.8	F163 K177 M205 G206 A207 Y280 T281 N282 V409	F163-M180 HydrophobicContact CB-CE 4.09Å; F163-M180 HydrophobicContact CB-SD 4.13Å; F163-M180 HydrophobicContact CD2-CB 4.08Å; F163-M180 HydrophobicContact CD2-CE 3.77Å; F163-M180 HydrophobicContact CD2-SD 3.77Å; F163-M180 HydrophobicContact CE2-CB 3.81Å; F163-M180 HydrophobicContact CE2-SD 4.38Å; F163-M180 HydrophobicContact CG-CE 4.23Å; F163-M180 HydrophobicContact CG-SD 3.97Å; F163-M180 HydrophobicContact CZ-CB 4.48Å; K177-M180 HydrophobicContact CD-SD 4.4Å; K177-M180 HydrophobicContact CG-CG 4.3Å; K177-M180 HydrophobicContact CG-SD 3.61Å; M180-M205 HydrophobicContact CE-CE 3.97Å; M180-G206 CarbonylContact C-O 3.53Å; M180-G206 WeakPolarHBondContact CA-O 3.42Å; M180-A207 HydrophobicContact CB-CB 4.2Å; M180-Y280 HydrophobicContact CE-CD1 4.45Å; M180-T281 WeakPolarHBondContact O-CA 3.44Å; M180-T281 PolarHBondContact O-OG1 2.85Å; M180-N282 HydrophobicContact CG-CB 4.25Å; M180-N282 PolarHBondContact N-OD1 3.04Å; M180-N282 PolarHBondContact O-N 3.38Å; M180-N282 PolarHBondContact O-OD1 2.86Å; M180-V409 HydrophobicContact SD-CG2 4.17Å
181	A	98.1	Very high	94.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145.2	174.6	0	0	0	0	0	110.6	M205 G206 A228 I229 A232 L279 Y280	A181-M205 WeakPolarHBondContact O-CA 3.47Å; A181-G206 PolarHBondContact N-O 2.88Å; A181-G206 PolarHBondContact O-N 3.28Å; A181-G206 VanDerWaalsContact O-O 3.12Å; A181-A228 HydrophobicContact CB-CB 3.95Å; A181-I229 HydrophobicContact CB-CB 4.39Å; A181-I229 HydrophobicContact CB-CG1 3.7Å; A181-A232 HydrophobicContact CB-CB 4.06Å; A181-L279 HydrophobicContact CB-CD1 4.21Å; A181-Y280 CarbonylContact C-O 3.56Å; A181-Y280 WeakPolarHBondContact CA-O 3.33Å
182	A	98.6	Very high	94.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	125.8	-176	0	0	0	0	0	111.1	V202 A204 M205 L279 Y280	A182-V202 HydrophobicContact CB-CG1 4.24Å; A182-A204 CarbonylContact C-O 3.57Å; A182-A204 WeakPolarHBondContact CA-O 3.45Å; A182-M205 HydrophobicContact CB-CE 3.95Å; A182-L279 WeakPolarHBondContact O-CA 3.47Å; A182-Y280 PolarHBondContact N-O 2.92Å; A182-Y280 PolarHBondContact O-N 3.17Å
183	F	98.9	Very high	94.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.3	169.2	-78.4	-81.4	0	0	0	110	V203 A204 A232 R233 L236 L277 H278 L279 I361	F183-V203 HydrophobicContact CB-CG2 4.17Å; F183-V203 WeakPolarHBondContact O-CG2 3.43Å; F183-V203 PolarHBondContact O-N 2.67Å; F183-A204 HydrophobicContact CB-CB 4.34Å; F183-A204 PolarHBondContact N-O 2.79Å; F183-A204 PolarHBondContact O-N 3.08Å; F183-A232 HydrophobicContact CD2-CB 3.98Å; F183-A232 HydrophobicContact CE2-CB 4.08Å; F183-R233 HydrophobicContact CE2-CB 3.92Å; F183-R233 HydrophobicContact CZ-CB 4.33Å; F183-L236 HydrophobicContact CB-CD1 4.14Å; F183-L236 HydrophobicContact CD1-CD2 3.93Å; F183-L236 HydrophobicContact CD2-CB 4.12Å; F183-L236 HydrophobicContact CD2-CD2 4.18Å; F183-L236 HydrophobicContact CE1-CD2 4.11Å; F183-L236 HydrophobicContact CE2-CD2 4.39Å; F183-L236 HydrophobicContact CG-CB 4.43Å; F183-L236 HydrophobicContact CG-CD1 4.43Å; F183-L236 HydrophobicContact CG-CD2 3.95Å; F183-L236 HydrophobicContact CZ-CD2 4.34Å; F183-L277 HydrophobicContact CB-CD1 4.25Å; F183-L277 HydrophobicContact CD1-CD1 3.78Å; F183-L277 HydrophobicContact CD1-CD2 4.22Å; F183-L277 HydrophobicContact CD1-CG 4.03Å; F183-L277 HydrophobicContact CE1-CD2 4.33Å; F183-L277 HydrophobicContact CE1-CG 4.49Å; F183-L277 HydrophobicContact CG-CD1 4.42Å; F183-H278 WeakPolarHBondContact CA-O 3.27Å; F183-L279 HydrophobicContact CD1-CB 4.08Å; F183-L279 HydrophobicContact CD1-CD1 4.22Å; F183-L279 HydrophobicContact CD2-CD1 4.05Å; F183-L279 HydrophobicContact CE1-CB 3.94Å; F183-L279 HydrophobicContact CE1-CD1 4.13Å; F183-L279 HydrophobicContact CE1-CD2 4.16Å; F183-L279 HydrophobicContact CE1-CG 4.31Å; F183-L279 HydrophobicContact CE2-CD1 3.91Å; F183-L279 HydrophobicContact CG-CD1 4.21Å; F183-L279 HydrophobicContact CZ-CD1 3.97Å; F183-L279 HydrophobicContact CZ-CD2 3.95Å; F183-L279 HydrophobicContact CZ-CG 4.38Å; F183-I361 HydrophobicContact CE1-CD1 3.82Å; F183-I361 HydrophobicContact CE1-CG1 4.11Å; F183-I361 HydrophobicContact CZ-CD1 4.18Å
184	V	98.8	Very high	93.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.4	-178.8	-173.9	0	0	0	0	107.7	M155 L158 Y200 K201 V202 H278	M155-V184 HydrophobicContact CE-CB 3.9Å; M155-V184 HydrophobicContact CE-CG2 3.73Å; M155-V184 HydrophobicContact SD-CB 3.83Å; M155-V184 HydrophobicContact SD-CG1 3.92Å; M155-V184 HydrophobicContact SD-CG2 3.85Å; L158-V184 HydrophobicContact CD2-CG1 4.27Å; V184-Y200 HydrophobicContact CG1-CD1 4.2Å; V184-K201 CarbonylContact C-O 3.59Å; V184-K201 WeakPolarHBondContact CA-O 3.32Å; V184-V202 HydrophobicContact CG2-CG2 4.24Å; V184-H278 PolarHBondContact N-O 2.89Å; V184-H278 PolarHBondContact O-N 2.86Å
185	L	98.3	Very high	93.5	Very high	12 Å²	12	37.4 Å²	37.4	6%	0.063	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136.8	161.7	-68.6	-177.9	0	0	0	108.7	Y200 K201 V203 F239 I259 I275 S276 L277	L185-Y200 CarbonylContact O-C 3.54Å; L185-K201 PolarHBondContact N-O 2.71Å; L185-K201 PolarHBondContact O-N 3.18Å; L185-V203 HydrophobicContact CB-CG1 4.29Å; L185-V203 HydrophobicContact CD1-CG1 3.85Å; L185-V203 HydrophobicContact CG-CG1 3.84Å; L185-V203 HydrophobicContact CG-CG2 4.05Å; L185-F239 HydrophobicContact CD1-CE1 4.04Å; L185-F239 HydrophobicContact CD1-CZ 4.2Å; L185-I259 HydrophobicContact CD1-CD1 3.93Å; L185-I259 HydrophobicContact CD1-CG2 3.77Å; L185-I275 HydrophobicContact CB-CG2 4.33Å; L185-I275 HydrophobicContact CD1-CG2 4.26Å; L185-I275 HydrophobicContact CD2-CG2 4.07Å; L185-I275 HydrophobicContact CG-CG2 4.46Å; L185-S276 WeakPolarHBondContact CA-O 3.39Å; L185-L277 HydrophobicContact CD2-CB 4.17Å; L185-L277 HydrophobicContact CD2-CD1 3.71Å
186	I	97.2	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.6	164.1	-61.4	-179.7	0	0	0	106.4	Q198 Q199 Y200 I275 S276	I186-Q198 HydrophobicContact CG2-CB 4.09Å; I186-Q198 HydrophobicContact CG2-CG 4.38Å; I186-Q199 WeakPolarHBondContact CA-O 3.46Å; I186-Y200 HydrophobicContact CD1-CD1 3.69Å; I186-Y200 HydrophobicContact CD1-CE1 3.25Å; I186-Y200 HydrophobicContact CD1-CE2 4.12Å; I186-Y200 HydrophobicContact CD1-CG 4.32Å; I186-Y200 VanDerWaalsContact CD1-CZ 3.49Å; I186-Y200 HydrophobicContact CG1-CD1 3.73Å; I186-Y200 HydrophobicContact CG1-CD2 4.32Å; I186-Y200 HydrophobicContact CG1-CE1 3.83Å; I186-Y200 HydrophobicContact CG1-CE2 4.39Å; I186-Y200 HydrophobicContact CG1-CG 3.99Å; I186-Y200 HydrophobicContact CG2-CE2 4.35Å; I186-I275 CarbonylContact O-C 3.58Å; I186-I275 VanDerWaalsContact O-CA 3.32Å; I186-I275 WeakPolarHBondContact O-CA 3.49Å; I186-S276 PolarHBondContact N-O 2.82Å; I186-S276 PolarHBondContact O-N 2.84Å
187	S	94.8	Very high	92.9	Very high	22 Å²	22	43.3 Å²	43.3	15%	0.154	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	132.3	177.9	58.2	0	0	0	0	110.8	V189 Q198 Q199 K274	S187-V189 PolarHBondContact O-N 3.24Å; S187-Q198 VanDerWaalsContact C-OE1 3.28Å; S187-Q199 PolarHBondContact N-O 2.99Å; S187-Q199 PolarHBondContact O-N 3.3Å; S187-K274 WeakPolarHBondContact CA-O 3.33Å
188	E	91.6	Very high	92.7	Very high	63 Å²	63	45.7 Å²	45.7	29%	0.294	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	130.8	170.8	-166.8	-170.1	103.1	0	0	110.2	P196 C197 K274	E188-P196 HydrophobicContact CG-CB 4.15Å; E188-C197 WeakPolarHBondContact CA-O 3.25Å; E188-K274 HydrophobicContact CB-CB 3.96Å; E188-K274 HydrophobicContact CB-CD 3.9Å; E188-K274 VanDerWaalsContact CD-CD 3.45Å; E188-K274 HydrophobicContact CG-CD 4.31Å; E188-K274 PolarHBondContact N-O 3.45Å; E188-K274 WeakPolarHBondContact OE1-CD 3.49Å; E188-K274 IonicContact OE1-NZ 2.9Å; E188-K274 PolarHBondContact OE1-NZ 3.38Å; E188-K274 VanDerWaalsContact OE2-CD 3.31Å; E188-K274 WeakPolarHBondContact OE2-CD 3.47Å; E188-K274 IonicContact OE2-NZ 2.7Å; E188-K274 PolarHBondContact OE2-NZ 2.95Å
189	V	89.9	Confident	92.8	Very high	49 Å²	49	49.1 Å²	49.1	30%	0.297	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	165.5	176.3	-61	0	0	0	0	109.5	S187 C197 Q199	S187-V189 PolarHBondContact O-N 3.24Å; V189-C197 PolarHBondContact N-O 3.39Å; V189-C197 PolarHBondContact O-N 2.93Å; V189-C197 VanDerWaalsContact O-O 3.05Å; V189-Q199 HydrophobicContact CG1-CB 4.04Å; V189-Q199 HydrophobicContact CG2-CB 3.88Å
190	V	90	Very high	92.9	Very high	105 Å²	105	49.1 Å²	49.1	64%	0.636	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.8	177.4	-171.8	0	0	0	0	109.7	G194 R195	V190-G194 VanDerWaalsContact CG1-CA 3.5Å; V190-R195 CarbonylContact C-O 3.6Å; V190-R195 WeakPolarHBondContact CA-O 3.32Å
191	D	88.4	Confident	93	Very high	39 Å²	39	53.6 Å²	53.6	21%	0.209	31%	0.307	C	S	.	.			trans	-76.8	173.8	176.3	84.6	-6.6	0	0	0	112.6	A193 G194 R195	D191-A193 PolarHBondContact O-N 3.24Å; D191-A193 VanDerWaalsContact O-N 3.07Å; D191-A193 VanDerWaalsContact OD1-C 3.24Å; D191-A193 VanDerWaalsContact OD1-CA 3.28Å; D191-A193 WeakPolarHBondContact OD1-CA 3.33Å; D191-A193 WeakPolarHBondContact OD1-CB 3.46Å; D191-A193 PolarHBondContact OD1-N 2.94Å; D191-G194 PolarHBondContact O-N 3.42Å; D191-G194 PolarHBondContact OD1-N 3.25Å; D191-R195 PolarHBondContact N-O 2.89Å; D191-R195 WeakPolarHBondContact OD1-CB 3.37Å; D191-R195 PolarHBondContact OD1-N 3.47Å; D191-R195 IonicContact OD1-NE 3.22Å; D191-R195 IonicContact OD2-CZ 3.23Å; D191-R195 VanDerWaalsContact OD2-CZ 3.22Å; D191-R195 IonicContact OD2-NE 2.63Å; D191-R195 PolarHBondContact OD2-NE 3.44Å; D191-R195 IonicContact OD2-NH2 2.7Å; D191-R195 PolarHBondContact OD2-NH2 3.06Å
192	T	88.8	Confident	93.1	Very high	162 Å²	162	54.2 Å²	54.2	99%	0.994	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-6.7	179.5	50.4	0	0	0	0	114.4
193	A	89.3	Confident	93.1	Very high	71 Å²	71	54.2 Å²	54.2	59%	0.587	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	8.4	174.3	0	0	0	0	0	112.8	D191	D191-A193 PolarHBondContact O-N 3.24Å; D191-A193 VanDerWaalsContact O-N 3.07Å; D191-A193 VanDerWaalsContact OD1-C 3.24Å; D191-A193 VanDerWaalsContact OD1-CA 3.28Å; D191-A193 WeakPolarHBondContact OD1-CA 3.33Å; D191-A193 WeakPolarHBondContact OD1-CB 3.46Å; D191-A193 PolarHBondContact OD1-N 2.94Å
194	G	88.1	Confident	93.1	Very high	57 Å²	57	54.2 Å²	54.2	59%	0.588	31%	0.311	S	S	*	.	S	Bend	trans	83.7	12.5	177.4	0	0	0	0	0	115.2	V190 D191	V190-G194 VanDerWaalsContact CG1-CA 3.5Å; D191-G194 PolarHBondContact O-N 3.42Å; D191-G194 PolarHBondContact OD1-N 3.25Å
195	R	88	Confident	93	Very high	156 Å²	156	54.4 Å²	54.4	59%	0.589	31%	0.312	S	S	*	.			trans	-102.3	145.1	-174.4	-53.8	174.8	-62.2	179	4.4	111.8	V190 D191 C197	V190-R195 CarbonylContact C-O 3.6Å; V190-R195 WeakPolarHBondContact CA-O 3.32Å; D191-R195 PolarHBondContact N-O 2.89Å; D191-R195 WeakPolarHBondContact OD1-CB 3.37Å; D191-R195 PolarHBondContact OD1-N 3.47Å; D191-R195 IonicContact OD1-NE 3.22Å; D191-R195 IonicContact OD2-CZ 3.23Å; D191-R195 VanDerWaalsContact OD2-CZ 3.22Å; D191-R195 IonicContact OD2-NE 2.63Å; D191-R195 PolarHBondContact OD2-NE 3.44Å; D191-R195 IonicContact OD2-NH2 2.7Å; D191-R195 PolarHBondContact OD2-NH2 3.06Å; R195-C197 PolarHBondContact O-N 3.04Å
196	P	86.3	Confident	93	Very high	91 Å²	91	53.9 Å²	53.9	59%	0.591	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	135.9	169.6	-23.2	34.2	0	0	0	112	E188	E188-P196 HydrophobicContact CG-CB 4.15Å
197	C	88.1	Confident	93.1	Very high	51 Å²	51	53.9 Å²	53.9	35%	0.345	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	164.2	171.2	70.8	0	0	0	0	110.2	E188 V189 R195	E188-C197 WeakPolarHBondContact CA-O 3.25Å; V189-C197 PolarHBondContact N-O 3.39Å; V189-C197 PolarHBondContact O-N 2.93Å; V189-C197 VanDerWaalsContact O-O 3.05Å; R195-C197 PolarHBondContact O-N 3.04Å
198	Q	90.8	Very high	93.1	Very high	54 Å²	54	53 Å²	53	25%	0.252	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.2	-176.3	-62.9	-59.8	-25.4	0	0	111.8	V145 I186 S187 Y200	V145-Q198 HydrophobicContact CB-CG 3.83Å; V145-Q198 HydrophobicContact CG1-CB 4.44Å; V145-Q198 HydrophobicContact CG1-CG 3.9Å; V145-Q198 HydrophobicContact CG2-CG 3.64Å; I186-Q198 HydrophobicContact CG2-CB 4.09Å; I186-Q198 HydrophobicContact CG2-CG 4.38Å; S187-Q198 VanDerWaalsContact C-OE1 3.28Å; Q198-Y200 HydrophobicContact CB-CD2 4.32Å; Q198-Y200 HydrophobicContact CB-CE2 3.95Å
199	Q	94.4	Very high	93.1	Very high	76 Å²	76	53.8 Å²	53.8	36%	0.355	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.3	168.8	178.5	171.2	125.6	0	0	109.8	I186 S187 V189	I186-Q199 WeakPolarHBondContact CA-O 3.46Å; S187-Q199 PolarHBondContact N-O 2.99Å; S187-Q199 PolarHBondContact O-N 3.3Å; V189-Q199 HydrophobicContact CG1-CB 4.04Å; V189-Q199 HydrophobicContact CG2-CB 3.88Å
200	Y	97.3	Very high	93.2	Very high	24 Å²	24	52.4 Å²	52.4	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.4	171.2	-72.9	-121.7	0	0	0	109.6	W150 H151 H154 M155 V184 L185 I186 Q198	W150-Y200 AromaticContact CH2-CE2 3.76Å; W150-Y200 HydrophobicContact CH2-CE2 3.76Å; W150-Y200 AromaticContact CH2-CZ 3.94Å; W150-Y200 WeakPolarHBondContact CH2-OH 3.35Å; W150-Y200 AromaticContact CZ3-CE2 3.89Å; W150-Y200 HydrophobicContact CZ3-CE2 3.89Å; W150-Y200 AromaticContact CZ3-CZ 3.79Å; W150-Y200 WeakPolarHBondContact CZ3-OH 3.44Å; H151-Y200 AromaticContact ND1-CE1 3.55Å; H151-Y200 AromaticContact ND1-CZ 3.68Å; H151-Y200 PolarHBondContact ND1-OH 2.9Å; H154-Y200 AromaticContact CD2-CD1 3.55Å; H154-Y200 AromaticContact CD2-CE1 3.71Å; H154-Y200 AromaticContact CD2-CG 3.72Å; H154-Y200 AromaticContact NE2-CG 3.73Å; M155-Y200 HydrophobicContact CG-CD1 4.48Å; M155-Y200 HydrophobicContact CG-CE1 4.07Å; M155-Y200 HydrophobicContact SD-CD1 3.93Å; M155-Y200 HydrophobicContact SD-CE1 3.98Å; V184-Y200 HydrophobicContact CG1-CD1 4.2Å; L185-Y200 CarbonylContact O-C 3.54Å; I186-Y200 HydrophobicContact CD1-CD1 3.69Å; I186-Y200 HydrophobicContact CD1-CE1 3.25Å; I186-Y200 HydrophobicContact CD1-CE2 4.12Å; I186-Y200 HydrophobicContact CD1-CG 4.32Å; I186-Y200 VanDerWaalsContact CD1-CZ 3.49Å; I186-Y200 HydrophobicContact CG1-CD1 3.73Å; I186-Y200 HydrophobicContact CG1-CD2 4.32Å; I186-Y200 HydrophobicContact CG1-CE1 3.83Å; I186-Y200 HydrophobicContact CG1-CE2 4.39Å; I186-Y200 HydrophobicContact CG1-CG 3.99Å; I186-Y200 HydrophobicContact CG2-CE2 4.35Å; Q198-Y200 HydrophobicContact CB-CD2 4.32Å; Q198-Y200 HydrophobicContact CB-CE2 3.95Å
201	K	97.9	Very high	93.3	Very high	93 Å²	93	48 Å²	48	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	110.6	-174.1	-155.4	172.4	-148.1	147.3	0	111.8	V184 L185 V203 L427	V184-K201 CarbonylContact C-O 3.59Å; V184-K201 WeakPolarHBondContact CA-O 3.32Å; L185-K201 PolarHBondContact N-O 2.71Å; L185-K201 PolarHBondContact O-N 3.18Å; K201-V203 PolarHBondContact O-N 2.85Å; K201-V203 VanDerWaalsContact O-N 3.12Å; K201-L427 HydrophobicContact CD-CD2 4.22Å; K201-L427 HydrophobicContact CG-CD2 4.35Å
202	V	98.7	Very high	93.5	Very high	13 Å²	13	46.2 Å²	46.2	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	109.8	173.3	-174.4	0	0	0	0	108.9	L158 K162 A182 V184 M205 W425	L158-V202 HydrophobicContact CD2-CG2 4Å; L158-V202 HydrophobicContact CG-CG2 3.79Å; K162-V202 HydrophobicContact CB-CB 4.45Å; K162-V202 HydrophobicContact CB-CG2 4.14Å; K162-V202 HydrophobicContact CG-CB 4.1Å; K162-V202 HydrophobicContact CG-CG1 4.02Å; K162-V202 HydrophobicContact CG-CG2 4.34Å; A182-V202 HydrophobicContact CB-CG1 4.24Å; V184-V202 HydrophobicContact CG2-CG2 4.24Å; V202-M205 HydrophobicContact CG1-CE 4.13Å; V202-W425 HydrophobicContact CG1-CZ3 4.32Å
203	V	98.8	Very high	93.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-26.4	-175.6	-70.3	0	0	0	0	113.4	F183 L185 K201 L236 F239 C426 L427	F183-V203 HydrophobicContact CB-CG2 4.17Å; F183-V203 WeakPolarHBondContact O-CG2 3.43Å; F183-V203 PolarHBondContact O-N 2.67Å; L185-V203 HydrophobicContact CB-CG1 4.29Å; L185-V203 HydrophobicContact CD1-CG1 3.85Å; L185-V203 HydrophobicContact CG-CG1 3.84Å; L185-V203 HydrophobicContact CG-CG2 4.05Å; K201-V203 PolarHBondContact O-N 2.85Å; K201-V203 VanDerWaalsContact O-N 3.12Å; V203-L236 HydrophobicContact CG2-CD1 3.76Å; V203-F239 HydrophobicContact CB-CD1 3.79Å; V203-F239 HydrophobicContact CB-CD2 4.18Å; V203-F239 HydrophobicContact CB-CE1 3.68Å; V203-F239 HydrophobicContact CB-CE2 4.1Å; V203-F239 HydrophobicContact CB-CG 4.03Å; V203-F239 HydrophobicContact CB-CZ 3.86Å; V203-F239 HydrophobicContact CG1-CD1 4.29Å; V203-F239 HydrophobicContact CG1-CD2 4.47Å; V203-F239 HydrophobicContact CG1-CE1 3.67Å; V203-F239 HydrophobicContact CG1-CE2 3.89Å; V203-F239 HydrophobicContact CG1-CZ 3.45Å; V203-F239 VanDerWaalsContact CG1-CZ 3.45Å; V203-F239 HydrophobicContact CG2-CD1 4.16Å; V203-F239 HydrophobicContact CG2-CE1 4.12Å; V203-C426 CarbonylContact O-C 3.57Å; V203-C426 WeakPolarHBondContact O-CA 3.36Å; V203-C426 WeakPolarHBondContact O-CB 3.44Å; V203-L427 HydrophobicContact CG1-CD2 4.4Å; V203-L427 PolarHBondContact O-N 3.44Å
204	A	98.9	Very high	93.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	148.5	177.2	0	0	0	0	0	111.8	A182 F183 A235 L236 C426	A182-A204 CarbonylContact C-O 3.57Å; A182-A204 WeakPolarHBondContact CA-O 3.45Å; F183-A204 HydrophobicContact CB-CB 4.34Å; F183-A204 PolarHBondContact N-O 2.79Å; F183-A204 PolarHBondContact O-N 3.08Å; A204-A235 HydrophobicContact CB-CB 3.94Å; A204-L236 VanDerWaalsContact CB-CA 3.47Å; A204-L236 HydrophobicContact CB-CB 3.81Å; A204-L236 HydrophobicContact CB-CD1 4.35Å; A204-C426 HydrophobicContact CB-CB 4.09Å
205	M	98.5	Very high	93.7	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.025	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	143	-171.7	-176.4	169.3	-90.9	0	0	110.3	S159 K162 F163 L166 M180 A181 A182 V202 W425	S159-M205 VanDerWaalsContact O-CE 3.26Å; S159-M205 WeakPolarHBondContact O-CE 3.35Å; K162-M205 HydrophobicContact CB-CE 4.03Å; K162-M205 HydrophobicContact CG-CE 4.07Å; F163-M205 HydrophobicContact CB-CE 4.04Å; F163-M205 HydrophobicContact CB-SD 3.98Å; F163-M205 HydrophobicContact CD2-CE 4.15Å; F163-M205 HydrophobicContact CD2-CG 3.98Å; F163-M205 HydrophobicContact CD2-SD 3.46Å; F163-M205 WeakPolarHBondContact CD2-SD 3.1Å; F163-M205 HydrophobicContact CE2-CG 4.39Å; F163-M205 HydrophobicContact CE2-SD 4.32Å; F163-M205 HydrophobicContact CG-SD 4.1Å; L166-M205 HydrophobicContact CD1-SD 3.82Å; M180-M205 HydrophobicContact CE-CE 3.97Å; A181-M205 WeakPolarHBondContact O-CA 3.47Å; A182-M205 HydrophobicContact CB-CE 3.95Å; V202-M205 HydrophobicContact CG1-CE 4.13Å; M205-W425 HydrophobicContact CB-CE3 4.19Å; M205-W425 PolarHBondContact N-O 3.45Å; M205-W425 PolarHBondContact O-N 3.38Å; M205-W425 VanDerWaalsContact O-N 3.11Å
206	G	98.4	Very high	93.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	142.4	178.6	0	0	0	0	0	112.1	M180 A181 I423	M180-G206 CarbonylContact C-O 3.53Å; M180-G206 WeakPolarHBondContact CA-O 3.42Å; A181-G206 PolarHBondContact N-O 2.88Å; A181-G206 PolarHBondContact O-N 3.28Å; A181-G206 VanDerWaalsContact O-O 3.12Å; G206-I423 CarbonylContact C-O 3.53Å; G206-I423 VanDerWaalsContact CA-O 3.27Å; G206-I423 WeakPolarHBondContact CA-O 3.39Å
207	A	97.3	Very high	94.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	156.2	170.2	0	0	0	0	0	111.2	F163 C176 H179 M180 S422 I423	F163-A207 HydrophobicContact CE2-CB 3.74Å; F163-A207 HydrophobicContact CZ-CB 3.75Å; C176-A207 HydrophobicContact CB-CB 4.28Å; H179-A207 CarbonylContact O-C 3.41Å; H179-A207 WeakPolarHBondContact O-CA 3.38Å; H179-A207 VanDerWaalsContact O-CB 3.31Å; H179-A207 WeakPolarHBondContact O-CB 3.49Å; M180-A207 HydrophobicContact CB-CB 4.2Å; A207-S422 CarbonylContact O-C 3.14Å; A207-S422 WeakPolarHBondContact O-CA 3.36Å; A207-S422 WeakPolarHBondContact O-CB 3.3Å; A207-I423 HydrophobicContact CB-CB 4.31Å; A207-I423 PolarHBondContact N-O 2.83Å; A207-I423 PolarHBondContact O-N 3.06Å
208	G	95.5	Very high	94.4	Very high	5 Å²	5	38.1 Å²	38.1	5%	0.052	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.5	160	-179.5	0	0	0	0	0	112.7	H179 C226 H227 A228	H179-G208 PolarHBondContact O-N 2.83Å; G208-C226 CarbonylContact C-O 3.59Å; G208-C226 VanDerWaalsContact CA-O 3.31Å; G208-C226 WeakPolarHBondContact CA-O 3.11Å; G208-H227 CarbonylContact O-C 3.5Å; G208-H227 WeakPolarHBondContact O-CA 3.49Å; G208-A228 PolarHBondContact O-N 2.97Å
209	R	92.3	Very high	94.5	Very high	78 Å²	78	37.5 Å²	37.5	29%	0.294	19%	0.186	S	C	.	.	S	Bend	trans	-140.7	18.9	-168	66	177.2	-68.5	-153.1	-3.2	115	H179 H227 D419	H179-R209 HydrophobicContact CB-CB 4.01Å; R209-H227 VanDerWaalsContact C-CD2 3.43Å; R209-D419 VanDerWaalsContact CD-OD1 3.3Å; R209-D419 WeakPolarHBondContact CD-OD1 3.23Å; R209-D419 HydrophobicContact CG-CB 4.42Å; R209-D419 IonicContact CZ-OD1 3.77Å; R209-D419 IonicContact CZ-OD2 3.25Å; R209-D419 IonicContact NE-OD1 2.91Å; R209-D419 IonicContact NH1-OD1 2.66Å; R209-D419 PolarHBondContact NH1-OD1 2.58Å; R209-D419 IonicContact NH1-OD2 2.66Å; R209-D419 PolarHBondContact NH1-OD2 2.82Å
210	S	92.1	Very high	94.5	Very high	21 Å²	21	34 Å²	34	15%	0.147	17%	0.171	C	C	.	.			trans	-148.5	174.5	-171.5	53.8	0	0	0	0	111.2	C226 H227 D419 S437	S210-C226 CarbonylContact O-C 3.59Å; S210-C226 VanDerWaalsContact O-CA 3.23Å; S210-C226 WeakPolarHBondContact O-CA 3.4Å; S210-C226 VanDerWaalsContact O-CB 3.24Å; S210-C226 WeakPolarHBondContact O-CB 3.5Å; S210-C226 PolarHBondContact O-N 2.92Å; S210-H227 PolarHBondContact O-N 2.85Å; S210-D419 WeakPolarHBondContact CB-O 3.24Å; S210-D419 PolarHBondContact OG-O 3.31Å; S210-S437 WeakPolarHBondContact OG-CB 3.34Å
211	C	92.3	Very high	94.4	Very high	13 Å²	13	36 Å²	36	9%	0.088	18%	0.181	C	C	.	.			trans	-142.7	165.6	174.5	68.3	0	0	0	0	110.1	S213 H224 H310 S437	C211-S213 PolarHBondContact O-N 2.92Å; C211-H224 WeakPolarHBondContact CB-O 3.38Å; C211-H310 VanDerWaalsContact SG-CB 3.53Å; C211-S437 CarbonylContact C-O 3.53Å; C211-S437 VanDerWaalsContact C-O 3.27Å
212	C	92.3	Very high	94.2	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.172	C	C	.	.			trans	-62.4	140.7	177.9	-46.7	0	0	0	0	110.5	M222 V223 V330 S437 S438 G440	C212-M222 HydrophobicContact CB-SD 4.39Å; C212-V223 PolarHBondContact SG-O 3.47Å; C212-V330 HydrophobicContact CB-CB 4.23Å; C212-V330 HydrophobicContact CB-CG1 4.1Å; C212-V330 HydrophobicContact CB-CG2 4.21Å; C212-V330 WeakPolarHBondContact O-CB 3.32Å; C212-V330 VanDerWaalsContact O-CG1 3.3Å; C212-V330 WeakPolarHBondContact O-CG1 3.49Å; C212-S437 PolarHBondContact N-O 3.04Å; C212-S437 VanDerWaalsContact N-O 3.15Å; C212-S437 PolarHBondContact SG-O 3.26Å; C212-S437 VanDerWaalsContact SG-O 3.36Å; C212-S438 WeakPolarHBondContact CA-O 3.32Å; C212-S438 WeakPolarHBondContact CB-O 3.13Å; C212-G440 VanDerWaalsContact SG-CA 3.51Å; C212-G440 PolarHBondContact SG-N 2.94Å; C212-G440 VanDerWaalsContact SG-N 3.38Å
213	S	87	Confident	94.1	Very high	56 Å²	56	32.9 Å²	32.9	39%	0.392	17%	0.168	S	C	.	.			trans	-110.6	0.9	176.8	59	0	0	0	0	113	C211	C211-S213 PolarHBondContact O-N 2.92Å
214	G	90.7	Very high	94	Very high	27 Å²	27	33.6 Å²	33.6	28%	0.278	17%	0.171	S	C	.	.	S	Bend	trans	-77.4	-170.6	-179.6	0	0	0	0	0	114.8	K329 V330	G214-K329 WeakPolarHBondContact O-CA 3.44Å; G214-K329 WeakPolarHBondContact O-CB 3.25Å; G214-V330 PolarHBondContact O-N 3.41Å
215	W	92.8	Very high	93.9	Very high	178 Å²	178	34.2 Å²	34.2	67%	0.674	18%	0.175	S	C	*	.	B	Isolated β-bridge	trans	-67.9	156.1	174.9	-57.4	97.1	0	0	0	111.8	A328 K329	W215-A328 WeakPolarHBondContact CA-O 3.35Å; W215-A328 HydrophobicContact CE3-CB 4.05Å; W215-A328 HydrophobicContact CZ3-CB 3.83Å; W215-K329 HydrophobicContact CE3-CG 4.29Å
216	L	92.4	Very high	93.8	Very high	15 Å²	15	34 Å²	34	8%	0.079	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-64.4	134.8	172.3	-65.8	-178	0	0	0	111.2	Y218 G327 A328 K329 V330 K517 V520	L216-Y218 HydrophobicContact CB-CE1 4.12Å; L216-G327 WeakPolarHBondContact CD1-O 3.37Å; L216-A328 PolarHBondContact N-O 2.73Å; L216-K329 WeakPolarHBondContact CD2-O 3.33Å; L216-V330 HydrophobicContact CD2-CG2 3.95Å; L216-K517 HydrophobicContact CD2-CD 3.76Å; L216-K517 HydrophobicContact CD2-CG 4.3Å; L216-V520 HydrophobicContact CB-CG2 4.01Å; L216-V520 HydrophobicContact CD1-CG2 3.99Å; L216-V520 HydrophobicContact CD2-CG2 4.07Å; L216-V520 HydrophobicContact CG-CG2 4.25Å
217	S	91.4	Very high	93.7	Very high	32 Å²	32	35 Å²	35	22%	0.224	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-103.8	135.8	169.6	-177.1	0	0	0	0	110.8	S219	S217-S219 PolarHBondContact OG-OG 3.37Å
218	Y	93.5	Very high	93.7	Very high	110 Å²	110	35.4 Å²	35.4	43%	0.431	18%	0.181	S	C	.	.	S	Bend	trans	-100.2	-6.8	-176.2	-51.4	-66.2	0	0	0	113.7	L216 G220 L519 V520 F523	L216-Y218 HydrophobicContact CB-CE1 4.12Å; Y218-G220 VanDerWaalsContact C-N 3.31Å; Y218-G220 PolarHBondContact O-N 3.36Å; Y218-L519 HydrophobicContact CD1-CB 3.83Å; Y218-L519 HydrophobicContact CE1-CB 3.82Å; Y218-V520 HydrophobicContact CD1-CG2 4.17Å; Y218-V520 HydrophobicContact CE1-CG2 4.14Å; Y218-F523 WeakPolarHBondContact O-CB 3.45Å; Y218-F523 WeakPolarHBondContact O-CD1 3.39Å
219	S	92.6	Very high	93.8	Very high	41 Å²	41	35.7 Å²	35.7	29%	0.287	18%	0.182	S	C	.	.	S	Bend	trans	-80.9	-3.2	-176.1	65.2	0	0	0	0	115.2	S217 M221 R461	S217-S219 PolarHBondContact OG-OG 3.37Å; S219-M221 PolarHBondContact O-N 3.38Å; S219-M221 VanDerWaalsContact O-N 3.17Å; S219-M221 WeakPolarHBondContact OG-CB 3.4Å; S219-M221 WeakPolarHBondContact OG-CG 3.26Å; S219-M221 PolarHBondContact OG-SD 3.33Å; S219-M221 VanDerWaalsContact OG-SD 3.41Å; S219-R461 PolarHBondContact O-NE 3.47Å; S219-R461 PolarHBondContact O-NH2 2.8Å
220	G	94.6	Very high	94.1	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.031	17%	0.17	C	C	.	.	S	Bend	trans	73.5	-3.3	-175	0	0	0	0	0	115.6	Y218 K460 R461	Y218-G220 VanDerWaalsContact C-N 3.31Å; Y218-G220 PolarHBondContact O-N 3.36Å; G220-K460 WeakPolarHBondContact O-CA 3.24Å; G220-K460 WeakPolarHBondContact O-CB 3.3Å; G220-K460 PolarHBondContact O-N 3.34Å; G220-R461 PolarHBondContact O-N 3.11Å; G220-R461 VanDerWaalsContact O-N 3.16Å
221	M	93.9	Very high	94.4	Very high	64 Å²	64	31.5 Å²	31.5	32%	0.315	16%	0.163	S	C	.	.			trans	-80.3	-26.1	-172.5	-66.9	165.2	79	0	0	113.7	S219 T455 C459	S219-M221 PolarHBondContact O-N 3.38Å; S219-M221 VanDerWaalsContact O-N 3.17Å; S219-M221 WeakPolarHBondContact OG-CB 3.4Å; S219-M221 WeakPolarHBondContact OG-CG 3.26Å; S219-M221 PolarHBondContact OG-SD 3.33Å; S219-M221 VanDerWaalsContact OG-SD 3.41Å; M221-T455 HydrophobicContact CB-CG2 3.82Å; M221-T455 HydrophobicContact CE-CG2 3.45Å; M221-T455 VanDerWaalsContact CE-CG2 3.45Å; M221-T455 HydrophobicContact CG-CG2 3.91Å; M221-C459 WeakPolarHBondContact O-CB 3.48Å
222	M	94.4	Very high	94.7	Very high	41 Å²	41	30.9 Å²	30.9	20%	0.202	16%	0.159	C	C	.	.			trans	-84	139.3	-176.7	-169	-174.5	-79.4	0	0	112.9	C212 H224 V330 K439	C212-M222 HydrophobicContact CB-SD 4.39Å; M222-H224 PolarHBondContact O-N 3.14Å; M222-H224 VanDerWaalsContact SD-CD2 3.54Å; M222-V330 HydrophobicContact SD-CG2 4.42Å; M222-K439 WeakPolarHBondContact CG-O 3.34Å
223	V	96.7	Very high	95	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.			trans	-91.1	91.8	168.2	177.7	0	0	0	0	109.9	C212 D225 I231 R234 L435 G440 L458 C459	C212-V223 PolarHBondContact SG-O 3.47Å; V223-D225 WeakPolarHBondContact CG1-O 3.42Å; V223-D225 PolarHBondContact O-N 3.12Å; V223-I231 HydrophobicContact CG1-CD1 3.94Å; V223-R234 VanDerWaalsContact CG2-NH1 3.3Å; V223-L435 HydrophobicContact CB-CD2 3.77Å; V223-L435 HydrophobicContact CG1-CD2 4.04Å; V223-L435 HydrophobicContact CG2-CD2 3.69Å; V223-G440 PolarHBondContact N-O 3.03Å; V223-G440 VanDerWaalsContact O-CA 3.31Å; V223-G440 WeakPolarHBondContact O-CA 3.44Å; V223-L458 HydrophobicContact CG2-CB 4.47Å; V223-C459 HydrophobicContact CG2-CB 4.33Å
224	H	96.1	Very high	95.6	Very high	16 Å²	16	31.2 Å²	31.2	7%	0.074	15%	0.152	C	C	.	.			trans	-61.7	-12.3	-176.6	-71.2	-176.9	0	0	0	116	C211 M222 V330 C332 V520	C211-H224 WeakPolarHBondContact CB-O 3.38Å; M222-H224 PolarHBondContact O-N 3.14Å; M222-H224 VanDerWaalsContact SD-CD2 3.54Å; H224-V330 HydrophobicContact CB-CG1 3.75Å; H224-V330 VanDerWaalsContact O-CG1 3.28Å; H224-V330 WeakPolarHBondContact O-CG1 3.39Å; H224-C332 PolarHBondContact O-SG 3.25Å; H224-V520 VanDerWaalsContact CE1-CG1 3.47Å; H224-V520 WeakPolarHBondContact CE1-CG1 3.32Å
225	D	96.7	Very high	96	Very high	13 Å²	13	30 Å²	30	7%	0.07	14%	0.139	C	C	.	.			trans	-152.6	120.8	-169	-162.2	-30.4	0	0	0	110.9	V223 H227 I230 C332 K338	V223-D225 WeakPolarHBondContact CG1-O 3.42Å; V223-D225 PolarHBondContact O-N 3.12Å; D225-H227 IonicContact OD1-CE1 3.55Å; D225-H227 IonicContact OD1-CG 3.78Å; D225-H227 PolarHBondContact OD1-N 3.23Å; D225-H227 IonicContact OD1-ND1 2.71Å; D225-H227 PolarHBondContact OD1-ND1 3.24Å; D225-I230 HydrophobicContact CB-CG2 4.03Å; D225-C332 HydrophobicContact CB-CB 4.5Å; D225-C332 WeakPolarHBondContact OD2-CB 3.43Å; D225-K338 IonicContact OD2-NZ 3.74Å; D225-K338 PolarHBondContact OD2-NZ 3.18Å
226	C	97.1	Very high	96.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.			trans	-124.3	14.4	-165.9	-61.4	0	0	0	0	113.2	G208 S210 I231 S422 S437	G208-C226 CarbonylContact C-O 3.59Å; G208-C226 VanDerWaalsContact CA-O 3.31Å; G208-C226 WeakPolarHBondContact CA-O 3.11Å; S210-C226 CarbonylContact O-C 3.59Å; S210-C226 VanDerWaalsContact O-CA 3.23Å; S210-C226 WeakPolarHBondContact O-CA 3.4Å; S210-C226 VanDerWaalsContact O-CB 3.24Å; S210-C226 WeakPolarHBondContact O-CB 3.5Å; S210-C226 PolarHBondContact O-N 2.92Å; C226-I231 HydrophobicContact CB-CD1 4.34Å; C226-I231 HydrophobicContact CB-CG1 4.4Å; C226-S422 WeakPolarHBondContact CB-OG 3.37Å; C226-S437 VanDerWaalsContact CB-OG 3.27Å; C226-S437 WeakPolarHBondContact CB-OG 3.45Å
227	H	96.5	Very high	96.6	Very high	20 Å²	20	21.6 Å²	21.6	9%	0.093	11%	0.107	C	C	.	.			trans	-67	141	170.5	-58.3	90	0	0	0	110.5	G208 R209 S210 D225 I229 I230 I231 H310	G208-H227 CarbonylContact O-C 3.5Å; G208-H227 WeakPolarHBondContact O-CA 3.49Å; R209-H227 VanDerWaalsContact C-CD2 3.43Å; S210-H227 PolarHBondContact O-N 2.85Å; D225-H227 IonicContact OD1-CE1 3.55Å; D225-H227 IonicContact OD1-CG 3.78Å; D225-H227 PolarHBondContact OD1-N 3.23Å; D225-H227 IonicContact OD1-ND1 2.71Å; D225-H227 PolarHBondContact OD1-ND1 3.24Å; H227-I229 PolarHBondContact O-N 3.25Å; H227-I229 VanDerWaalsContact O-N 3.16Å; H227-I230 HydrophobicContact CB-CG1 4.11Å; H227-I230 WeakPolarHBondContact O-CA 3.34Å; H227-I230 WeakPolarHBondContact O-CB 3.45Å; H227-I230 PolarHBondContact O-N 2.95Å; H227-I231 PolarHBondContact O-N 2.84Å; H227-H310 AromaticContact CE1-CD2 3.81Å; H227-H310 AromaticContact CE1-CE1 3.58Å; H227-H310 AromaticContact CE1-CG 3.65Å; H227-H310 AromaticContact CE1-ND1 3.5Å; H227-H310 AromaticContact CE1-NE2 3.79Å; H227-H310 AromaticContact NE2-CE1 3.3Å; H227-H310 PolarHBondContact NE2-CE1 3.36Å; H227-H310 VanDerWaalsContact NE2-CE1 3.3Å; H227-H310 AromaticContact NE2-ND1 3.4Å; H227-H310 PolarHBondContact NE2-ND1 2.71Å; H227-H310 AromaticContact NE2-NE2 3.89Å
228	A	97.1	Very high	96.9	Very high	9 Å²	9	20.4 Å²	20.4	7%	0.074	10%	0.098	C	C	.	.	H	α-helix	trans	-44.8	-52.7	-169.2	0	0	0	0	0	114.8	H179 A181 G208 I230 I231 A232	H179-A228 WeakPolarHBondContact O-CB 3.31Å; A181-A228 HydrophobicContact CB-CB 3.95Å; G208-A228 PolarHBondContact O-N 2.97Å; A228-I230 VanDerWaalsContact C-N 3.27Å; A228-I230 PolarHBondContact O-N 2.78Å; A228-I231 PolarHBondContact O-N 2.88Å; A228-A232 VanDerWaalsContact O-CB 3.26Å; A228-A232 WeakPolarHBondContact O-CB 3.36Å; A228-A232 PolarHBondContact O-N 3.18Å
229	I	97.2	Very high	97.1	Very high	11 Å²	11	15.5 Å²	15.5	6%	0.056	8%	0.079	C	C	.	.	H	α-helix	trans	-62.5	-32.8	-179.8	-65.8	160	0	0	0	112.1	A181 H227 R233 L279 T281 P285 L339 W342	A181-I229 HydrophobicContact CB-CB 4.39Å; A181-I229 HydrophobicContact CB-CG1 3.7Å; H227-I229 PolarHBondContact O-N 3.25Å; H227-I229 VanDerWaalsContact O-N 3.16Å; I229-R233 VanDerWaalsContact O-CB 3.31Å; I229-R233 WeakPolarHBondContact O-CB 3.31Å; I229-R233 PolarHBondContact O-N 2.76Å; I229-L279 HydrophobicContact CG2-CD2 4.13Å; I229-T281 HydrophobicContact CD1-CG2 4.22Å; I229-P285 HydrophobicContact CD1-CB 3.93Å; I229-P285 HydrophobicContact CD1-CG 3.75Å; I229-L339 HydrophobicContact CD1-CD1 4.37Å; I229-L339 HydrophobicContact CG2-CD2 4.29Å; I229-W342 HydrophobicContact CG2-CH2 4.14Å; I229-W342 HydrophobicContact CG2-CZ3 3.82Å
230	I	98.3	Very high	97.4	Very high	11 Å²	11	13.7 Å²	13.7	6%	0.056	7%	0.066	C	C	.	.	H	α-helix	trans	-76.5	-40	-178.7	-46.1	-50.7	0	0	0	110.5	D225 H227 A228 R234 K338 W342	D225-I230 HydrophobicContact CB-CG2 4.03Å; H227-I230 HydrophobicContact CB-CG1 4.11Å; H227-I230 WeakPolarHBondContact O-CA 3.34Å; H227-I230 WeakPolarHBondContact O-CB 3.45Å; H227-I230 PolarHBondContact O-N 2.95Å; A228-I230 VanDerWaalsContact C-N 3.27Å; A228-I230 PolarHBondContact O-N 2.78Å; I230-R234 VanDerWaalsContact O-CG 3.27Å; I230-R234 WeakPolarHBondContact O-CG 3.33Å; I230-R234 PolarHBondContact O-N 2.7Å; I230-R234 VanDerWaalsContact O-N 3.08Å; I230-K338 HydrophobicContact CD1-CD 3.42Å; I230-K338 VanDerWaalsContact CD1-CD 3.42Å; I230-K338 HydrophobicContact CG1-CD 4.39Å; I230-W342 HydrophobicContact CD1-CH2 3.86Å; I230-W342 HydrophobicContact CD1-CZ2 4.35Å
231	I	98.6	Very high	97.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.4	-48.5	172.1	-67.2	-63.5	0	0	0	110.5	V223 C226 H227 A228 R233 R234 A235 I423 N424 L458	V223-I231 HydrophobicContact CG1-CD1 3.94Å; C226-I231 HydrophobicContact CB-CD1 4.34Å; C226-I231 HydrophobicContact CB-CG1 4.4Å; H227-I231 PolarHBondContact O-N 2.84Å; A228-I231 PolarHBondContact O-N 2.88Å; I231-R233 VanDerWaalsContact C-N 3.31Å; I231-R233 PolarHBondContact O-N 3.3Å; I231-R234 PolarHBondContact O-N 2.87Å; I231-A235 WeakPolarHBondContact O-CB 3.28Å; I231-A235 PolarHBondContact O-N 2.88Å; I231-I423 VanDerWaalsContact CG2-O 3.29Å; I231-I423 WeakPolarHBondContact CG2-O 3.49Å; I231-N424 HydrophobicContact CG2-CB 3.52Å; I231-L458 HydrophobicContact CD1-CD1 3.87Å; I231-L458 HydrophobicContact CG2-CD1 3.84Å
232	A	98.8	Very high	97.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58	-42.1	176.9	0	0	0	0	0	111.6	A181 F183 A228 R234 A235 L236	A181-A232 HydrophobicContact CB-CB 4.06Å; F183-A232 HydrophobicContact CD2-CB 3.98Å; F183-A232 HydrophobicContact CE2-CB 4.08Å; A228-A232 VanDerWaalsContact O-CB 3.26Å; A228-A232 WeakPolarHBondContact O-CB 3.36Å; A228-A232 PolarHBondContact O-N 3.18Å; A232-R234 PolarHBondContact O-N 2.86Å; A232-A235 PolarHBondContact O-N 2.83Å; A232-L236 WeakPolarHBondContact O-CB 3.42Å; A232-L236 PolarHBondContact O-N 3.14Å
233	R	98.8	Very high	98	Very high	35 Å²	35	10.9 Å²	10.9	13%	0.132	5%	0.05	C	C	.	.	H	α-helix	trans	-65.1	-38.3	175	179.2	179.6	164.7	-93.6	-9.9	112.1	F183 I229 I231 L236 L237 W342 V347	F183-R233 HydrophobicContact CE2-CB 3.92Å; F183-R233 HydrophobicContact CZ-CB 4.33Å; I229-R233 VanDerWaalsContact O-CB 3.31Å; I229-R233 WeakPolarHBondContact O-CB 3.31Å; I229-R233 PolarHBondContact O-N 2.76Å; I231-R233 VanDerWaalsContact C-N 3.31Å; I231-R233 PolarHBondContact O-N 3.3Å; R233-L236 WeakPolarHBondContact O-CA 3.42Å; R233-L236 VanDerWaalsContact O-CB 3.31Å; R233-L236 WeakPolarHBondContact O-CB 3.3Å; R233-L236 PolarHBondContact O-N 3.47Å; R233-L237 HydrophobicContact CG-CD2 4.4Å; R233-L237 VanDerWaalsContact O-CG 3.3Å; R233-L237 WeakPolarHBondContact O-CG 3.31Å; R233-L237 PolarHBondContact O-N 3.45Å; R233-W342 HydrophobicContact CB-CH2 4.19Å; R233-W342 HydrophobicContact CB-CZ3 4.42Å; R233-W342 HydrophobicContact CG-CH2 4.33Å; R233-V347 PolarHBondContact NE-O 2.92Å; R233-V347 PolarHBondContact NH2-O 2.82Å
234	R	98.8	Very high	98.1	Very high	30 Å²	30	10.9 Å²	10.9	11%	0.113	5%	0.05	C	C	.	.	H	α-helix	trans	-73.7	-32.2	179.5	-69.2	172.8	82.2	-127.4	14	111.9	V223 I230 I231 A232 L237 R238 L458	V223-R234 VanDerWaalsContact CG2-NH1 3.3Å; I230-R234 VanDerWaalsContact O-CG 3.27Å; I230-R234 WeakPolarHBondContact O-CG 3.33Å; I230-R234 PolarHBondContact O-N 2.7Å; I230-R234 VanDerWaalsContact O-N 3.08Å; I231-R234 PolarHBondContact O-N 2.87Å; A232-R234 PolarHBondContact O-N 2.86Å; R234-L237 PolarHBondContact O-N 3.39Å; R234-R238 PolarHBondContact O-N 2.91Å; R234-L458 HydrophobicContact CB-CB 4.28Å; R234-L458 HydrophobicContact CB-CD1 4.09Å; R234-L458 HydrophobicContact CB-CD2 4.4Å; R234-L458 VanDerWaalsContact NH1-CB 3.34Å; R234-L458 PolarHBondContact NH1-O 3.12Å; R234-L458 PolarHBondContact NH2-O 2.66Å
235	A	98.9	Very high	98.1	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.4	-39	165.9	0	0	0	0	0	111.4	A204 I231 A232 R238 F239 C426 L458	A204-A235 HydrophobicContact CB-CB 3.94Å; I231-A235 WeakPolarHBondContact O-CB 3.28Å; I231-A235 PolarHBondContact O-N 2.88Å; A232-A235 PolarHBondContact O-N 2.83Å; A235-R238 WeakPolarHBondContact O-CB 3.24Å; A235-R238 PolarHBondContact O-N 2.98Å; A235-F239 PolarHBondContact O-N 3.26Å; A235-C426 HydrophobicContact CB-CB 4.16Å; A235-C426 VanDerWaalsContact O-CB 3.26Å; A235-C426 WeakPolarHBondContact O-CB 3.47Å; A235-L458 HydrophobicContact CB-CD2 4.17Å
236	L	98.9	Very high	98.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-60.3	-45.3	171.9	-177.7	71.7	0	0	0	110.8	F183 V203 A204 A232 R233 R238 F239 L240 L277 V347	F183-L236 HydrophobicContact CB-CD1 4.14Å; F183-L236 HydrophobicContact CD1-CD2 3.93Å; F183-L236 HydrophobicContact CD2-CB 4.12Å; F183-L236 HydrophobicContact CD2-CD2 4.18Å; F183-L236 HydrophobicContact CE1-CD2 4.11Å; F183-L236 HydrophobicContact CE2-CD2 4.39Å; F183-L236 HydrophobicContact CG-CB 4.43Å; F183-L236 HydrophobicContact CG-CD1 4.43Å; F183-L236 HydrophobicContact CG-CD2 3.95Å; F183-L236 HydrophobicContact CZ-CD2 4.34Å; V203-L236 HydrophobicContact CG2-CD1 3.76Å; A204-L236 VanDerWaalsContact CB-CA 3.47Å; A204-L236 HydrophobicContact CB-CB 3.81Å; A204-L236 HydrophobicContact CB-CD1 4.35Å; A232-L236 WeakPolarHBondContact O-CB 3.42Å; A232-L236 PolarHBondContact O-N 3.14Å; R233-L236 WeakPolarHBondContact O-CA 3.42Å; R233-L236 VanDerWaalsContact O-CB 3.31Å; R233-L236 WeakPolarHBondContact O-CB 3.3Å; R233-L236 PolarHBondContact O-N 3.47Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.03Å; L236-F239 HydrophobicContact CD1-CD1 4.03Å; L236-F239 CarbonylContact O-C 3.5Å; L236-F239 WeakPolarHBondContact O-CA 3.48Å; L236-F239 WeakPolarHBondContact O-CB 3.35Å; L236-F239 PolarHBondContact O-N 2.9Å; L236-L240 HydrophobicContact CD1-CD2 4.46Å; L236-L240 HydrophobicContact CG-CD1 4.28Å; L236-L240 HydrophobicContact CG-CG 4.26Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 2.97Å; L236-L277 HydrophobicContact CD1-CD1 4.24Å; L236-L277 HydrophobicContact CD2-CD1 4.29Å; L236-L277 HydrophobicContact CD2-CD2 3.93Å; L236-V347 HydrophobicContact CD2-CG2 3.8Å
237	L	98.9	Very high	98.1	Very high	17 Å²	17	13.7 Å²	13.7	9%	0.089	6%	0.064	C	C	.	.	H	α-helix	trans	-58.5	-38.5	178.2	-54.2	-161.4	0	0	0	112.1	R233 R234 L240 Y241 V347 Q348 L352 L463	R233-L237 HydrophobicContact CG-CD2 4.4Å; R233-L237 VanDerWaalsContact O-CG 3.3Å; R233-L237 WeakPolarHBondContact O-CG 3.31Å; R233-L237 PolarHBondContact O-N 3.45Å; R234-L237 PolarHBondContact O-N 3.39Å; L237-L240 HydrophobicContact CD2-CD1 4.41Å; L237-L240 PolarHBondContact O-N 2.97Å; L237-Y241 WeakPolarHBondContact O-CD2 3.5Å; L237-Y241 PolarHBondContact O-N 2.91Å; L237-V347 WeakPolarHBondContact CD2-O 3.44Å; L237-Q348 WeakPolarHBondContact CD2-O 3.43Å; L237-L352 HydrophobicContact CB-CD1 4.06Å; L237-L352 HydrophobicContact CD2-CD1 3.97Å; L237-L352 HydrophobicContact CG-CD1 4.41Å; L237-L463 HydrophobicContact CB-CD2 4.03Å
238	R	98.3	Very high	98	Very high	7 Å²	7	15.9 Å²	15.9	3%	0.026	7%	0.073	C	C	.	.	H	α-helix	trans	-63.6	-43	172.2	-70.2	178.3	65.1	-117.9	-6.8	112.3	R234 A235 L236 Y241 K242 C426 D429 R457 L458 L463 Y466	R234-R238 PolarHBondContact O-N 2.91Å; A235-R238 WeakPolarHBondContact O-CB 3.24Å; A235-R238 PolarHBondContact O-N 2.98Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.03Å; R238-Y241 PolarHBondContact O-N 3.41Å; R238-K242 WeakPolarHBondContact O-CG 3.34Å; R238-K242 PolarHBondContact O-N 3.22Å; R238-C426 PolarHBondContact NH1-SG 2.97Å; R238-C426 VanDerWaalsContact NH1-SG 3.45Å; R238-D429 IonicContact CZ-OD1 3Å; R238-D429 IonicContact CZ-OD2 3.7Å; R238-D429 VanDerWaalsContact NH1-CG 3.3Å; R238-D429 IonicContact NH1-OD1 3.82Å; R238-D429 PolarHBondContact NH1-OD1 2.84Å; R238-D429 VanDerWaalsContact NH1-OD1 3.09Å; R238-D429 IonicContact NH1-OD2 3.03Å; R238-D429 PolarHBondContact NH1-OD2 3.38Å; R238-D429 IonicContact NH2-OD1 2.61Å; R238-D429 PolarHBondContact NH2-OD1 2.93Å; R238-D429 IonicContact NH2-OD2 2.62Å; R238-R457 VanDerWaalsContact CD-O 3.3Å; R238-R457 WeakPolarHBondContact CD-O 3.35Å; R238-L458 HydrophobicContact CG-CD2 4.39Å; R238-L463 HydrophobicContact CG-CD2 3.63Å; R238-Y466 HydrophobicContact CG-CE2 4.37Å
239	F	98.8	Very high	97.8	Very high	6 Å²	6	19.3 Å²	19.3	3%	0.026	9%	0.088	C	C	.	.	H	α-helix	trans	-60.5	-44.7	174.6	168.1	-100.8	0	0	0	111.4	L185 V203 A235 L236 Y241 K242 Q243 I259 C426 L427	L185-F239 HydrophobicContact CD1-CE1 4.04Å; L185-F239 HydrophobicContact CD1-CZ 4.2Å; V203-F239 HydrophobicContact CB-CD1 3.79Å; V203-F239 HydrophobicContact CB-CD2 4.18Å; V203-F239 HydrophobicContact CB-CE1 3.68Å; V203-F239 HydrophobicContact CB-CE2 4.1Å; V203-F239 HydrophobicContact CB-CG 4.03Å; V203-F239 HydrophobicContact CB-CZ 3.86Å; V203-F239 HydrophobicContact CG1-CD1 4.29Å; V203-F239 HydrophobicContact CG1-CD2 4.47Å; V203-F239 HydrophobicContact CG1-CE1 3.67Å; V203-F239 HydrophobicContact CG1-CE2 3.89Å; V203-F239 HydrophobicContact CG1-CZ 3.45Å; V203-F239 VanDerWaalsContact CG1-CZ 3.45Å; V203-F239 HydrophobicContact CG2-CD1 4.16Å; V203-F239 HydrophobicContact CG2-CE1 4.12Å; A235-F239 PolarHBondContact O-N 3.26Å; L236-F239 HydrophobicContact CD1-CD1 4.03Å; L236-F239 CarbonylContact O-C 3.5Å; L236-F239 WeakPolarHBondContact O-CA 3.48Å; L236-F239 WeakPolarHBondContact O-CB 3.35Å; L236-F239 PolarHBondContact O-N 2.9Å; F239-Y241 VanDerWaalsContact C-N 3.33Å; F239-Y241 PolarHBondContact O-N 3.27Å; F239-K242 WeakPolarHBondContact O-CA 3.31Å; F239-K242 WeakPolarHBondContact O-CB 3.26Å; F239-K242 PolarHBondContact O-N 3Å; F239-Q243 HydrophobicContact CD1-CG 4.27Å; F239-Q243 HydrophobicContact CD2-CG 4.36Å; F239-Q243 HydrophobicContact CE1-CG 3.81Å; F239-Q243 HydrophobicContact CE2-CG 3.89Å; F239-Q243 VanDerWaalsContact CE2-NE2 3.33Å; F239-Q243 HydrophobicContact CZ-CG 3.59Å; F239-Q243 WeakPolarHBondContact O-CG 3.3Å; F239-Q243 PolarHBondContact O-N 3.05Å; F239-I259 HydrophobicContact CE1-CD1 3.82Å; F239-I259 HydrophobicContact CZ-CD1 4.31Å; F239-C426 HydrophobicContact CB-CB 4.01Å; F239-L427 HydrophobicContact CD2-CB 3.95Å; F239-L427 HydrophobicContact CE2-CB 4.1Å; F239-L427 HydrophobicContact CE2-CD2 4.12Å
240	L	98.8	Very high	97.4	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-61	-39.3	176	-59.7	178.1	0	0	0	111.8	L236 L237 Q243 L244 I259 F260 L352 I356 L359	L236-L240 HydrophobicContact CD1-CD2 4.46Å; L236-L240 HydrophobicContact CG-CD1 4.28Å; L236-L240 HydrophobicContact CG-CG 4.26Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 2.97Å; L237-L240 HydrophobicContact CD2-CD1 4.41Å; L237-L240 PolarHBondContact O-N 2.97Å; L240-Q243 WeakPolarHBondContact O-CB 3.28Å; L240-Q243 PolarHBondContact O-N 3.38Å; L240-L244 WeakPolarHBondContact O-CG 3.45Å; L240-L244 PolarHBondContact O-N 3.25Å; L240-I259 HydrophobicContact CD2-CD1 4.08Å; L240-F260 HydrophobicContact CD2-CE2 4.3Å; L240-F260 HydrophobicContact CD2-CZ 3.97Å; L240-L352 HydrophobicContact CB-CD1 4Å; L240-L352 HydrophobicContact CB-CD2 4.29Å; L240-L352 HydrophobicContact CD1-CD1 3.99Å; L240-I356 HydrophobicContact CD1-CD1 4.26Å; L240-L359 HydrophobicContact CD1-CD1 3.68Å; L240-L359 HydrophobicContact CD2-CD1 3.78Å; L240-L359 HydrophobicContact CG-CD1 4.38Å
241	Y	98.7	Very high	97.1	Very high	4 Å²	4	26 Å²	26	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-39.1	170.5	-72.9	-59.4	0	0	0	113.2	L237 R238 F239 Q243 L244 L245 L351 L352 L463 Y466 F467 V470	L237-Y241 WeakPolarHBondContact O-CD2 3.5Å; L237-Y241 PolarHBondContact O-N 2.91Å; R238-Y241 PolarHBondContact O-N 3.41Å; F239-Y241 VanDerWaalsContact C-N 3.33Å; F239-Y241 PolarHBondContact O-N 3.27Å; Y241-Q243 VanDerWaalsContact C-N 3.28Å; Y241-Q243 PolarHBondContact O-N 2.83Å; Y241-L244 HydrophobicContact CD1-CD1 4.45Å; Y241-L244 PolarHBondContact O-N 3.33Å; Y241-L245 WeakPolarHBondContact O-CG 3.4Å; Y241-L245 PolarHBondContact O-N 2.78Å; Y241-L351 WeakPolarHBondContact OH-CB 3.36Å; Y241-L352 HydrophobicContact CD1-CD2 3.63Å; Y241-L352 HydrophobicContact CD1-CG 4.4Å; Y241-L352 HydrophobicContact CE1-CD2 3.43Å; Y241-L352 VanDerWaalsContact CE1-CD2 3.43Å; Y241-L352 HydrophobicContact CE1-CG 3.81Å; Y241-L352 HydrophobicContact CE2-CD1 4.35Å; Y241-L352 HydrophobicContact CE2-CD2 4.44Å; Y241-L352 HydrophobicContact CE2-CG 4.25Å; Y241-L352 HydrophobicContact CG-CD2 4.2Å; Y241-L463 HydrophobicContact CD2-CD2 4.32Å; Y241-L463 HydrophobicContact CE2-CD2 4.14Å; Y241-L463 WeakPolarHBondContact CE2-O 3.34Å; Y241-Y466 HydrophobicContact CD2-CG 4.29Å; Y241-Y466 HydrophobicContact CG-CG 4.28Å; Y241-F467 HydrophobicContact CE1-CB 3.97Å; Y241-F467 HydrophobicContact CE1-CD2 4.48Å; Y241-V470 HydrophobicContact CD1-CG2 4.18Å
242	K	98	Very high	96.7	Very high	31 Å²	31	30.6 Å²	30.6	14%	0.135	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-39.6	172.2	-67.1	179	-168.6	-178	0	111.3	R238 F239 L245 L246 L427 G428 D429	R238-K242 WeakPolarHBondContact O-CG 3.34Å; R238-K242 PolarHBondContact O-N 3.22Å; F239-K242 WeakPolarHBondContact O-CA 3.31Å; F239-K242 WeakPolarHBondContact O-CB 3.26Å; F239-K242 PolarHBondContact O-N 3Å; K242-L245 PolarHBondContact O-N 2.69Å; K242-L246 WeakPolarHBondContact O-CG 3.46Å; K242-L246 PolarHBondContact O-N 3.37Å; K242-L427 WeakPolarHBondContact CD-O 3.42Å; K242-L427 PolarHBondContact NZ-O 2.79Å; K242-G428 PolarHBondContact NZ-O 2.83Å; K242-D429 VanDerWaalsContact NZ-N 3.17Å; K242-D429 IonicContact NZ-OD1 2.8Å; K242-D429 PolarHBondContact NZ-OD1 2.61Å
243	Q	98.4	Very high	96.3	Very high	15 Å²	15	35.3 Å²	35.3	7%	0.07	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-41.2	175.2	-65	-63.2	-55	0	0	111.9	F239 L240 Y241 L246 F247 C258 I259 F260	F239-Q243 HydrophobicContact CD1-CG 4.27Å; F239-Q243 HydrophobicContact CD2-CG 4.36Å; F239-Q243 HydrophobicContact CE1-CG 3.81Å; F239-Q243 HydrophobicContact CE2-CG 3.89Å; F239-Q243 VanDerWaalsContact CE2-NE2 3.33Å; F239-Q243 HydrophobicContact CZ-CG 3.59Å; F239-Q243 WeakPolarHBondContact O-CG 3.3Å; F239-Q243 PolarHBondContact O-N 3.05Å; L240-Q243 WeakPolarHBondContact O-CB 3.28Å; L240-Q243 PolarHBondContact O-N 3.38Å; Y241-Q243 VanDerWaalsContact C-N 3.28Å; Y241-Q243 PolarHBondContact O-N 2.83Å; Q243-L246 WeakPolarHBondContact O-CB 3.41Å; Q243-L246 PolarHBondContact O-N 2.97Å; Q243-F247 PolarHBondContact O-N 3.1Å; Q243-C258 PolarHBondContact O-SG 3.01Å; Q243-C258 VanDerWaalsContact OE1-CA 3.31Å; Q243-I259 HydrophobicContact CB-CD1 4.46Å; Q243-I259 HydrophobicContact CB-CG1 4.12Å; Q243-I259 HydrophobicContact CG-CD1 3.91Å; Q243-I259 HydrophobicContact CG-CG1 3.87Å; Q243-F260 HydrophobicContact CB-CD2 3.91Å; Q243-F260 HydrophobicContact CB-CE2 3.86Å
244	L	98.1	Very high	95.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-36.8	173.7	-69.8	174.4	0	0	0	112.8	L240 Y241 F247 F248 F260 L269 L352 F355 I356 V470	L240-L244 WeakPolarHBondContact O-CG 3.45Å; L240-L244 PolarHBondContact O-N 3.25Å; Y241-L244 HydrophobicContact CD1-CD1 4.45Å; Y241-L244 PolarHBondContact O-N 3.33Å; L244-F247 WeakPolarHBondContact O-CB 3.23Å; L244-F247 PolarHBondContact O-N 3.46Å; L244-F248 WeakPolarHBondContact O-CD2 3.38Å; L244-F248 PolarHBondContact O-N 3.2Å; L244-F260 HydrophobicContact CD2-CD2 4.11Å; L244-F260 HydrophobicContact CD2-CE2 4.36Å; L244-F260 HydrophobicContact CG-CD2 4.48Å; L244-F260 HydrophobicContact CG-CE2 4.36Å; L244-L269 HydrophobicContact CD2-CD1 3.71Å; L244-L352 HydrophobicContact CD1-CD2 3.52Å; L244-F355 HydrophobicContact CD1-CB 3.89Å; L244-F355 HydrophobicContact CD1-CD2 3.86Å; L244-F355 HydrophobicContact CD1-CG 4.28Å; L244-F355 HydrophobicContact CD2-CB 4.38Å; L244-I356 HydrophobicContact CD1-CG2 4.09Å; L244-I356 HydrophobicContact CD2-CG2 3.68Å; L244-I356 HydrophobicContact CG-CG2 4.28Å; L244-V470 HydrophobicContact CB-CG1 3.86Å; L244-V470 HydrophobicContact CB-CG2 3.95Å; L244-V470 HydrophobicContact CD1-CG1 4.01Å; L244-V470 HydrophobicContact CG-CG1 4.49Å
245	L	97.1	Very high	95.3	Very high	21 Å²	21	38.6 Å²	38.6	11%	0.11	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-46.9	170.8	-66.9	175.2	0	0	0	111.1	Y241 K242 F247 F248 E249 Y466 R469 V470 L473	Y241-L245 WeakPolarHBondContact O-CG 3.4Å; Y241-L245 PolarHBondContact O-N 2.78Å; K242-L245 PolarHBondContact O-N 2.69Å; L245-F247 VanDerWaalsContact C-N 3.25Å; L245-F247 PolarHBondContact O-N 3.41Å; L245-F248 CarbonylContact O-C 3.53Å; L245-F248 PolarHBondContact O-N 2.82Å; L245-E249 PolarHBondContact O-N 2.69Å; L245-E249 VanDerWaalsContact O-N 3.11Å; L245-Y466 HydrophobicContact CD1-CD1 4.12Å; L245-Y466 HydrophobicContact CD1-CE1 4.16Å; L245-R469 HydrophobicContact CD2-CB 4.47Å; L245-R469 HydrophobicContact CD2-CG 3.8Å; L245-V470 HydrophobicContact CD2-CG2 3.79Å; L245-V470 HydrophobicContact CG-CG2 4.1Å; L245-L473 HydrophobicContact CD2-CD1 3.63Å
246	L	96.5	Very high	94.8	Very high	42 Å²	42	45.8 Å²	45.8	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-34.6	174.2	-66.9	168.5	0	0	0	112.7	K242 Q243 F248 E249 T254 K255 C258	K242-L246 WeakPolarHBondContact O-CG 3.46Å; K242-L246 PolarHBondContact O-N 3.37Å; Q243-L246 WeakPolarHBondContact O-CB 3.41Å; Q243-L246 PolarHBondContact O-N 2.97Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 3.01Å; L246-E249 PolarHBondContact O-N 2.89Å; L246-T254 HydrophobicContact CD2-CG2 3.4Å; L246-K255 WeakPolarHBondContact O-CA 3.37Å; L246-C258 HydrophobicContact CB-CB 4.21Å
247	F	96.1	Very high	94.4	Very high	24 Å²	24	49.3 Å²	49.3	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-31	175.6	-174.2	-92.7	0	0	0	112.8	Q243 L244 L245 K255 L269	Q243-F247 PolarHBondContact O-N 3.1Å; L244-F247 WeakPolarHBondContact O-CB 3.23Å; L244-F247 PolarHBondContact O-N 3.46Å; L245-F247 VanDerWaalsContact C-N 3.25Å; L245-F247 PolarHBondContact O-N 3.41Å; F247-K255 WeakPolarHBondContact O-CD 3.37Å; F247-K255 WeakPolarHBondContact O-CE 3.41Å; F247-K255 PolarHBondContact O-NZ 2.85Å; F247-L269 HydrophobicContact CB-CD1 4.4Å; F247-L269 HydrophobicContact CD1-CD1 3.58Å; F247-L269 HydrophobicContact CD2-CD1 3.88Å; F247-L269 HydrophobicContact CE1-CD1 3.71Å; F247-L269 HydrophobicContact CE1-CD2 3.8Å; F247-L269 HydrophobicContact CE1-CG 4.41Å; F247-L269 HydrophobicContact CE2-CD1 3.99Å; F247-L269 HydrophobicContact CE2-CD2 4.06Å; F247-L269 HydrophobicContact CG-CD1 3.68Å; F247-L269 HydrophobicContact CZ-CD1 3.91Å; F247-L269 HydrophobicContact CZ-CD2 3.52Å; F247-L269 HydrophobicContact CZ-CG 4.39Å
248	F	94.4	Very high	94.3	Very high	66 Å²	66	48.6 Å²	48.6	29%	0.289	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.5	178.3	-66	-65.2	0	0	0	114	L244 L245 L246 V470 L473	L244-F248 WeakPolarHBondContact O-CD2 3.38Å; L244-F248 PolarHBondContact O-N 3.2Å; L245-F248 CarbonylContact O-C 3.53Å; L245-F248 PolarHBondContact O-N 2.82Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 3.01Å; F248-V470 HydrophobicContact CE2-CG1 4.1Å; F248-L473 HydrophobicContact CB-CB 3.88Å; F248-L473 HydrophobicContact CB-CD1 4.24Å; F248-L473 HydrophobicContact CB-CG 4.47Å; F248-L473 HydrophobicContact CD1-CB 4.49Å; F248-L473 HydrophobicContact CD2-CB 3.97Å; F248-L473 HydrophobicContact CG-CB 3.87Å
249	E	92.9	Very high	94.2	Very high	81 Å²	81	49.1 Å²	49.1	38%	0.379	28%	0.275	S	S	.	.			trans	-67.3	146.1	171.8	-75.5	-59.6	158.8	0	0	111.9	L245 L246 T254	L245-E249 PolarHBondContact O-N 2.69Å; L245-E249 VanDerWaalsContact O-N 3.11Å; L246-E249 PolarHBondContact O-N 2.89Å; E249-T254 HydrophobicContact CB-CG2 4.07Å; E249-T254 HydrophobicContact CG-CG2 4Å
250	A	89.6	Confident	94.2	Very high	100 Å²	100	49 Å²	49	83%	0.826	27%	0.274	S	S	*	.	S	Bend	trans	-79.7	-23.6	-176.5	0	0	0	0	0	113.5	P252	A250-P252 WeakPolarHBondContact O-CD 3.44Å
251	D	92.2	Very high	94	Very high	62 Å²	62	51.6 Å²	51.6	33%	0.332	29%	0.286	S	S	.	.			trans	-76.3	120.5	174.3	166.2	39.6	0	0	0	111	T253 T254 K255	D251-T253 VanDerWaalsContact C-N 3.25Å; D251-T253 PolarHBondContact O-N 2.98Å; D251-T253 PolarHBondContact OD1-N 3.45Å; D251-T253 PolarHBondContact OD1-OG1 3.45Å; D251-T253 PolarHBondContact OD2-N 3.38Å; D251-T253 PolarHBondContact OD2-OG1 3.45Å; D251-T254 PolarHBondContact O-N 3.21Å; D251-T254 WeakPolarHBondContact OD2-CB 3.21Å; D251-T254 PolarHBondContact OD2-N 3.08Å; D251-T254 PolarHBondContact OD2-OG1 3.44Å; D251-K255 WeakPolarHBondContact O-CB 3.31Å; D251-K255 PolarHBondContact O-N 2.95Å
252	P	90.3	Very high	93.8	Very high	97 Å²	97	55.4 Å²	55.4	63%	0.63	31%	0.314	S	S	*	.	H	α-helix	trans	-57	-33.6	176.3	-25.3	35.6	0	0	0	114	A250 K255 Q256	A250-P252 WeakPolarHBondContact O-CD 3.44Å; P252-K255 PolarHBondContact O-N 2.7Å; P252-Q256 WeakPolarHBondContact O-CB 3.3Å; P252-Q256 PolarHBondContact O-N 2.99Å
253	T	88.8	Confident	93.4	Very high	100 Å²	100	54.7 Å²	54.7	61%	0.613	31%	0.313	S	S	*	.	H	α-helix	trans	-72.9	-44.9	-175	79.4	0	0	0	0	111.5	D251 Q256 S257	D251-T253 VanDerWaalsContact C-N 3.25Å; D251-T253 PolarHBondContact O-N 2.98Å; D251-T253 PolarHBondContact OD1-N 3.45Å; D251-T253 PolarHBondContact OD1-OG1 3.45Å; D251-T253 PolarHBondContact OD2-N 3.38Å; D251-T253 PolarHBondContact OD2-OG1 3.45Å; T253-Q256 PolarHBondContact O-N 2.92Å; T253-S257 PolarHBondContact O-N 3.13Å
254	T	86.8	Confident	92.8	Very high	52 Å²	52	60.3 Å²	60.3	32%	0.319	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-45.3	171.1	-62.6	0	0	0	0	110.7	L246 E249 D251 Q256 S257	L246-T254 HydrophobicContact CD2-CG2 3.4Å; E249-T254 HydrophobicContact CB-CG2 4.07Å; E249-T254 HydrophobicContact CG-CG2 4Å; D251-T254 PolarHBondContact O-N 3.21Å; D251-T254 WeakPolarHBondContact OD2-CB 3.21Å; D251-T254 PolarHBondContact OD2-N 3.08Å; D251-T254 PolarHBondContact OD2-OG1 3.44Å; T254-Q256 VanDerWaalsContact C-N 3.34Å; T254-Q256 PolarHBondContact O-N 3.37Å; T254-S257 WeakPolarHBondContact O-CB 3.46Å; T254-S257 PolarHBondContact O-N 2.91Å; T254-S257 PolarHBondContact O-OG 3.13Å
255	K	89.8	Confident	92	Very high	81 Å²	81	67.4 Å²	67.4	35%	0.352	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-37.2	176.6	179.5	165	179	144.1	0	113.2	L246 F247 D251 P252 S257 C258	L246-K255 WeakPolarHBondContact O-CA 3.37Å; F247-K255 WeakPolarHBondContact O-CD 3.37Å; F247-K255 WeakPolarHBondContact O-CE 3.41Å; F247-K255 PolarHBondContact O-NZ 2.85Å; D251-K255 WeakPolarHBondContact O-CB 3.31Å; D251-K255 PolarHBondContact O-N 2.95Å; P252-K255 PolarHBondContact O-N 2.7Å; K255-S257 PolarHBondContact O-N 2.89Å; K255-C258 VanDerWaalsContact O-CB 3.23Å; K255-C258 WeakPolarHBondContact O-CB 3.48Å; K255-C258 PolarHBondContact O-N 2.83Å; K255-C258 VanDerWaalsContact O-N 3.1Å
256	Q	89.1	Confident	91.5	Very high	152 Å²	152	68 Å²	68	71%	0.71	39%	0.392	S	S	*	.	H	α-helix	trans	-62.7	-27.7	178.1	-164.7	171.3	20	0	0	112.6	P252 T253 T254 C258 K272	P252-Q256 WeakPolarHBondContact O-CB 3.3Å; P252-Q256 PolarHBondContact O-N 2.99Å; T253-Q256 PolarHBondContact O-N 2.92Å; T254-Q256 VanDerWaalsContact C-N 3.34Å; T254-Q256 PolarHBondContact O-N 3.37Å; Q256-C258 PolarHBondContact O-N 3.13Å; Q256-K272 PolarHBondContact O-NZ 3.18Å
257	S	91	Very high	91.2	Very high	74 Å²	74	73 Å²	73	52%	0.517	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.5	176.1	81.2	0	0	0	0	115	T253 T254 K255	T253-S257 PolarHBondContact O-N 3.13Å; T254-S257 WeakPolarHBondContact O-CB 3.46Å; T254-S257 PolarHBondContact O-N 2.91Å; T254-S257 PolarHBondContact O-OG 3.13Å; K255-S257 PolarHBondContact O-N 2.89Å
258	C	96.3	Very high	91.1	Very high	3 Å²	3	72.2 Å²	72.2	2%	0.02	41%	0.411	C	S	.	.			trans	-65.4	140.8	175.7	-175.8	0	0	0	0	111.6	Q243 L246 K255 Q256 F260 K272	Q243-C258 PolarHBondContact O-SG 3.01Å; Q243-C258 VanDerWaalsContact OE1-CA 3.31Å; L246-C258 HydrophobicContact CB-CB 4.21Å; K255-C258 VanDerWaalsContact O-CB 3.23Å; K255-C258 WeakPolarHBondContact O-CB 3.48Å; K255-C258 PolarHBondContact O-N 2.83Å; K255-C258 VanDerWaalsContact O-N 3.1Å; Q256-C258 PolarHBondContact O-N 3.13Å; C258-F260 VanDerWaalsContact C-N 3.28Å; C258-F260 PolarHBondContact O-N 3.16Å; C258-F260 PolarHBondContact SG-N 2.84Å; C258-K272 WeakPolarHBondContact O-CD 3.5Å; C258-K272 VanDerWaalsContact O-CE 3.24Å; C258-K272 WeakPolarHBondContact O-CE 3.41Å; C258-K272 PolarHBondContact O-NZ 2.86Å
259	I	97.2	Very high	91.2	Very high	17 Å²	17	69.9 Å²	69.9	9%	0.087	40%	0.401	C	S	.	.	S	Bend	trans	-76.8	-8.9	174.6	67.2	178.8	0	0	0	114.3	L185 F239 L240 Q243 L271 K272 I275	L185-I259 HydrophobicContact CD1-CD1 3.93Å; L185-I259 HydrophobicContact CD1-CG2 3.77Å; F239-I259 HydrophobicContact CE1-CD1 3.82Å; F239-I259 HydrophobicContact CZ-CD1 4.31Å; L240-I259 HydrophobicContact CD2-CD1 4.08Å; Q243-I259 HydrophobicContact CB-CD1 4.46Å; Q243-I259 HydrophobicContact CB-CG1 4.12Å; Q243-I259 HydrophobicContact CG-CD1 3.91Å; Q243-I259 HydrophobicContact CG-CG1 3.87Å; I259-L271 HydrophobicContact CB-CD1 4Å; I259-L271 HydrophobicContact CD1-CD1 3.8Å; I259-L271 HydrophobicContact CG1-CD1 3.89Å; I259-K272 WeakPolarHBondContact O-CB 3.12Å; I259-K272 WeakPolarHBondContact O-CG 3.4Å; I259-K272 PolarHBondContact O-N 2.8Å; I259-I275 HydrophobicContact CB-CD1 4.15Å; I259-I275 HydrophobicContact CG2-CD1 4.34Å
260	F	97.5	Very high	91.4	Very high	3 Å²	3	68.3 Å²	68.3	1%	0.013	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	155.5	-176.9	-65.1	-69.4	0	0	0	112.4	L240 Q243 L244 C258 L269 Q270 L271 K272 I356 L359	L240-F260 HydrophobicContact CD2-CE2 4.3Å; L240-F260 HydrophobicContact CD2-CZ 3.97Å; Q243-F260 HydrophobicContact CB-CD2 3.91Å; Q243-F260 HydrophobicContact CB-CE2 3.86Å; L244-F260 HydrophobicContact CD2-CD2 4.11Å; L244-F260 HydrophobicContact CD2-CE2 4.36Å; L244-F260 HydrophobicContact CG-CD2 4.48Å; L244-F260 HydrophobicContact CG-CE2 4.36Å; C258-F260 VanDerWaalsContact C-N 3.28Å; C258-F260 PolarHBondContact O-N 3.16Å; C258-F260 PolarHBondContact SG-N 2.84Å; F260-L269 HydrophobicContact CB-CB 4.16Å; F260-L269 HydrophobicContact CB-CD1 4.26Å; F260-Q270 WeakPolarHBondContact CA-O 3.36Å; F260-Q270 WeakPolarHBondContact CD1-O 3.32Å; F260-L271 HydrophobicContact CE1-CD1 4.4Å; F260-K272 WeakPolarHBondContact O-CE 3.45Å; F260-I356 HydrophobicContact CD1-CG2 4.09Å; F260-I356 HydrophobicContact CD2-CG2 4.45Å; F260-I356 HydrophobicContact CE1-CB 4.03Å; F260-I356 HydrophobicContact CE1-CD1 3.94Å; F260-I356 HydrophobicContact CE1-CG2 3.74Å; F260-I356 HydrophobicContact CE2-CG2 4.12Å; F260-I356 HydrophobicContact CG-CG2 4.44Å; F260-I356 HydrophobicContact CZ-CB 4.28Å; F260-I356 HydrophobicContact CZ-CD1 3.57Å; F260-I356 HydrophobicContact CZ-CG2 3.75Å; F260-L359 HydrophobicContact CE1-CD1 4.32Å; F260-L359 HydrophobicContact CE1-CD2 4.45Å; F260-L359 HydrophobicContact CZ-CD1 4.16Å
261	E	95.4	Very high	91.7	Very high	58 Å²	58	65.4 Å²	65.4	27%	0.271	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.4	172.8	62.8	-179.7	-150.8	0	0	110.7	L269 Q270 K272 P273	E261-L269 CarbonylContact O-C 3.55Å; E261-L269 VanDerWaalsContact O-CA 3.28Å; E261-L269 WeakPolarHBondContact O-CA 3.28Å; E261-L269 WeakPolarHBondContact O-CB 3.5Å; E261-Q270 HydrophobicContact CG-CG 3.6Å; E261-Q270 PolarHBondContact N-O 3.01Å; E261-Q270 PolarHBondContact O-N 3.18Å; E261-Q270 PolarHBondContact OE1-NE2 2.92Å; E261-K272 HydrophobicContact CB-CG 4.01Å; E261-K272 HydrophobicContact CG-CG 4.04Å; E261-P273 WeakPolarHBondContact OE1-CD 3.26Å; E261-P273 WeakPolarHBondContact OE2-CD 3.5Å
262	S	94.5	Very high	91.9	Very high	84 Å²	84	65.1 Å²	65.1	59%	0.587	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	134.8	172.7	-58	0	0	0	0	110.6
263	S	89.2	Confident	92	Very high	17 Å²	17	64.9 Å²	64.9	12%	0.119	36%	0.359	C	S	.	.			trans	-80.9	153	167.1	-162.8	0	0	0	0	110.5	D265 Q270 Q357	S263-D265 PolarHBondContact OG-N 3.38Å; S263-Q270 PolarHBondContact OG-OE1 3.12Å; S263-Q357 PolarHBondContact OG-NE2 3.01Å
264	T	85.2	Confident	92.2	Very high	133 Å²	133	66.5 Å²	66.5	82%	0.816	36%	0.357	S	S	*	.	S	Bend	trans	-77.6	-28.5	167.7	45.3	0	0	0	0	112.1
265	D	82.6	Confident	92.6	Very high	148 Å²	148	65.7 Å²	65.7	79%	0.791	35%	0.351	S	S	*	.	S	Bend	trans	-105.5	-3.3	-163	-50	-16.7	0	0	0	112.1	S263	S263-D265 PolarHBondContact OG-N 3.38Å
266	S	86.7	Confident	93	Very high	34 Å²	34	62.4 Å²	62.4	24%	0.238	34%	0.338	C	S	.	.			trans	-150.1	149.6	-179.8	-175.6	0	0	0	0	111.6	Q268	S266-Q268 PolarHBondContact O-N 2.97Å; S266-Q268 WeakPolarHBondContact OG-CB 3.48Å; S266-Q268 PolarHBondContact OG-N 3.19Å; S266-Q268 VanDerWaalsContact OG-N 3.11Å
267	H	88.9	Confident	93.4	Very high	147 Å²	147	55.6 Å²	55.6	68%	0.681	31%	0.306	S	S	*	.	S	Bend	trans	-69.2	-16.4	168.1	63.2	-90.1	0	0	0	112.6
268	Q	95.2	Very high	93.8	Very high	8 Å²	8	52 Å²	52	4%	0.037	28%	0.281	C	S	.	.	S	Bend	trans	-78.4	135.7	175.3	-62.6	171.8	-41.6	0	0	110.4	S266 S353 Q357	S266-Q268 PolarHBondContact O-N 2.97Å; S266-Q268 WeakPolarHBondContact OG-CB 3.48Å; S266-Q268 PolarHBondContact OG-N 3.19Å; S266-Q268 VanDerWaalsContact OG-N 3.11Å; Q268-S353 PolarHBondContact NE2-O 2.89Å; Q268-Q357 HydrophobicContact CB-CG 3.88Å
269	L	96.8	Very high	93.9	Very high	16 Å²	16	51.9 Å²	51.9	8%	0.084	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	141.8	172.3	-52.3	-178.5	0	0	0	110.7	L244 F247 F260 E261 F355 I356 Q357	L244-L269 HydrophobicContact CD2-CD1 3.71Å; F247-L269 HydrophobicContact CB-CD1 4.4Å; F247-L269 HydrophobicContact CD1-CD1 3.58Å; F247-L269 HydrophobicContact CD2-CD1 3.88Å; F247-L269 HydrophobicContact CE1-CD1 3.71Å; F247-L269 HydrophobicContact CE1-CD2 3.8Å; F247-L269 HydrophobicContact CE1-CG 4.41Å; F247-L269 HydrophobicContact CE2-CD1 3.99Å; F247-L269 HydrophobicContact CE2-CD2 4.06Å; F247-L269 HydrophobicContact CG-CD1 3.68Å; F247-L269 HydrophobicContact CZ-CD1 3.91Å; F247-L269 HydrophobicContact CZ-CD2 3.52Å; F247-L269 HydrophobicContact CZ-CG 4.39Å; F260-L269 HydrophobicContact CB-CB 4.16Å; F260-L269 HydrophobicContact CB-CD1 4.26Å; E261-L269 CarbonylContact O-C 3.55Å; E261-L269 VanDerWaalsContact O-CA 3.28Å; E261-L269 WeakPolarHBondContact O-CA 3.28Å; E261-L269 WeakPolarHBondContact O-CB 3.5Å; L269-F355 PolarHBondContact N-O 3.49Å; L269-I356 HydrophobicContact CB-CG2 4.35Å; L269-I356 VanDerWaalsContact O-CA 3.32Å; L269-I356 WeakPolarHBondContact O-CA 3.31Å; L269-Q357 PolarHBondContact O-N 3.28Å
270	Q	95.9	Very high	93.9	Very high	49 Å²	49	51.1 Å²	51.1	23%	0.229	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	155.2	175.4	66.9	-168.7	31.5	0	0	110.7	F260 E261 S263 Q357	F260-Q270 WeakPolarHBondContact CA-O 3.36Å; F260-Q270 WeakPolarHBondContact CD1-O 3.32Å; E261-Q270 HydrophobicContact CG-CG 3.6Å; E261-Q270 PolarHBondContact N-O 3.01Å; E261-Q270 PolarHBondContact O-N 3.18Å; E261-Q270 PolarHBondContact OE1-NE2 2.92Å; S263-Q270 PolarHBondContact OG-OE1 3.12Å; Q270-Q357 HydrophobicContact CB-CG 4.45Å
271	L	96.1	Very high	93.8	Very high	39 Å²	39	51.1 Å²	51.1	20%	0.204	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	135.9	169.4	-170.4	70.1	0	0	0	108.3	I259 F260 I275 L359	I259-L271 HydrophobicContact CB-CD1 4Å; I259-L271 HydrophobicContact CD1-CD1 3.8Å; I259-L271 HydrophobicContact CG1-CD1 3.89Å; F260-L271 HydrophobicContact CE1-CD1 4.4Å; L271-I275 HydrophobicContact CD1-CB 4.46Å; L271-I275 HydrophobicContact CD1-CG2 4.26Å; L271-I275 HydrophobicContact CD2-CB 4.06Å; L271-I275 HydrophobicContact CD2-CG2 4.09Å; L271-I275 VanDerWaalsContact CD2-O 3.31Å; L271-I275 WeakPolarHBondContact CD2-O 3.44Å; L271-I275 HydrophobicContact CG-CB 4.05Å; L271-I275 HydrophobicContact CG-CG2 4.29Å; L271-L359 HydrophobicContact CB-CD2 4.01Å; L271-L359 HydrophobicContact CD2-CD2 4.27Å
272	K	96.1	Very high	93.8	Very high	56 Å²	56	48.3 Å²	48.3	24%	0.243	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-55.9	146.9	179.5	-77.8	174.2	172.7	174.3	0	111.6	Q256 C258 I259 F260 E261 I275	Q256-K272 PolarHBondContact O-NZ 3.18Å; C258-K272 WeakPolarHBondContact O-CD 3.5Å; C258-K272 VanDerWaalsContact O-CE 3.24Å; C258-K272 WeakPolarHBondContact O-CE 3.41Å; C258-K272 PolarHBondContact O-NZ 2.86Å; I259-K272 WeakPolarHBondContact O-CB 3.12Å; I259-K272 WeakPolarHBondContact O-CG 3.4Å; I259-K272 PolarHBondContact O-N 2.8Å; F260-K272 WeakPolarHBondContact O-CE 3.45Å; E261-K272 HydrophobicContact CB-CG 4.01Å; E261-K272 HydrophobicContact CG-CG 4.04Å; K272-I275 HydrophobicContact CB-CD1 3.8Å; K272-I275 HydrophobicContact CB-CG1 4.23Å; K272-I275 PolarHBondContact O-N 2.92Å
273	P	93	Very high	93.5	Very high	92 Å²	92	48.2 Å²	48.2	60%	0.597	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	149.3	177.2	-26.9	34.2	0	0	0	112.2	E261 I275	E261-P273 WeakPolarHBondContact OE1-CD 3.26Å; E261-P273 WeakPolarHBondContact OE2-CD 3.5Å; P273-I275 PolarHBondContact O-N 3.15Å
274	K	92.8	Very high	93.4	Very high	133 Å²	133	49.6 Å²	49.6	58%	0.578	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	18.3	-179.7	-48.2	-168.4	170.4	-157.1	0	115.3	S187 E188	S187-K274 WeakPolarHBondContact CA-O 3.33Å; E188-K274 HydrophobicContact CB-CB 3.96Å; E188-K274 HydrophobicContact CB-CD 3.9Å; E188-K274 VanDerWaalsContact CD-CD 3.45Å; E188-K274 HydrophobicContact CG-CD 4.31Å; E188-K274 PolarHBondContact N-O 3.45Å; E188-K274 WeakPolarHBondContact OE1-CD 3.49Å; E188-K274 IonicContact OE1-NZ 2.9Å; E188-K274 PolarHBondContact OE1-NZ 3.38Å; E188-K274 VanDerWaalsContact OE2-CD 3.31Å; E188-K274 WeakPolarHBondContact OE2-CD 3.47Å; E188-K274 IonicContact OE2-NZ 2.7Å; E188-K274 PolarHBondContact OE2-NZ 2.95Å
275	I	95.8	Very high	93.4	Very high	36 Å²	36	43.5 Å²	43.5	19%	0.185	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.4	165	-48.6	-172.9	0	0	0	109.6	L185 I186 I259 L271 K272 P273	L185-I275 HydrophobicContact CB-CG2 4.33Å; L185-I275 HydrophobicContact CD1-CG2 4.26Å; L185-I275 HydrophobicContact CD2-CG2 4.07Å; L185-I275 HydrophobicContact CG-CG2 4.46Å; I186-I275 CarbonylContact O-C 3.58Å; I186-I275 VanDerWaalsContact O-CA 3.32Å; I186-I275 WeakPolarHBondContact O-CA 3.49Å; I259-I275 HydrophobicContact CB-CD1 4.15Å; I259-I275 HydrophobicContact CG2-CD1 4.34Å; L271-I275 HydrophobicContact CD1-CB 4.46Å; L271-I275 HydrophobicContact CD1-CG2 4.26Å; L271-I275 HydrophobicContact CD2-CB 4.06Å; L271-I275 HydrophobicContact CD2-CG2 4.09Å; L271-I275 VanDerWaalsContact CD2-O 3.31Å; L271-I275 WeakPolarHBondContact CD2-O 3.44Å; L271-I275 HydrophobicContact CG-CB 4.05Å; L271-I275 HydrophobicContact CG-CG2 4.29Å; K272-I275 HydrophobicContact CB-CD1 3.8Å; K272-I275 HydrophobicContact CB-CG1 4.23Å; K272-I275 PolarHBondContact O-N 2.92Å; P273-I275 PolarHBondContact O-N 3.15Å
276	S	97	Very high	93.4	Very high	12 Å²	12	38.6 Å²	38.6	8%	0.084	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.1	178	53.5	0	0	0	0	111.7	W146 L185 I186 H278	W146-S276 WeakPolarHBondContact CZ3-OG 3.35Å; L185-S276 WeakPolarHBondContact CA-O 3.39Å; I186-S276 PolarHBondContact N-O 2.82Å; I186-S276 PolarHBondContact O-N 2.84Å; S276-H278 VanDerWaalsContact CB-NE2 3.32Å; S276-H278 WeakPolarHBondContact CB-NE2 3.39Å; S276-H278 PolarHBondContact OG-NE2 2.89Å
277	L	98.5	Very high	93	Very high	8 Å²	8	37 Å²	37	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.4	-175.1	178.6	70	0	0	0	110.7	F183 L185 L236 V347 I361 T362	F183-L277 HydrophobicContact CB-CD1 4.25Å; F183-L277 HydrophobicContact CD1-CD1 3.78Å; F183-L277 HydrophobicContact CD1-CD2 4.22Å; F183-L277 HydrophobicContact CD1-CG 4.03Å; F183-L277 HydrophobicContact CE1-CD2 4.33Å; F183-L277 HydrophobicContact CE1-CG 4.49Å; F183-L277 HydrophobicContact CG-CD1 4.42Å; L185-L277 HydrophobicContact CD2-CB 4.17Å; L185-L277 HydrophobicContact CD2-CD1 3.71Å; L236-L277 HydrophobicContact CD1-CD1 4.24Å; L236-L277 HydrophobicContact CD2-CD1 4.29Å; L236-L277 HydrophobicContact CD2-CD2 3.93Å; L277-V347 HydrophobicContact CD2-CG2 3.79Å; L277-I361 CarbonylContact O-C 3.59Å; L277-I361 WeakPolarHBondContact O-CA 3.48Å; L277-T362 PolarHBondContact O-N 3.11Å
278	H	98.5	Very high	91.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157.4	-176	-57.6	-97.2	0	0	0	110.4	W146 H151 M155 F183 V184 S276 T363	W146-H278 AromaticContact CD2-CE1 3.57Å; W146-H278 AromaticContact CE3-CE1 3.48Å; W146-H278 VanDerWaalsContact CE3-CE1 3.48Å; W146-H278 AromaticContact CE3-NE2 3.62Å; W146-H278 AromaticContact CG-CE1 3.78Å; W146-H278 AromaticContact CZ3-NE2 4Å; H151-H278 AromaticContact CE1-ND1 3.86Å; M155-H278 HydrophobicContact CE-CB 3.56Å; M155-H278 HydrophobicContact SD-CB 4.21Å; F183-H278 WeakPolarHBondContact CA-O 3.27Å; V184-H278 PolarHBondContact N-O 2.89Å; V184-H278 PolarHBondContact O-N 2.86Å; S276-H278 VanDerWaalsContact CB-NE2 3.32Å; S276-H278 WeakPolarHBondContact CB-NE2 3.39Å; S276-H278 PolarHBondContact OG-NE2 2.89Å; H278-T363 PolarHBondContact ND1-OG1 3.01Å
279	L	98.4	Very high	89.9	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	118.4	-177.9	170	64.2	0	0	0	110.7	A181 A182 F183 I229 L339 I361 T363 I364 V365	A181-L279 HydrophobicContact CB-CD1 4.21Å; A182-L279 WeakPolarHBondContact O-CA 3.47Å; F183-L279 HydrophobicContact CD1-CB 4.08Å; F183-L279 HydrophobicContact CD1-CD1 4.22Å; F183-L279 HydrophobicContact CD2-CD1 4.05Å; F183-L279 HydrophobicContact CE1-CB 3.94Å; F183-L279 HydrophobicContact CE1-CD1 4.13Å; F183-L279 HydrophobicContact CE1-CD2 4.16Å; F183-L279 HydrophobicContact CE1-CG 4.31Å; F183-L279 HydrophobicContact CE2-CD1 3.91Å; F183-L279 HydrophobicContact CG-CD1 4.21Å; F183-L279 HydrophobicContact CZ-CD1 3.97Å; F183-L279 HydrophobicContact CZ-CD2 3.95Å; F183-L279 HydrophobicContact CZ-CG 4.38Å; I229-L279 HydrophobicContact CG2-CD2 4.13Å; L279-L339 HydrophobicContact CD2-CD2 4.27Å; L279-I361 HydrophobicContact CB-CG2 4.11Å; L279-I361 HydrophobicContact CD2-CD1 4Å; L279-T363 PolarHBondContact N-O 2.69Å; L279-I364 HydrophobicContact CB-CG1 4.01Å; L279-I364 HydrophobicContact CD2-CD1 4.02Å; L279-I364 HydrophobicContact CD2-CG1 4.05Å; L279-I364 HydrophobicContact CG-CG1 4.27Å; L279-I364 CarbonylContact O-C 3.56Å; L279-I364 VanDerWaalsContact O-CA 3.26Å; L279-I364 WeakPolarHBondContact O-CA 3.41Å; L279-V365 PolarHBondContact O-N 3.42Å
280	Y	97.9	Very high	88.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	143.3	164	178.3	-99.2	0	0	0	110	A156 S159 M180 A181 A182 N282 V365 D407 V409	A156-Y280 HydrophobicContact CB-CD2 4.06Å; A156-Y280 HydrophobicContact CB-CE2 3.48Å; A156-Y280 VanDerWaalsContact CB-CE2 3.48Å; S159-Y280 WeakPolarHBondContact OG-CB 3.43Å; M180-Y280 HydrophobicContact CE-CD1 4.45Å; A181-Y280 CarbonylContact C-O 3.56Å; A181-Y280 WeakPolarHBondContact CA-O 3.33Å; A182-Y280 PolarHBondContact N-O 2.92Å; A182-Y280 PolarHBondContact O-N 3.17Å; Y280-N282 HydrophobicContact CE1-CB 3.86Å; Y280-N282 WeakPolarHBondContact OH-CB 3.14Å; Y280-V365 HydrophobicContact CD2-CB 3.97Å; Y280-V365 HydrophobicContact CD2-CG1 3.74Å; Y280-V365 WeakPolarHBondContact CD2-O 3.3Å; Y280-V365 HydrophobicContact CE2-CG1 4.08Å; Y280-D407 PolarHBondContact OH-O 2.89Å; Y280-V409 HydrophobicContact CE1-CG2 3.64Å; Y280-V409 WeakPolarHBondContact OH-CG2 3.29Å; Y280-V409 PolarHBondContact OH-N 3.25Å
281	T	95.9	Very high	86.2	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	135.9	163.4	174.4	0	0	0	0	109.7	M180 I229 R283 I364 V365 L366 G367	M180-T281 WeakPolarHBondContact O-CA 3.44Å; M180-T281 PolarHBondContact O-OG1 2.85Å; I229-T281 HydrophobicContact CD1-CG2 4.22Å; T281-R283 VanDerWaalsContact CG2-O 3.3Å; T281-R283 WeakPolarHBondContact CG2-O 3.43Å; T281-R283 PolarHBondContact O-N 3.47Å; T281-R283 PolarHBondContact OG1-N 2.55Å; T281-R283 PolarHBondContact OG1-O 3.34Å; T281-I364 HydrophobicContact CG2-CG2 4.35Å; T281-V365 PolarHBondContact N-O 3.31Å; T281-L366 HydrophobicContact CG2-CD2 3.35Å; T281-G367 PolarHBondContact O-N 2.79Å
282	N	93.9	Very high	84	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-87	7.9	177.8	77.2	-17.9	0	0	0	113.5	K177 H179 M180 Y280 G367 Y408 V409	K177-N282 PolarHBondContact O-ND2 3.39Å; H179-N282 WeakPolarHBondContact CA-OD1 3.46Å; M180-N282 HydrophobicContact CG-CB 4.25Å; M180-N282 PolarHBondContact N-OD1 3.04Å; M180-N282 PolarHBondContact O-N 3.38Å; M180-N282 PolarHBondContact O-OD1 2.86Å; Y280-N282 HydrophobicContact CE1-CB 3.86Å; Y280-N282 WeakPolarHBondContact OH-CB 3.14Å; N282-G367 CarbonylContact C-O 3.47Å; N282-Y408 HydrophobicContact CB-CD2 3.92Å; N282-Y408 HydrophobicContact CB-CE2 4.07Å; N282-Y408 WeakPolarHBondContact O-CD2 3.03Å; N282-Y408 WeakPolarHBondContact O-CE2 3.34Å; N282-V409 PolarHBondContact ND2-O 3.21Å
283	R	89.9	Confident	81.5	Confident	81 Å²	81	42.2 Å²	42.2	31%	0.306	20%	0.201	S	C	.	.	S	Bend	trans	-139.2	145.8	172.7	-64.4	-67.4	175.1	175.2	-8	109.8	S178 H179 T281 Y408	S178-R283 WeakPolarHBondContact O-CG 3.33Å; S178-R283 PolarHBondContact O-NE 3.18Å; H179-R283 HydrophobicContact CB-CG 4.42Å; T281-R283 VanDerWaalsContact CG2-O 3.3Å; T281-R283 WeakPolarHBondContact CG2-O 3.43Å; T281-R283 PolarHBondContact O-N 3.47Å; T281-R283 PolarHBondContact OG1-N 2.55Å; T281-R283 PolarHBondContact OG1-O 3.34Å; R283-Y408 PolarHBondContact NH2-OH 3.11Å
284	C	86.3	Confident	79.2	Confident	46 Å²	46	47.4 Å²	47.4	31%	0.311	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-55.9	136.8	167	179.9	0	0	0	0	109.9	E286 V376	C284-E286 PolarHBondContact O-N 2.86Å; C284-V376 WeakPolarHBondContact SG-CG2 3.41Å
285	P	85.3	Confident	77	Confident	5 Å²	5	45 Å²	45	3%	0.032	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-59.7	124.6	172.7	-17.3	28.2	0	0	0	111.2	I229 L339	I229-P285 HydrophobicContact CD1-CB 3.93Å; I229-P285 HydrophobicContact CD1-CG 3.75Å; P285-L339 HydrophobicContact CB-CD1 3.73Å; P285-L339 HydrophobicContact CG-CD1 3.36Å
286	E	82.2	Confident	74.1	Confident	46 Å²	46	49 Å²	49	22%	0.215	24%	0.235	C	C	.	.	S	Bend	trans	-65.1	148.3	175.2	-57.6	-140.9	159.6	0	0	111.7	C284 K290 H310 S334 G335 S336	C284-E286 PolarHBondContact O-N 2.86Å; E286-K290 HydrophobicContact CG-CD 4.33Å; E286-K290 IonicContact OE1-NZ 3.7Å; E286-K290 PolarHBondContact OE1-NZ 3.27Å; E286-K290 IonicContact OE2-NZ 3.79Å; E286-K290 PolarHBondContact OE2-NZ 3.48Å; E286-H310 IonicContact OE2-CE1 3.77Å; E286-S334 WeakPolarHBondContact O-CB 3.47Å; E286-G335 VanDerWaalsContact O-CA 3.3Å; E286-G335 WeakPolarHBondContact O-CA 3.35Å; E286-G335 PolarHBondContact O-N 2.81Å; E286-S336 PolarHBondContact O-N 3.11Å
287	G	78.5	Confident	71.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	144	-142.5	-179.9	0	0	0	0	0	112.8	A289 K290 S334 S336	G287-A289 PolarHBondContact O-N 2.8Å; G287-A289 VanDerWaalsContact O-N 3.14Å; G287-K290 WeakPolarHBondContact O-CB 3.26Å; G287-K290 PolarHBondContact O-N 2.94Å; G287-S334 WeakPolarHBondContact CA-OG 3.43Å; G287-S336 WeakPolarHBondContact CA-OG 3.46Å
288	A	58.5	Low	69.2	Low	3 Å²	3	56.9 Å²	56.9	3%	0.025	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-55.2	-31.1	175.9	0	0	0	0	0	111.8	K290 N291 L305 Q308 S336 I379	A288-K290 PolarHBondContact O-N 3.31Å; A288-N291 PolarHBondContact O-N 2.86Å; A288-L305 HydrophobicContact CB-CD1 4.39Å; A288-Q308 HydrophobicContact CB-CG 4.37Å; A288-S336 PolarHBondContact N-OG 3.03Å; A288-I379 HydrophobicContact CB-CD1 4.02Å; A288-I379 HydrophobicContact CB-CG2 3.96Å
289	A	59.7	Low	66.7	Low	4 Å²	4	64.3 Å²	64.3	3%	0.033	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-77.1	14.8	175.6	0	0	0	0	0	115.7	G287 F292 V376 I379	G287-A289 PolarHBondContact O-N 2.8Å; G287-A289 VanDerWaalsContact O-N 3.14Å; A289-F292 VanDerWaalsContact C-CE2 3.49Å; A289-F292 VanDerWaalsContact CA-CZ 3.44Å; A289-F292 HydrophobicContact CB-CE2 3.96Å; A289-F292 HydrophobicContact CB-CZ 3.74Å; A289-F292 WeakPolarHBondContact O-CD2 3.47Å; A289-F292 WeakPolarHBondContact O-CE2 3.12Å; A289-V376 HydrophobicContact CB-CB 4.49Å; A289-V376 HydrophobicContact CB-CG2 3.71Å; A289-I379 HydrophobicContact CB-CD1 4.04Å
290	K	59.8	Low	64.4	Low	108 Å²	108	71 Å²	71	47%	0.47	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-113.1	-10.7	170.1	-158.2	171.5	177.4	-177.2	0	112.7	E286 G287 A288 L315	E286-K290 HydrophobicContact CG-CD 4.33Å; E286-K290 IonicContact OE1-NZ 3.7Å; E286-K290 PolarHBondContact OE1-NZ 3.27Å; E286-K290 IonicContact OE2-NZ 3.79Å; E286-K290 PolarHBondContact OE2-NZ 3.48Å; G287-K290 WeakPolarHBondContact O-CB 3.26Å; G287-K290 PolarHBondContact O-N 2.94Å; A288-K290 PolarHBondContact O-N 3.31Å; K290-L315 HydrophobicContact CB-CD2 4.5Å
291	N	55.1	Low	62.3	Low	69 Å²	69	73.4 Å²	73.4	37%	0.369	39%	0.392	S	S	.	.			trans	-97.7	24.5	-174	-66.7	-14.5	0	0	0	113.4	A288 Y293 Q308	A288-N291 PolarHBondContact O-N 2.86Å; N291-Y293 PolarHBondContact O-N 3.04Å; N291-Q308 PolarHBondContact ND2-OE1 2.86Å
292	F	50.7	Low	60.3	Low	34 Å²	34	75.5 Å²	75.5	15%	0.149	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-65.4	-18.3	-174.6	-65.5	-52.2	0	0	0	115.1	A289 F294 K295 W302 Y372 E375 I379	A289-F292 VanDerWaalsContact C-CE2 3.49Å; A289-F292 VanDerWaalsContact CA-CZ 3.44Å; A289-F292 HydrophobicContact CB-CE2 3.96Å; A289-F292 HydrophobicContact CB-CZ 3.74Å; A289-F292 WeakPolarHBondContact O-CD2 3.47Å; A289-F292 WeakPolarHBondContact O-CE2 3.12Å; F292-F294 PolarHBondContact O-N 3.15Å; F292-K295 PolarHBondContact O-N 3.03Å; F292-W302 HydrophobicContact CE1-CZ3 4.37Å; F292-Y372 AromaticContact CD2-CD1 3.58Å; F292-Y372 HydrophobicContact CD2-CD1 3.58Å; F292-Y372 HydrophobicContact CD2-CE1 4.03Å; F292-Y372 HydrophobicContact CD2-CG 4.38Å; F292-Y372 AromaticContact CE2-CD1 3.93Å; F292-Y372 HydrophobicContact CE2-CD1 3.93Å; F292-Y372 HydrophobicContact CE2-CG 4.36Å; F292-E375 HydrophobicContact CD1-CB 4.15Å; F292-E375 HydrophobicContact CE1-CB 3.33Å; F292-E375 HydrophobicContact CE1-CG 4.17Å; F292-E375 HydrophobicContact CE2-CB 4.02Å; F292-E375 HydrophobicContact CZ-CB 3.24Å; F292-E375 HydrophobicContact CZ-CG 4.34Å; F292-I379 HydrophobicContact CE1-CD1 3.56Å; F292-I379 HydrophobicContact CZ-CD1 3.77Å
293	Y	44.8	Very low	58.4	Low	207 Å²	207	79.1 Å²	79.1	81%	0.812	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-58.9	-4.9	176.9	-68.2	-80.2	0	0	0	115.6	N291	N291-Y293 PolarHBondContact O-N 3.04Å
294	F	43.9	Very low	57.1	Low	201 Å²	201	80.1 Å²	80.1	88%	0.882	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-106.1	6.6	179.9	-92.1	-80.1	0	0	0	115.7	F292	F292-F294 PolarHBondContact O-N 3.15Å
295	K	46	Very low	56.9	Low	83 Å²	83	79.8 Å²	79.8	36%	0.361	43%	0.429	S	S	.	.			trans	-98.8	99.3	179.3	-78.2	-165.5	169.6	-167.6	0	113.8	F292 C301	F292-K295 PolarHBondContact O-N 3.03Å; K295-C301 WeakPolarHBondContact CE-O 3.45Å; K295-C301 PolarHBondContact NZ-O 2.84Å
296	S	35.7	Very low	57	Low	118 Å²	118	82.5 Å²	82.5	83%	0.825	44%	0.44	S	S	*	.			trans	-74.2	164.2	151.2	-78.9	0	0	0	0	111.4
297	S	44.8	Very low	57.5	Low	126 Å²	126	80.3 Å²	80.3	88%	0.881	43%	0.429	S	S	*	.	S	Bend	trans	-54.3	147.8	-170.7	-170.4	0	0	0	0	116.2
298	G	46.5	Very low	58.1	Low	60 Å²	60	80.7 Å²	80.7	62%	0.619	43%	0.431	S	S	*	.	S	Bend	trans	93.4	49	134.6	0	0	0	0	0	119.7
299	N	46.1	Very low	59.7	Low	157 Å²	157	80.6 Å²	80.6	84%	0.84	43%	0.43	S	S	*	.	S	Bend	trans	-176.6	-179.8	145.8	-105.3	-47	0	0	0	112	C301	N299-C301 PolarHBondContact O-N 3.21Å
300	N	51.8	Low	61.3	Low	141 Å²	141	80.8 Å²	80.8	75%	0.754	43%	0.431	S	S	*	.			trans	-64.5	58.6	-179.7	-78.6	-24.3	0	0	0	114.8	W302	N300-W302 VanDerWaalsContact C-N 3.28Å; N300-W302 PolarHBondContact O-N 3.42Å
301	C	52.3	Low	62.7	Low	50 Å²	50	76 Å²	76	34%	0.338	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	59.3	-171.6	-167.8	0	0	0	0	112.3	K295 N299	K295-C301 WeakPolarHBondContact CE-O 3.45Å; K295-C301 PolarHBondContact NZ-O 2.84Å; N299-C301 PolarHBondContact O-N 3.21Å
302	W	54.7	Low	64.2	Low	46 Å²	46	79.6 Å²	79.6	17%	0.174	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-30.1	172.6	-59.1	125.9	0	0	0	112.2	F292 N300 N304 L305 E375 D378 I379	F292-W302 HydrophobicContact CE1-CZ3 4.37Å; N300-W302 VanDerWaalsContact C-N 3.28Å; N300-W302 PolarHBondContact O-N 3.42Å; W302-N304 VanDerWaalsContact C-N 3.28Å; W302-N304 PolarHBondContact O-N 2.86Å; W302-L305 HydrophobicContact CE3-CD1 3.66Å; W302-L305 HydrophobicContact CZ3-CD1 4.04Å; W302-L305 WeakPolarHBondContact O-CB 3.43Å; W302-L305 PolarHBondContact O-N 3.38Å; W302-E375 HydrophobicContact CH2-CB 3.95Å; W302-E375 HydrophobicContact CH2-CG 4.29Å; W302-D378 HydrophobicContact CD2-CB 4.42Å; W302-D378 HydrophobicContact CH2-CB 4.02Å; W302-D378 HydrophobicContact CZ2-CB 3.46Å; W302-D378 VanDerWaalsContact CZ2-CB 3.46Å; W302-D378 PolarHBondContact NE1-OD2 2.74Å; W302-D378 VanDerWaalsContact NE1-OD2 3.1Å; W302-I379 HydrophobicContact CE3-CD1 4.45Å; W302-I379 HydrophobicContact CE3-CG1 3.79Å; W302-I379 HydrophobicContact CH2-CG1 4.42Å; W302-I379 HydrophobicContact CZ3-CD1 3.9Å; W302-I379 HydrophobicContact CZ3-CG1 3.55Å
303	T	53.3	Low	65.8	Low	77 Å²	77	81 Å²	81	47%	0.472	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.8	175.8	48.3	0	0	0	0	113.8	L305	T303-L305 VanDerWaalsContact C-N 3.3Å; T303-L305 PolarHBondContact O-N 3.28Å
304	N	63.9	Low	67.8	Low	102 Å²	102	76.8 Å²	76.8	55%	0.545	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.2	179.4	-70.9	-25.1	0	0	0	113.8	W302 K306	W302-N304 VanDerWaalsContact C-N 3.28Å; W302-N304 PolarHBondContact O-N 2.86Å; N304-K306 PolarHBondContact O-N 3.49Å
305	L	80.8	Confident	70	Confident	39 Å²	39	69.2 Å²	69.2	20%	0.204	41%	0.407	C	S	.	.			trans	-75.6	106.8	-178.4	-63.8	-174.1	0	0	0	111.6	A288 W302 T303 I379 R383	A288-L305 HydrophobicContact CB-CD1 4.39Å; W302-L305 HydrophobicContact CE3-CD1 3.66Å; W302-L305 HydrophobicContact CZ3-CD1 4.04Å; W302-L305 WeakPolarHBondContact O-CB 3.43Å; W302-L305 PolarHBondContact O-N 3.38Å; T303-L305 VanDerWaalsContact C-N 3.3Å; T303-L305 PolarHBondContact O-N 3.28Å; L305-I379 HydrophobicContact CD1-CD1 3.8Å; L305-I379 HydrophobicContact CD1-CG1 3.97Å; L305-R383 PolarHBondContact O-NH2 2.95Å
306	K	88.4	Confident	72.1	Confident	61 Å²	61	67 Å²	67	27%	0.265	40%	0.4	S	S	.	.			trans	-68.6	149.7	174.7	-49.9	-48.6	-177.1	-165.5	0	111.6	N304 Q308 P317 V318 R383 Q510 A511	N304-K306 PolarHBondContact O-N 3.49Å; K306-Q308 PolarHBondContact O-NE2 3.35Å; K306-P317 HydrophobicContact CB-CB 4.32Å; K306-V318 HydrophobicContact CB-CG1 4.46Å; K306-R383 VanDerWaalsContact C-NH2 3.28Å; K306-R383 PolarHBondContact O-NH2 2.96Å; K306-R383 VanDerWaalsContact O-NH2 3.16Å; K306-Q510 WeakPolarHBondContact CD-O 3.37Å; K306-Q510 WeakPolarHBondContact CE-O 3.49Å; K306-Q510 PolarHBondContact NZ-O 3.12Å; K306-A511 CarbonylContact C-O 3.49Å; K306-A511 VanDerWaalsContact CA-O 3.26Å; K306-A511 WeakPolarHBondContact CA-O 3.37Å
307	L	91.5	Very high	74.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	37%	0.371	C	S	.	.			trans	-56.7	141.1	171	-69.4	174.3	0	0	0	110	Y309 P317 V318 D337 F506 A511 G512 W514	L307-Y309 HydrophobicContact CB-CE2 4Å; L307-P317 CarbonylContact O-C 3.56Å; L307-P317 WeakPolarHBondContact O-CA 3.44Å; L307-V318 HydrophobicContact CB-CB 4.3Å; L307-V318 HydrophobicContact CB-CG1 4.09Å; L307-V318 PolarHBondContact O-N 3.08Å; L307-D337 HydrophobicContact CD2-CB 3.96Å; L307-F506 HydrophobicContact CD1-CB 4.36Å; L307-F506 HydrophobicContact CD1-CD2 4.36Å; L307-F506 HydrophobicContact CD1-CG 4.26Å; L307-F506 HydrophobicContact CD2-CD1 3.99Å; L307-F506 HydrophobicContact CD2-CD2 4.43Å; L307-F506 HydrophobicContact CD2-CE1 3.91Å; L307-F506 HydrophobicContact CD2-CE2 4.34Å; L307-F506 HydrophobicContact CD2-CG 4.26Å; L307-F506 HydrophobicContact CD2-CZ 4.09Å; L307-A511 HydrophobicContact CG-CB 4.24Å; L307-A511 PolarHBondContact N-O 3.05Å; L307-G512 WeakPolarHBondContact CD1-O 3.1Å; L307-W514 HydrophobicContact CD1-CB 4.23Å; L307-W514 HydrophobicContact CD1-CE3 4.27Å; L307-W514 HydrophobicContact CD2-CE3 4.34Å
308	Q	91.4	Very high	76.8	Confident	9 Å²	9	57.5 Å²	57.5	4%	0.042	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.9	-177.5	-56.4	-61.4	-56	0	0	110.3	A288 N291 K306 L315 V316 V333 S334 D337	A288-Q308 HydrophobicContact CB-CG 4.37Å; N291-Q308 PolarHBondContact ND2-OE1 2.86Å; K306-Q308 PolarHBondContact O-NE2 3.35Å; Q308-L315 HydrophobicContact CB-CD1 3.78Å; Q308-L315 HydrophobicContact CB-CG 4.17Å; Q308-V316 WeakPolarHBondContact CA-O 3.49Å; Q308-V333 CarbonylContact O-C 3.59Å; Q308-S334 WeakPolarHBondContact O-CB 3.44Å; Q308-S334 PolarHBondContact O-N 3.16Å; Q308-D337 PolarHBondContact N-OD2 3.16Å
309	Y	92.9	Very high	78.8	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.3	-178	-73.9	-96.9	0	0	0	110.9	L307 A311 V316 V318 L321 W326 C332 V333 P513 N515	L307-Y309 HydrophobicContact CB-CE2 4Å; Y309-A311 PolarHBondContact O-N 3.32Å; Y309-V316 PolarHBondContact N-O 2.83Å; Y309-V316 WeakPolarHBondContact O-CG2 3.25Å; Y309-V316 PolarHBondContact O-N 2.74Å; Y309-V318 HydrophobicContact CD2-CB 3.84Å; Y309-V318 HydrophobicContact CD2-CG2 4.02Å; Y309-V318 HydrophobicContact CE2-CB 3.6Å; Y309-V318 HydrophobicContact CE2-CG2 3.47Å; Y309-V318 VanDerWaalsContact CE2-CG2 3.47Å; Y309-L321 HydrophobicContact CD1-CD2 4.27Å; Y309-L321 HydrophobicContact CD2-CD2 4.25Å; Y309-L321 HydrophobicContact CG-CD2 3.86Å; Y309-W326 HydrophobicContact CD1-CH2 4.23Å; Y309-W326 AromaticContact CD1-CZ3 3.58Å; Y309-W326 HydrophobicContact CD1-CZ3 3.58Å; Y309-W326 HydrophobicContact CE1-CE3 4.46Å; Y309-W326 AromaticContact CE1-CH2 3.57Å; Y309-W326 HydrophobicContact CE1-CH2 3.57Å; Y309-W326 AromaticContact CE1-CZ3 3.27Å; Y309-W326 HydrophobicContact CE1-CZ3 3.27Å; Y309-W326 AromaticContact CZ-CZ3 4Å; Y309-C332 CarbonylContact C-O 3.49Å; Y309-C332 VanDerWaalsContact CA-O 3.3Å; Y309-C332 WeakPolarHBondContact CA-O 3.12Å; Y309-V333 HydrophobicContact CD1-CB 4.29Å; Y309-V333 HydrophobicContact CD1-CG2 3.96Å; Y309-V333 HydrophobicContact CE1-CB 4.03Å; Y309-V333 HydrophobicContact CE1-CG2 3.25Å; Y309-P513 PolarHBondContact OH-O 2.83Å; Y309-P513 VanDerWaalsContact OH-O 3.1Å; Y309-N515 PolarHBondContact OH-N 2.95Å; Y309-N515 VanDerWaalsContact OH-N 3.13Å
310	H	92.3	Very high	80.8	Confident	9 Å²	9	59.7 Å²	59.7	4%	0.042	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	117.5	164.3	-55.9	-97.6	0	0	0	108.6	C211 H227 E286 L314 C331 C332	C211-H310 VanDerWaalsContact SG-CB 3.53Å; H227-H310 AromaticContact CE1-CD2 3.81Å; H227-H310 AromaticContact CE1-CE1 3.58Å; H227-H310 AromaticContact CE1-CG 3.65Å; H227-H310 AromaticContact CE1-ND1 3.5Å; H227-H310 AromaticContact CE1-NE2 3.79Å; H227-H310 AromaticContact NE2-CE1 3.3Å; H227-H310 PolarHBondContact NE2-CE1 3.36Å; H227-H310 VanDerWaalsContact NE2-CE1 3.3Å; H227-H310 AromaticContact NE2-ND1 3.4Å; H227-H310 PolarHBondContact NE2-ND1 2.71Å; H227-H310 AromaticContact NE2-NE2 3.89Å; E286-H310 IonicContact OE2-CE1 3.77Å; H310-L314 CarbonylContact C-O 3.52Å; H310-L314 VanDerWaalsContact CA-O 3.3Å; H310-L314 WeakPolarHBondContact CA-O 3.18Å; H310-C331 CarbonylContact O-C 3.55Å; H310-C331 WeakPolarHBondContact O-CA 3.44Å; H310-C332 PolarHBondContact N-O 2.94Å; H310-C332 PolarHBondContact O-N 3.04Å
311	A	90.9	Very high	82.5	Confident	7 Å²	7	53.9 Å²	53.9	6%	0.058	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	132.1	177.9	0	0	0	0	0	109.6	Y309 G313 L314 V316 L321 L325 C331	Y309-A311 PolarHBondContact O-N 3.32Å; A311-G313 PolarHBondContact O-N 2.78Å; A311-G313 VanDerWaalsContact O-N 3.08Å; A311-L314 PolarHBondContact N-O 3.41Å; A311-L314 PolarHBondContact O-N 3.07Å; A311-V316 HydrophobicContact CB-CG2 4.18Å; A311-L321 HydrophobicContact CB-CD1 3.9Å; A311-L325 HydrophobicContact CB-CD2 4.5Å; A311-C331 HydrophobicContact CB-CB 4.39Å
312	K	86.5	Confident	84.2	Confident	144 Å²	144	55.9 Å²	55.9	63%	0.626	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	27	-174.7	-56.8	178.9	-178.3	171.6	0	114.5	L314 L325	K312-L314 VanDerWaalsContact C-N 3.33Å; K312-L325 HydrophobicContact CD-CD2 4.27Å; K312-L325 HydrophobicContact CG-CD1 4.35Å; K312-L325 HydrophobicContact CG-CD2 4.35Å
313	G	83.6	Confident	85.7	Confident	64 Å²	64	58.8 Å²	58.8	66%	0.66	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-2.8	-176.7	0	0	0	0	0	115.5	A311	A311-G313 PolarHBondContact O-N 2.78Å; A311-G313 VanDerWaalsContact O-N 3.08Å
314	L	87.3	Confident	87.4	Confident	119 Å²	119	57.2 Å²	57.2	62%	0.623	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	149.7	175.8	-60.9	176.7	0	0	0	110.9	H310 A311 K312 V316	H310-L314 CarbonylContact C-O 3.52Å; H310-L314 VanDerWaalsContact CA-O 3.3Å; H310-L314 WeakPolarHBondContact CA-O 3.18Å; A311-L314 PolarHBondContact N-O 3.41Å; A311-L314 PolarHBondContact O-N 3.07Å; K312-L314 VanDerWaalsContact C-N 3.33Å; L314-V316 HydrophobicContact CB-CG1 4.2Å
315	L	89.4	Confident	88.5	Confident	42 Å²	42	53.6 Å²	53.6	22%	0.22	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.3	168.7	-174.8	68.8	0	0	0	108.7	K290 Q308	K290-L315 HydrophobicContact CB-CD2 4.5Å; Q308-L315 HydrophobicContact CB-CD1 3.78Å; Q308-L315 HydrophobicContact CB-CG 4.17Å
316	V	89.5	Confident	88.6	Confident	35 Å²	35	53.2 Å²	53.2	21%	0.212	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.7	-175.8	-61.9	0	0	0	0	112.4	Q308 Y309 A311 L314 L321	Q308-V316 WeakPolarHBondContact CA-O 3.49Å; Y309-V316 PolarHBondContact N-O 2.83Å; Y309-V316 WeakPolarHBondContact O-CG2 3.25Å; Y309-V316 PolarHBondContact O-N 2.74Å; A311-V316 HydrophobicContact CB-CG2 4.18Å; L314-V316 HydrophobicContact CB-CG1 4.2Å; V316-L321 HydrophobicContact CG2-CB 4.49Å; V316-L321 HydrophobicContact CG2-CD1 4.25Å
317	P	90.7	Very high	88.5	Confident	32 Å²	32	52.5 Å²	52.5	21%	0.208	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	141.6	167.7	-23.6	32.2	0	0	0	112.4	K306 L307 A319 Y320	K306-P317 HydrophobicContact CB-CB 4.32Å; L307-P317 CarbonylContact O-C 3.56Å; L307-P317 WeakPolarHBondContact O-CA 3.44Å; P317-A319 PolarHBondContact O-N 3.38Å; P317-A319 VanDerWaalsContact O-N 3.12Å; P317-Y320 HydrophobicContact CB-CD2 3.79Å; P317-Y320 HydrophobicContact CB-CE2 4.14Å; P317-Y320 HydrophobicContact CG-CD2 3.78Å; P317-Y320 HydrophobicContact CG-CE2 3.99Å; P317-Y320 PolarHBondContact O-N 3.17Å
318	V	90.1	Very high	88.4	Confident	13 Å²	13	54 Å²	54	8%	0.079	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-57.2	-29.3	-179.9	70.8	0	0	0	0	113.6	K306 L307 Y309 Y320 L321 P513	K306-V318 HydrophobicContact CB-CG1 4.46Å; L307-V318 HydrophobicContact CB-CB 4.3Å; L307-V318 HydrophobicContact CB-CG1 4.09Å; L307-V318 PolarHBondContact O-N 3.08Å; Y309-V318 HydrophobicContact CD2-CB 3.84Å; Y309-V318 HydrophobicContact CD2-CG2 4.02Å; Y309-V318 HydrophobicContact CE2-CB 3.6Å; Y309-V318 HydrophobicContact CE2-CG2 3.47Å; Y309-V318 VanDerWaalsContact CE2-CG2 3.47Å; V318-Y320 PolarHBondContact O-N 3.16Å; V318-L321 PolarHBondContact O-N 2.91Å; V318-P513 HydrophobicContact CG2-CG 4.16Å
319	A	87	Confident	88.5	Confident	70 Å²	70	56.4 Å²	56.4	58%	0.579	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-66.9	-17.4	177.4	0	0	0	0	0	113.9	P317	P317-A319 PolarHBondContact O-N 3.38Å; P317-A319 VanDerWaalsContact O-N 3.12Å
320	Y	88.1	Confident	88.5	Confident	194 Å²	194	56.4 Å²	56.4	76%	0.761	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-111.1	8.1	177.7	-51.8	-52.4	0	0	0	112.6	P317 V318	P317-Y320 HydrophobicContact CB-CD2 3.79Å; P317-Y320 HydrophobicContact CB-CE2 4.14Å; P317-Y320 HydrophobicContact CG-CD2 3.78Å; P317-Y320 HydrophobicContact CG-CE2 3.99Å; P317-Y320 PolarHBondContact O-N 3.17Å; V318-Y320 PolarHBondContact O-N 3.16Å
321	L	87.6	Confident	88.6	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	34%	0.335	C	S	.	.			trans	-93.6	104	-178.1	-176.5	55.2	0	0	0	110.7	Y309 A311 V316 V318 L325 W326 C331	Y309-L321 HydrophobicContact CD1-CD2 4.27Å; Y309-L321 HydrophobicContact CD2-CD2 4.25Å; Y309-L321 HydrophobicContact CG-CD2 3.86Å; A311-L321 HydrophobicContact CB-CD1 3.9Å; V316-L321 HydrophobicContact CG2-CB 4.49Å; V316-L321 HydrophobicContact CG2-CD1 4.25Å; V318-L321 PolarHBondContact O-N 2.91Å; L321-L325 HydrophobicContact CD1-CD2 3.95Å; L321-L325 HydrophobicContact CD1-CG 4.43Å; L321-W326 HydrophobicContact CD2-CE3 3.71Å; L321-W326 HydrophobicContact CD2-CZ3 4.1Å; L321-C331 HydrophobicContact CD2-CB 4.1Å
322	D	87.9	Confident	88.8	Confident	91 Å²	91	56 Å²	56	49%	0.487	33%	0.334	S	S	.	.			trans	-46.5	124.2	176.3	163.6	36.7	0	0	0	112.9	G324 L325 W326	D322-G324 PolarHBondContact O-N 3.27Å; D322-G324 PolarHBondContact OD1-N 2.75Å; D322-L325 HydrophobicContact CB-CB 3.98Å; D322-L325 PolarHBondContact O-N 2.91Å; D322-L325 WeakPolarHBondContact OD2-CB 3.13Å; D322-L325 PolarHBondContact OD2-N 2.8Å; D322-W326 PolarHBondContact O-N 2.76Å
323	P	86.7	Confident	89.2	Confident	107 Å²	107	49.8 Å²	49.8	70%	0.695	31%	0.307	S	S	*	.	H	α-helix	trans	-57.7	-28.6	174.1	-26.7	36	0	0	0	114.8	W326 G327	P323-W326 WeakPolarHBondContact O-CB 3.25Å; P323-G327 PolarHBondContact O-N 2.86Å
324	G	88.4	Confident	89.6	Confident	44 Å²	44	46.7 Å²	46.7	45%	0.454	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-52.8	173.6	0	0	0	0	0	111.6	D322 W326 G327 A328	D322-G324 PolarHBondContact O-N 3.27Å; D322-G324 PolarHBondContact OD1-N 2.75Å; G324-W326 VanDerWaalsContact C-N 3.27Å; G324-W326 PolarHBondContact O-N 3.04Å; G324-G327 PolarHBondContact O-N 3.38Å; G324-G327 VanDerWaalsContact O-N 3.14Å; G324-A328 WeakPolarHBondContact O-CB 3.14Å; G324-A328 PolarHBondContact O-N 3.31Å
325	L	87	Confident	89.9	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.141	25%	0.25	C	C	.	.	H	α-helix	trans	-56.3	-40.1	172.9	-176.5	62.1	0	0	0	112.1	A311 K312 L321 D322 A328 K329	A311-L325 HydrophobicContact CB-CD2 4.5Å; K312-L325 HydrophobicContact CD-CD2 4.27Å; K312-L325 HydrophobicContact CG-CD1 4.35Å; K312-L325 HydrophobicContact CG-CD2 4.35Å; L321-L325 HydrophobicContact CD1-CD2 3.95Å; L321-L325 HydrophobicContact CD1-CG 4.43Å; D322-L325 HydrophobicContact CB-CB 3.98Å; D322-L325 PolarHBondContact O-N 2.91Å; D322-L325 WeakPolarHBondContact OD2-CB 3.13Å; D322-L325 PolarHBondContact OD2-N 2.8Å; L325-A328 PolarHBondContact O-N 3.45Å; L325-K329 HydrophobicContact CD1-CB 3.93Å; L325-K329 HydrophobicContact CD1-CD 3.9Å; L325-K329 HydrophobicContact CD1-CG 4.03Å; L325-K329 PolarHBondContact O-N 2.76Å
326	W	82.6	Confident	89.9	Confident	31 Å²	31	39.4 Å²	39.4	12%	0.117	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-49.4	173.2	177.7	-88.4	0	0	0	112.7	Y309 L321 D322 P323 G324 A328 C331 N515 S516 K517	Y309-W326 HydrophobicContact CD1-CH2 4.23Å; Y309-W326 AromaticContact CD1-CZ3 3.58Å; Y309-W326 HydrophobicContact CD1-CZ3 3.58Å; Y309-W326 HydrophobicContact CE1-CE3 4.46Å; Y309-W326 AromaticContact CE1-CH2 3.57Å; Y309-W326 HydrophobicContact CE1-CH2 3.57Å; Y309-W326 AromaticContact CE1-CZ3 3.27Å; Y309-W326 HydrophobicContact CE1-CZ3 3.27Å; Y309-W326 AromaticContact CZ-CZ3 4Å; L321-W326 HydrophobicContact CD2-CE3 3.71Å; L321-W326 HydrophobicContact CD2-CZ3 4.1Å; D322-W326 PolarHBondContact O-N 2.76Å; P323-W326 WeakPolarHBondContact O-CB 3.25Å; G324-W326 VanDerWaalsContact C-N 3.27Å; G324-W326 PolarHBondContact O-N 3.04Å; W326-A328 VanDerWaalsContact C-N 3.29Å; W326-A328 PolarHBondContact O-N 2.74Å; W326-C331 HydrophobicContact CE3-CB 3.83Å; W326-C331 HydrophobicContact CZ3-CB 3.85Å; W326-N515 HydrophobicContact CD2-CB 3.92Å; W326-N515 VanDerWaalsContact CE2-CB 3.47Å; W326-N515 HydrophobicContact CE3-CB 4.11Å; W326-N515 HydrophobicContact CH2-CB 3.54Å; W326-N515 VanDerWaalsContact CH2-O 3.31Å; W326-N515 WeakPolarHBondContact CH2-O 3.5Å; W326-N515 HydrophobicContact CZ2-CB 3.3Å; W326-N515 VanDerWaalsContact CZ2-O 3.31Å; W326-N515 WeakPolarHBondContact CZ2-O 3.45Å; W326-N515 HydrophobicContact CZ3-CB 3.94Å; W326-S516 PolarHBondContact NE1-O 3.24Å; W326-K517 HydrophobicContact CZ2-CG 4.31Å
327	G	86.9	Confident	90.1	Very high	46 Å²	46	37.7 Å²	37.7	47%	0.474	23%	0.229	S	C	.	.	H	α-helix	trans	-69.4	-26.3	-176.7	0	0	0	0	0	113.6	L216 P323 G324	L216-G327 WeakPolarHBondContact CD1-O 3.37Å; P323-G327 PolarHBondContact O-N 2.86Å; G324-G327 PolarHBondContact O-N 3.38Å; G324-G327 VanDerWaalsContact O-N 3.14Å
328	A	90.8	Very high	90.4	Very high	32 Å²	32	37.2 Å²	37.2	26%	0.264	22%	0.224	S	C	.	.	H	α-helix	trans	-102.8	-33.6	-171.4	0	0	0	0	0	115.2	W215 L216 G324 L325 W326	W215-A328 WeakPolarHBondContact CA-O 3.35Å; W215-A328 HydrophobicContact CE3-CB 4.05Å; W215-A328 HydrophobicContact CZ3-CB 3.83Å; L216-A328 PolarHBondContact N-O 2.73Å; G324-A328 WeakPolarHBondContact O-CB 3.14Å; G324-A328 PolarHBondContact O-N 3.31Å; L325-A328 PolarHBondContact O-N 3.45Å; W326-A328 VanDerWaalsContact C-N 3.29Å; W326-A328 PolarHBondContact O-N 2.74Å
329	K	92.9	Very high	90.6	Very high	58 Å²	58	36.6 Å²	36.6	25%	0.252	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-124.1	163.6	-169.1	-65.4	-155.7	173.4	-165.1	0	113.9	G214 W215 L216 L325 C331	G214-K329 WeakPolarHBondContact O-CA 3.44Å; G214-K329 WeakPolarHBondContact O-CB 3.25Å; W215-K329 HydrophobicContact CE3-CG 4.29Å; L216-K329 WeakPolarHBondContact CD2-O 3.33Å; L325-K329 HydrophobicContact CD1-CB 3.93Å; L325-K329 HydrophobicContact CD1-CD 3.9Å; L325-K329 HydrophobicContact CD1-CG 4.03Å; L325-K329 PolarHBondContact O-N 2.76Å; K329-C331 PolarHBondContact O-N 2.89Å
330	V	93.6	Very high	91	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	19%	0.193	C	C	.	.			trans	-68.5	95.6	176.3	179.5	0	0	0	0	110.2	C212 G214 L216 M222 H224 C332	C212-V330 HydrophobicContact CB-CB 4.23Å; C212-V330 HydrophobicContact CB-CG1 4.1Å; C212-V330 HydrophobicContact CB-CG2 4.21Å; C212-V330 WeakPolarHBondContact O-CB 3.32Å; C212-V330 VanDerWaalsContact O-CG1 3.3Å; C212-V330 WeakPolarHBondContact O-CG1 3.49Å; G214-V330 PolarHBondContact O-N 3.41Å; L216-V330 HydrophobicContact CD2-CG2 3.95Å; M222-V330 HydrophobicContact SD-CG2 4.42Å; H224-V330 HydrophobicContact CB-CG1 3.75Å; H224-V330 VanDerWaalsContact O-CG1 3.28Å; H224-V330 WeakPolarHBondContact O-CG1 3.39Å; V330-C332 VanDerWaalsContact CG1-SG 3.58Å
331	C	94.1	Very high	91.4	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.014	16%	0.159	C	C	.	.			trans	-106.4	115.1	169.6	-59	0	0	0	0	109.6	H310 A311 L321 W326 K329 K517	H310-C331 CarbonylContact O-C 3.55Å; H310-C331 WeakPolarHBondContact O-CA 3.44Å; A311-C331 HydrophobicContact CB-CB 4.39Å; L321-C331 HydrophobicContact CD2-CB 4.1Å; W326-C331 HydrophobicContact CE3-CB 3.83Å; W326-C331 HydrophobicContact CZ3-CB 3.85Å; K329-C331 PolarHBondContact O-N 2.89Å; C331-K517 PolarHBondContact O-NZ 3.26Å
332	C	94.4	Very high	91.9	Very high	5 Å²	5	24.3 Å²	24.3	3%	0.034	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.8	-169.8	-77.9	0	0	0	0	111.7	H224 D225 Y309 H310 V330 K517	H224-C332 PolarHBondContact O-SG 3.25Å; D225-C332 HydrophobicContact CB-CB 4.5Å; D225-C332 WeakPolarHBondContact OD2-CB 3.43Å; Y309-C332 CarbonylContact C-O 3.49Å; Y309-C332 VanDerWaalsContact CA-O 3.3Å; Y309-C332 WeakPolarHBondContact CA-O 3.12Å; H310-C332 PolarHBondContact N-O 2.94Å; H310-C332 PolarHBondContact O-N 3.04Å; V330-C332 VanDerWaalsContact CG1-SG 3.58Å; C332-K517 PolarHBondContact SG-NZ 3.32Å
333	V	94.4	Very high	92.4	Very high	13 Å²	13	20 Å²	20	8%	0.079	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	148.3	174.5	-174.4	0	0	0	0	110	Q308 Y309 D337 K338 W514	Q308-V333 CarbonylContact O-C 3.59Å; Y309-V333 HydrophobicContact CD1-CB 4.29Å; Y309-V333 HydrophobicContact CD1-CG2 3.96Å; Y309-V333 HydrophobicContact CE1-CB 4.03Å; Y309-V333 HydrophobicContact CE1-CG2 3.25Å; V333-D337 HydrophobicContact CG1-CB 3.64Å; V333-K338 HydrophobicContact CB-CG 4.32Å; V333-K338 HydrophobicContact CG1-CG 4.32Å; V333-K338 WeakPolarHBondContact O-CE 3.4Å; V333-K338 PolarHBondContact O-NZ 2.74Å; V333-W514 HydrophobicContact CB-CH2 4.03Å; V333-W514 HydrophobicContact CB-CZ2 4.27Å; V333-W514 HydrophobicContact CB-CZ3 4.4Å; V333-W514 HydrophobicContact CG1-CE3 4.18Å; V333-W514 HydrophobicContact CG1-CH2 3.54Å; V333-W514 HydrophobicContact CG1-CZ2 4.23Å; V333-W514 HydrophobicContact CG1-CZ3 3.52Å; V333-W514 HydrophobicContact CG2-CD2 4.28Å; V333-W514 HydrophobicContact CG2-CE3 4.43Å; V333-W514 HydrophobicContact CG2-CH2 3.98Å; V333-W514 HydrophobicContact CG2-CZ2 3.79Å; V333-W514 HydrophobicContact CG2-CZ3 4.29Å
334	S	93.2	Very high	92.9	Very high	0 Å²	0	15 Å²	15	0%	0	10%	0.102	C	C	.	.			trans	-64.2	171.3	-178.7	77.1	0	0	0	0	114.8	E286 G287 Q308 S336 D337 K338	E286-S334 WeakPolarHBondContact O-CB 3.47Å; G287-S334 WeakPolarHBondContact CA-OG 3.43Å; Q308-S334 WeakPolarHBondContact O-CB 3.44Å; Q308-S334 PolarHBondContact O-N 3.16Å; S334-S336 PolarHBondContact OG-OG 2.81Å; S334-D337 WeakPolarHBondContact OG-CB 3.39Å; S334-D337 PolarHBondContact OG-N 3.38Å; S334-D337 PolarHBondContact OG-OD1 2.88Å; S334-D337 PolarHBondContact OG-OD2 3.07Å; S334-K338 WeakPolarHBondContact O-CD 3.42Å; S334-K338 VanDerWaalsContact O-CG 3.27Å; S334-K338 WeakPolarHBondContact O-CG 3.31Å; S334-K338 PolarHBondContact O-N 3Å
335	G	92.4	Very high	93.3	Very high	7 Å²	7	13.1 Å²	13.1	7%	0.072	8%	0.081	C	C	.	.	H	α-helix	trans	-67.1	-49.1	175.4	0	0	0	0	0	112.6	E286 D337 K338 L339	E286-G335 VanDerWaalsContact O-CA 3.3Å; E286-G335 WeakPolarHBondContact O-CA 3.35Å; E286-G335 PolarHBondContact O-N 2.81Å; G335-D337 VanDerWaalsContact C-N 3.33Å; G335-D337 PolarHBondContact O-N 3.06Å; G335-K338 PolarHBondContact O-N 3.16Å; G335-L339 PolarHBondContact O-N 3.05Å; G335-L339 VanDerWaalsContact O-N 3.08Å
336	S	90.7	Very high	93.8	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.8	-42.7	179.5	65.1	0	0	0	0	112.2	E286 G287 A288 S334 K338 L339 C340	E286-S336 PolarHBondContact O-N 3.11Å; G287-S336 WeakPolarHBondContact CA-OG 3.46Å; A288-S336 PolarHBondContact N-OG 3.03Å; S334-S336 PolarHBondContact OG-OG 2.81Å; S336-K338 VanDerWaalsContact C-N 3.31Å; S336-K338 PolarHBondContact O-N 2.99Å; S336-L339 PolarHBondContact O-N 3.26Å; S336-C340 WeakPolarHBondContact O-CB 3.09Å; S336-C340 PolarHBondContact O-N 2.96Å
337	D	93.3	Very high	94.6	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-72.8	-28	-173.9	-54.2	-17.8	0	0	0	111.7	L307 Q308 V333 S334 G335 C341 R383 W514	L307-D337 HydrophobicContact CD2-CB 3.96Å; Q308-D337 PolarHBondContact N-OD2 3.16Å; V333-D337 HydrophobicContact CG1-CB 3.64Å; S334-D337 WeakPolarHBondContact OG-CB 3.39Å; S334-D337 PolarHBondContact OG-N 3.38Å; S334-D337 PolarHBondContact OG-OD1 2.88Å; S334-D337 PolarHBondContact OG-OD2 3.07Å; G335-D337 VanDerWaalsContact C-N 3.33Å; G335-D337 PolarHBondContact O-N 3.06Å; D337-C341 PolarHBondContact O-N 3.36Å; D337-C341 PolarHBondContact O-SG 3.21Å; D337-R383 IonicContact OD1-CZ 2.7Å; D337-R383 IonicContact OD1-NH1 2.8Å; D337-R383 PolarHBondContact OD1-NH1 2.7Å; D337-W514 HydrophobicContact CB-CZ3 4.22Å; D337-W514 WeakPolarHBondContact O-CZ3 3.49Å
338	K	96.1	Very high	95.1	Very high	22 Å²	22	8.2 Å²	8.2	10%	0.096	5%	0.047	C	C	.	.	H	α-helix	trans	-74.7	-41.6	171.1	-69.4	168.1	-171.4	132.2	0	112.7	D225 I230 V333 S334 G335 S336 C340 C341 W342 W514	D225-K338 IonicContact OD2-NZ 3.74Å; D225-K338 PolarHBondContact OD2-NZ 3.18Å; I230-K338 HydrophobicContact CD1-CD 3.42Å; I230-K338 VanDerWaalsContact CD1-CD 3.42Å; I230-K338 HydrophobicContact CG1-CD 4.39Å; V333-K338 HydrophobicContact CB-CG 4.32Å; V333-K338 HydrophobicContact CG1-CG 4.32Å; V333-K338 WeakPolarHBondContact O-CE 3.4Å; V333-K338 PolarHBondContact O-NZ 2.74Å; S334-K338 WeakPolarHBondContact O-CD 3.42Å; S334-K338 VanDerWaalsContact O-CG 3.27Å; S334-K338 WeakPolarHBondContact O-CG 3.31Å; S334-K338 PolarHBondContact O-N 3Å; G335-K338 PolarHBondContact O-N 3.16Å; S336-K338 VanDerWaalsContact C-N 3.31Å; S336-K338 PolarHBondContact O-N 2.99Å; K338-C340 VanDerWaalsContact C-N 3.25Å; K338-C340 PolarHBondContact O-N 3.03Å; K338-C341 WeakPolarHBondContact O-CB 3.22Å; K338-C341 PolarHBondContact O-N 2.82Å; K338-W342 HydrophobicContact CB-CH2 4.27Å; K338-W342 HydrophobicContact CB-CZ2 3.69Å; K338-W342 HydrophobicContact CD-CZ2 4.28Å; K338-W342 HydrophobicContact CG-CZ2 4.46Å; K338-W342 VanDerWaalsContact O-CD1 3.28Å; K338-W342 VanDerWaalsContact O-CG 3.23Å; K338-W342 PolarHBondContact O-N 3.19Å; K338-W342 PolarHBondContact O-NE1 3.13Å; K338-W514 HydrophobicContact CB-CH2 4.46Å; K338-W514 HydrophobicContact CG-CH2 3.85Å; K338-W514 HydrophobicContact CG-CZ2 4.43Å
339	L	95.1	Very high	95.5	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-57.1	-45	172.6	-75.9	168.3	0	0	0	110.2	I229 L279 P285 G335 S336 C341 W342 T343 I361 I364 T380	I229-L339 HydrophobicContact CD1-CD1 4.37Å; I229-L339 HydrophobicContact CG2-CD2 4.29Å; L279-L339 HydrophobicContact CD2-CD2 4.27Å; P285-L339 HydrophobicContact CB-CD1 3.73Å; P285-L339 HydrophobicContact CG-CD1 3.36Å; G335-L339 PolarHBondContact O-N 3.05Å; G335-L339 VanDerWaalsContact O-N 3.08Å; S336-L339 PolarHBondContact O-N 3.26Å; L339-C341 PolarHBondContact O-N 2.9Å; L339-W342 HydrophobicContact CD2-CE3 3.74Å; L339-W342 HydrophobicContact CD2-CZ3 3.79Å; L339-W342 HydrophobicContact CG-CE3 4.46Å; L339-W342 HydrophobicContact CG-CZ3 4.38Å; L339-W342 PolarHBondContact O-N 2.88Å; L339-T343 PolarHBondContact O-N 3.49Å; L339-I361 HydrophobicContact CD2-CD1 4.16Å; L339-I364 HydrophobicContact CD1-CD1 4.31Å; L339-I364 HydrophobicContact CD2-CD1 3.84Å; L339-T380 HydrophobicContact CB-CG2 4.01Å
340	C	94.9	Very high	95.8	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-56.9	-31	173.9	-173.9	0	0	0	0	113.3	S336 K338 T343 I379 T380 L384	S336-C340 WeakPolarHBondContact O-CB 3.09Å; S336-C340 PolarHBondContact O-N 2.96Å; K338-C340 VanDerWaalsContact C-N 3.25Å; K338-C340 PolarHBondContact O-N 3.03Å; C340-T343 PolarHBondContact O-OG1 2.94Å; C340-I379 PolarHBondContact SG-O 2.63Å; C340-T380 WeakPolarHBondContact CA-O 3.23Å; C340-T380 PolarHBondContact SG-O 3.42Å; C340-L384 WeakPolarHBondContact O-CD1 3.5Å
341	C	96.6	Very high	96	Very high	9 Å²	9	5.1 Å²	5.1	6%	0.061	3%	0.031	C	C	.	.	H	α-helix	trans	-76.3	-34.5	171.6	-65	0	0	0	0	113.3	D337 K338 L339 T343 V344 I345 W514	D337-C341 PolarHBondContact O-N 3.36Å; D337-C341 PolarHBondContact O-SG 3.21Å; K338-C341 WeakPolarHBondContact O-CB 3.22Å; K338-C341 PolarHBondContact O-N 2.82Å; L339-C341 PolarHBondContact O-N 2.9Å; C341-T343 VanDerWaalsContact C-N 3.26Å; C341-T343 PolarHBondContact O-N 3.06Å; C341-V344 PolarHBondContact O-N 3.49Å; C341-I345 WeakPolarHBondContact O-CG2 3.19Å; C341-I345 PolarHBondContact O-N 3.16Å; C341-W514 HydrophobicContact CB-CH2 4.46Å; C341-W514 WeakPolarHBondContact SG-CH2 3.26Å; C341-W514 WeakPolarHBondContact SG-CZ3 3.18Å
342	W	98	Very high	96.2	Very high	15 Å²	15	5 Å²	5	6%	0.057	3%	0.031	C	C	.	.	H	α-helix	trans	-74	-15.2	-175.6	-55.4	-20.2	0	0	0	113.2	I229 I230 R233 K338 L339 V344 G346 V347 Y360 I361	I229-W342 HydrophobicContact CG2-CH2 4.14Å; I229-W342 HydrophobicContact CG2-CZ3 3.82Å; I230-W342 HydrophobicContact CD1-CH2 3.86Å; I230-W342 HydrophobicContact CD1-CZ2 4.35Å; R233-W342 HydrophobicContact CB-CH2 4.19Å; R233-W342 HydrophobicContact CB-CZ3 4.42Å; R233-W342 HydrophobicContact CG-CH2 4.33Å; K338-W342 HydrophobicContact CB-CH2 4.27Å; K338-W342 HydrophobicContact CB-CZ2 3.69Å; K338-W342 HydrophobicContact CD-CZ2 4.28Å; K338-W342 HydrophobicContact CG-CZ2 4.46Å; K338-W342 VanDerWaalsContact O-CD1 3.28Å; K338-W342 VanDerWaalsContact O-CG 3.23Å; K338-W342 PolarHBondContact O-N 3.19Å; K338-W342 PolarHBondContact O-NE1 3.13Å; L339-W342 HydrophobicContact CD2-CE3 3.74Å; L339-W342 HydrophobicContact CD2-CZ3 3.79Å; L339-W342 HydrophobicContact CG-CE3 4.46Å; L339-W342 HydrophobicContact CG-CZ3 4.38Å; L339-W342 PolarHBondContact O-N 2.88Å; W342-V344 PolarHBondContact O-N 2.92Å; W342-G346 WeakPolarHBondContact O-CA 3.29Å; W342-G346 PolarHBondContact O-N 3.11Å; W342-V347 HydrophobicContact CB-CG1 4.07Å; W342-V347 HydrophobicContact CD2-CG1 4.28Å; W342-V347 HydrophobicContact CE3-CG1 4.08Å; W342-V347 HydrophobicContact CG-CG1 4.26Å; W342-Y360 WeakPolarHBondContact O-CD1 3.49Å; W342-I361 HydrophobicContact CE3-CD1 4.42Å
343	T	97.4	Very high	96.4	Very high	2 Å²	2	5.2 Å²	5.2	1%	0.012	3%	0.032	C	C	.	.	H	α-helix	trans	-62.4	-28.1	167.5	62.8	0	0	0	0	112.4	L339 C340 C341 Y360 T380 Q399 I401	L339-T343 PolarHBondContact O-N 3.49Å; C340-T343 PolarHBondContact O-OG1 2.94Å; C341-T343 VanDerWaalsContact C-N 3.26Å; C341-T343 PolarHBondContact O-N 3.06Å; T343-Y360 WeakPolarHBondContact O-CD1 3.43Å; T343-Y360 WeakPolarHBondContact O-CE1 3.26Å; T343-T380 HydrophobicContact CG2-CG2 3.87Å; T343-Q399 WeakPolarHBondContact CA-O 3.09Å; T343-Q399 VanDerWaalsContact CB-O 3.3Å; T343-Q399 WeakPolarHBondContact CB-O 3.35Å; T343-Q399 PolarHBondContact O-N 3.21Å; T343-I401 HydrophobicContact CG2-CD1 3.87Å; T343-I401 HydrophobicContact CG2-CG1 4.05Å
344	V	97.6	Very high	96.6	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-109.3	-45.3	-178.6	178.4	0	0	0	0	112.2	C341 W342 Y360 L384 W388 L392 K398 V498 I502	C341-V344 PolarHBondContact O-N 3.49Å; W342-V344 PolarHBondContact O-N 2.92Å; V344-Y360 WeakPolarHBondContact O-CE1 3.3Å; V344-Y360 PolarHBondContact O-OH 2.84Å; V344-L384 HydrophobicContact CB-CD1 4.45Å; V344-L384 HydrophobicContact CG2-CD1 3.81Å; V344-W388 HydrophobicContact CG1-CE3 4.2Å; V344-W388 HydrophobicContact CG1-CZ3 4.2Å; V344-W388 HydrophobicContact CG2-CZ2 4.4Å; V344-L392 HydrophobicContact CG1-CD1 4Å; V344-L392 HydrophobicContact CG1-CD2 3.83Å; V344-K398 HydrophobicContact CG2-CB 4.22Å; V344-K398 HydrophobicContact CG2-CG 4.31Å; V344-V498 HydrophobicContact CG1-CG1 3.95Å; V344-I502 HydrophobicContact CB-CD1 3.82Å; V344-I502 HydrophobicContact CB-CG1 4.24Å; V344-I502 HydrophobicContact CG1-CD1 3.83Å; V344-I502 HydrophobicContact CG1-CG1 4.05Å
345	I	97.3	Very high	96.8	Very high	5 Å²	5	5.9 Å²	5.9	3%	0.026	3%	0.034	C	C	.	.	H	α-helix	trans	-90.6	-7.8	-175	-149.4	171.6	0	0	0	114.6	C341 Q348 Y396 Y495 V498 K499 I502	C341-I345 WeakPolarHBondContact O-CG2 3.19Å; C341-I345 PolarHBondContact O-N 3.16Å; I345-Q348 PolarHBondContact O-NE2 3.35Å; I345-Y396 HydrophobicContact CG1-CE1 4.13Å; I345-Y495 HydrophobicContact CD1-CD1 4.04Å; I345-Y495 HydrophobicContact CD1-CD2 4.06Å; I345-Y495 HydrophobicContact CD1-CE1 3.55Å; I345-Y495 HydrophobicContact CD1-CE2 3.59Å; I345-Y495 HydrophobicContact CD1-CG 4.26Å; I345-Y495 HydrophobicContact CG1-CD2 3.9Å; I345-Y495 HydrophobicContact CG1-CE1 4.4Å; I345-Y495 HydrophobicContact CG1-CE2 3.53Å; I345-Y495 HydrophobicContact CG1-CG 4.48Å; I345-V498 HydrophobicContact CB-CG1 4.28Å; I345-V498 HydrophobicContact CG1-CB 4.4Å; I345-V498 HydrophobicContact CG1-CG1 3.94Å; I345-K499 HydrophobicContact CD1-CB 3.5Å; I345-K499 HydrophobicContact CD1-CG 4.11Å; I345-I502 HydrophobicContact CB-CD1 3.81Å; I345-I502 HydrophobicContact CD1-CD1 4.48Å; I345-I502 HydrophobicContact CG1-CD1 4.49Å
346	G	98.2	Very high	97.1	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.03	C	C	.	.			trans	70.9	170	-172.7	0	0	0	0	0	114.3	W342 Q348 L359	W342-G346 WeakPolarHBondContact O-CA 3.29Å; W342-G346 PolarHBondContact O-N 3.11Å; G346-Q348 VanDerWaalsContact C-OE1 3.28Å; G346-L359 CarbonylContact C-O 3.58Å; G346-L359 WeakPolarHBondContact CA-O 3.19Å
347	V	98.6	Very high	97.4	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.042	C	C	.	.	S	Bend	trans	-84.7	-19.8	-177.1	-57.5	0	0	0	0	113.3	R233 L236 L237 L277 W342 G349 L359 I361	R233-V347 PolarHBondContact NE-O 2.92Å; R233-V347 PolarHBondContact NH2-O 2.82Å; L236-V347 HydrophobicContact CD2-CG2 3.8Å; L237-V347 WeakPolarHBondContact CD2-O 3.44Å; L277-V347 HydrophobicContact CD2-CG2 3.79Å; W342-V347 HydrophobicContact CB-CG1 4.07Å; W342-V347 HydrophobicContact CD2-CG1 4.28Å; W342-V347 HydrophobicContact CE3-CG1 4.08Å; W342-V347 HydrophobicContact CG-CG1 4.26Å; V347-G349 PolarHBondContact O-N 3Å; V347-L359 HydrophobicContact CG2-CB 3.97Å; V347-L359 PolarHBondContact N-O 2.69Å; V347-I361 HydrophobicContact CG1-CD1 3.95Å; V347-I361 HydrophobicContact CG1-CG1 3.76Å
348	Q	98.5	Very high	97.6	Very high	2 Å²	2	8.5 Å²	8.5	1%	0.009	5%	0.046	C	C	.	.	S	Bend	trans	-61.5	-44.9	-172.4	74.6	-60.7	-23.7	0	0	113.5	L237 I345 G346 L352 I356	L237-Q348 WeakPolarHBondContact CD2-O 3.43Å; I345-Q348 PolarHBondContact O-NE2 3.35Å; G346-Q348 VanDerWaalsContact C-OE1 3.28Å; Q348-L352 HydrophobicContact CB-CB 3.84Å; Q348-L352 HydrophobicContact CB-CD1 4.44Å; Q348-L352 HydrophobicContact CG-CB 4.27Å; Q348-I356 HydrophobicContact CB-CD1 3.87Å; Q348-I356 HydrophobicContact CB-CG1 4.24Å; Q348-I356 HydrophobicContact CG-CD1 4.46Å; Q348-I356 HydrophobicContact CG-CG1 4.31Å
349	G	98.3	Very high	97.7	Very high	7 Å²	7	8.1 Å²	8.1	7%	0.072	4%	0.044	C	C	.	.			trans	79.5	159	-177.1	0	0	0	0	0	114.8	V347 L351 L352 S353 Y495	V347-G349 PolarHBondContact O-N 3Å; G349-L351 VanDerWaalsContact C-N 3.31Å; G349-L351 PolarHBondContact O-N 2.81Å; G349-L352 PolarHBondContact O-N 2.99Å; G349-S353 PolarHBondContact O-N 3.33Å; G349-S353 PolarHBondContact O-OG 3.44Å; G349-Y495 VanDerWaalsContact C-CE2 3.47Å
350	A	98.4	Very high	97.8	Very high	9 Å²	9	9.5 Å²	9.5	7%	0.074	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41	-43.7	-169.6	0	0	0	0	0	117.1	S353 K489 A492 Y495	A350-S353 VanDerWaalsContact C-OG 3.24Å; A350-S353 VanDerWaalsContact CA-OG 3.25Å; A350-S353 WeakPolarHBondContact CA-OG 3.43Å; A350-S353 PolarHBondContact O-OG 3.15Å; A350-K489 HydrophobicContact CB-CB 4.29Å; A350-K489 HydrophobicContact CB-CG 4.07Å; A350-A492 HydrophobicContact CB-CB 4.15Å; A350-A492 WeakPolarHBondContact O-CB 3.27Å; A350-Y495 HydrophobicContact CB-CD1 3.57Å; A350-Y495 HydrophobicContact CB-CE1 3.74Å; A350-Y495 HydrophobicContact CB-CG 4.06Å; A350-Y495 VanDerWaalsContact N-CE2 3.33Å; A350-Y495 VanDerWaalsContact N-CZ 3.35Å
351	L	98.6	Very high	98	Very high	9 Å²	9	9.6 Å²	9.6	5%	0.047	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-38.6	-177.6	-93.8	65	0	0	0	112.7	Y241 G349 S353 H354 Y464 F467 Y485 V488 K489	Y241-L351 WeakPolarHBondContact OH-CB 3.36Å; G349-L351 VanDerWaalsContact C-N 3.31Å; G349-L351 PolarHBondContact O-N 2.81Å; L351-S353 VanDerWaalsContact C-N 3.35Å; L351-H354 PolarHBondContact O-N 2.96Å; L351-Y464 HydrophobicContact CD2-CD2 3.95Å; L351-F467 HydrophobicContact CB-CD2 3.66Å; L351-F467 HydrophobicContact CB-CE2 4.14Å; L351-F467 HydrophobicContact CB-CG 4.3Å; L351-F467 HydrophobicContact CD2-CB 3.83Å; L351-F467 HydrophobicContact CD2-CD1 4.31Å; L351-F467 HydrophobicContact CD2-CD2 3.98Å; L351-F467 HydrophobicContact CD2-CG 3.76Å; L351-F467 HydrophobicContact CG-CD2 3.72Å; L351-F467 HydrophobicContact CG-CE2 4.08Å; L351-F467 HydrophobicContact CG-CG 4Å; L351-F467 WeakPolarHBondContact O-CD2 3.29Å; L351-F467 VanDerWaalsContact O-CE2 3.3Å; L351-F467 WeakPolarHBondContact O-CE2 3.32Å; L351-Y485 HydrophobicContact CD1-CE2 4.19Å; L351-Y485 HydrophobicContact CD2-CD2 3.91Å; L351-Y485 HydrophobicContact CD2-CE2 3.42Å; L351-Y485 VanDerWaalsContact CD2-CE2 3.42Å; L351-Y485 HydrophobicContact CG-CE2 4.48Å; L351-V488 HydrophobicContact CD1-CG1 4.04Å; L351-V488 HydrophobicContact CG-CG1 3.89Å; L351-K489 HydrophobicContact CD1-CB 4.48Å; L351-K489 HydrophobicContact CD1-CD 4.29Å; L351-K489 HydrophobicContact CD1-CG 3.34Å
352	L	98.7	Very high	98	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-74.6	-28.6	178.3	-83.1	163.7	0	0	0	111.4	L237 L240 Y241 L244 Q348 G349 H354 F355 I356	L237-L352 HydrophobicContact CB-CD1 4.06Å; L237-L352 HydrophobicContact CD2-CD1 3.97Å; L237-L352 HydrophobicContact CG-CD1 4.41Å; L240-L352 HydrophobicContact CB-CD1 4Å; L240-L352 HydrophobicContact CB-CD2 4.29Å; L240-L352 HydrophobicContact CD1-CD1 3.99Å; Y241-L352 HydrophobicContact CD1-CD2 3.63Å; Y241-L352 HydrophobicContact CD1-CG 4.4Å; Y241-L352 HydrophobicContact CE1-CD2 3.43Å; Y241-L352 VanDerWaalsContact CE1-CD2 3.43Å; Y241-L352 HydrophobicContact CE1-CG 3.81Å; Y241-L352 HydrophobicContact CE2-CD1 4.35Å; Y241-L352 HydrophobicContact CE2-CD2 4.44Å; Y241-L352 HydrophobicContact CE2-CG 4.25Å; Y241-L352 HydrophobicContact CG-CD2 4.2Å; L244-L352 HydrophobicContact CD1-CD2 3.52Å; Q348-L352 HydrophobicContact CB-CB 3.84Å; Q348-L352 HydrophobicContact CB-CD1 4.44Å; Q348-L352 HydrophobicContact CG-CB 4.27Å; G349-L352 PolarHBondContact O-N 2.99Å; L352-H354 PolarHBondContact O-N 3.37Å; L352-H354 VanDerWaalsContact O-N 3.1Å; L352-F355 PolarHBondContact O-N 3.35Å; L352-I356 HydrophobicContact CB-CD1 4.24Å; L352-I356 HydrophobicContact CB-CG1 4.17Å; L352-I356 HydrophobicContact CD2-CD1 4.47Å; L352-I356 WeakPolarHBondContact O-CG1 3.01Å; L352-I356 PolarHBondContact O-N 3.34Å
353	S	98.3	Very high	98	Very high	8 Å²	8	10.1 Å²	10.1	6%	0.056	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-67.8	-1.2	174	46.6	0	0	0	0	115.3	Q268 G349 A350 L351 F355 Y495	Q268-S353 PolarHBondContact NE2-O 2.89Å; G349-S353 PolarHBondContact O-N 3.33Å; G349-S353 PolarHBondContact O-OG 3.44Å; A350-S353 VanDerWaalsContact C-OG 3.24Å; A350-S353 VanDerWaalsContact CA-OG 3.25Å; A350-S353 WeakPolarHBondContact CA-OG 3.43Å; A350-S353 PolarHBondContact O-OG 3.15Å; L351-S353 VanDerWaalsContact C-N 3.35Å; S353-F355 VanDerWaalsContact C-N 3.32Å; S353-Y495 WeakPolarHBondContact OG-CD2 3.49Å
354	H	97.9	Very high	97.9	Very high	18 Å²	18	10.1 Å²	10.1	8%	0.083	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-74.3	-23	162.2	-76.3	-65.5	0	0	0	112.8	L351 L352 F467 L479 V488 E491 A492	L351-H354 PolarHBondContact O-N 2.96Å; L352-H354 PolarHBondContact O-N 3.37Å; L352-H354 VanDerWaalsContact O-N 3.1Å; H354-F467 HydrophobicContact CB-CE2 4.23Å; H354-F467 AromaticContact CD2-CE2 3.68Å; H354-F467 AromaticContact CD2-CZ 3.92Å; H354-L479 HydrophobicContact CB-CD1 4.06Å; H354-V488 PolarHBondContact NE2-O 3.3Å; H354-E491 VanDerWaalsContact CE1-C 3.49Å; H354-A492 PolarHBondContact CE1-N 2.7Å
355	F	97.9	Very high	97.8	Very high	9 Å²	9	10.1 Å²	10.1	4%	0.039	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-28.5	-171.5	-46.3	-50.9	0	0	0	113.9	L244 L269 L352 S353 F467 V470 A471 H476 L479	L244-F355 HydrophobicContact CD1-CB 3.89Å; L244-F355 HydrophobicContact CD1-CD2 3.86Å; L244-F355 HydrophobicContact CD1-CG 4.28Å; L244-F355 HydrophobicContact CD2-CB 4.38Å; L269-F355 PolarHBondContact N-O 3.49Å; L352-F355 PolarHBondContact O-N 3.35Å; S353-F355 VanDerWaalsContact C-N 3.32Å; F355-F467 HydrophobicContact CE1-CE2 4.41Å; F355-F467 AromaticContact CE2-CD2 3.42Å; F355-F467 HydrophobicContact CE2-CD2 3.42Å; F355-F467 VanDerWaalsContact CE2-CD2 3.42Å; F355-F467 AromaticContact CE2-CE2 3.49Å; F355-F467 HydrophobicContact CE2-CE2 3.49Å; F355-F467 VanDerWaalsContact CE2-CE2 3.49Å; F355-F467 HydrophobicContact CE2-CG 4.37Å; F355-F467 HydrophobicContact CE2-CZ 4.47Å; F355-F467 AromaticContact CZ-CD2 3.74Å; F355-F467 HydrophobicContact CZ-CD2 3.74Å; F355-F467 AromaticContact CZ-CE2 3.38Å; F355-F467 HydrophobicContact CZ-CE2 3.38Å; F355-F467 AromaticContact CZ-CZ 3.97Å; F355-F467 HydrophobicContact CZ-CZ 3.97Å; F355-V470 HydrophobicContact CD1-CG1 4.38Å; F355-V470 HydrophobicContact CD2-CB 4.45Å; F355-V470 HydrophobicContact CD2-CG1 3.57Å; F355-V470 HydrophobicContact CE1-CG1 4.4Å; F355-V470 HydrophobicContact CE2-CB 4.01Å; F355-V470 HydrophobicContact CE2-CG1 3.56Å; F355-V470 HydrophobicContact CG-CG1 4Å; F355-V470 HydrophobicContact CZ-CB 4.43Å; F355-V470 HydrophobicContact CZ-CG1 4Å; F355-A471 HydrophobicContact CE1-CB 4.39Å; F355-A471 HydrophobicContact CZ-CB 3.91Å; F355-H476 AromaticContact CE1-CD2 3.79Å; F355-L479 HydrophobicContact CE1-CD1 4.45Å
356	I	97.9	Very high	97.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.056	C	C	.	.	B	Isolated β-bridge	trans	-128.4	149.9	-175.6	68.3	172.9	0	0	0	112.7	L240 L244 F260 L269 Q348 L352 L359	L240-I356 HydrophobicContact CD1-CD1 4.26Å; L244-I356 HydrophobicContact CD1-CG2 4.09Å; L244-I356 HydrophobicContact CD2-CG2 3.68Å; L244-I356 HydrophobicContact CG-CG2 4.28Å; F260-I356 HydrophobicContact CD1-CG2 4.09Å; F260-I356 HydrophobicContact CD2-CG2 4.45Å; F260-I356 HydrophobicContact CE1-CB 4.03Å; F260-I356 HydrophobicContact CE1-CD1 3.94Å; F260-I356 HydrophobicContact CE1-CG2 3.74Å; F260-I356 HydrophobicContact CE2-CG2 4.12Å; F260-I356 HydrophobicContact CG-CG2 4.44Å; F260-I356 HydrophobicContact CZ-CB 4.28Å; F260-I356 HydrophobicContact CZ-CD1 3.57Å; F260-I356 HydrophobicContact CZ-CG2 3.75Å; L269-I356 HydrophobicContact CB-CG2 4.35Å; L269-I356 VanDerWaalsContact O-CA 3.32Å; L269-I356 WeakPolarHBondContact O-CA 3.31Å; Q348-I356 HydrophobicContact CB-CD1 3.87Å; Q348-I356 HydrophobicContact CB-CG1 4.24Å; Q348-I356 HydrophobicContact CG-CD1 4.46Å; Q348-I356 HydrophobicContact CG-CG1 4.31Å; L352-I356 HydrophobicContact CB-CD1 4.24Å; L352-I356 HydrophobicContact CB-CG1 4.17Å; L352-I356 HydrophobicContact CD2-CD1 4.47Å; L352-I356 WeakPolarHBondContact O-CG1 3.01Å; L352-I356 PolarHBondContact O-N 3.34Å; I356-L359 HydrophobicContact CD1-CD1 3.81Å; I356-L359 HydrophobicContact CD1-CG 4.17Å
357	Q	97.3	Very high	97	Very high	50 Å²	50	10.5 Å²	10.5	23%	0.234	6%	0.057	C	C	.	.	P	Polyproline II helix	trans	-63.1	160.4	169	-64.4	-176	5.3	0	0	111.2	S263 Q268 L269 Q270 L359	S263-Q357 PolarHBondContact OG-NE2 3.01Å; Q268-Q357 HydrophobicContact CB-CG 3.88Å; L269-Q357 PolarHBondContact O-N 3.28Å; Q270-Q357 HydrophobicContact CB-CG 4.45Å; Q357-L359 PolarHBondContact O-N 3.33Å
358	P	97.6	Very high	95.9	Very high	13 Å²	13	12 Å²	12	8%	0.084	7%	0.072	C	C	.	.	P	Polyproline II helix	trans	-60.6	131.1	179.6	-24.8	37.2	0	0	0	113.1	Y360 S395 Y396	P358-Y360 HydrophobicContact CB-CE2 3.68Å; P358-S395 WeakPolarHBondContact CD-O 3.26Å; P358-S395 VanDerWaalsContact CG-O 3.25Å; P358-S395 WeakPolarHBondContact CG-O 3.34Å; P358-Y396 HydrophobicContact CB-CD1 4.02Å; P358-Y396 HydrophobicContact CB-CE1 4Å; P358-Y396 HydrophobicContact CG-CD1 3.51Å; P358-Y396 HydrophobicContact CG-CD2 3.76Å; P358-Y396 HydrophobicContact CG-CE1 3.42Å; P358-Y396 VanDerWaalsContact CG-CE1 3.42Å; P358-Y396 HydrophobicContact CG-CE2 3.66Å; P358-Y396 HydrophobicContact CG-CG 3.68Å; P358-Y396 VanDerWaalsContact CG-CZ 3.49Å
359	L	97.9	Very high	94.3	Very high	14 Å²	14	18.6 Å²	18.6	7%	0.073	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-102.8	123.9	178.3	-67	-178.9	0	0	0	110.1	L240 F260 L271 G346 V347 I356 Q357	L240-L359 HydrophobicContact CD1-CD1 3.68Å; L240-L359 HydrophobicContact CD2-CD1 3.78Å; L240-L359 HydrophobicContact CG-CD1 4.38Å; F260-L359 HydrophobicContact CE1-CD1 4.32Å; F260-L359 HydrophobicContact CE1-CD2 4.45Å; F260-L359 HydrophobicContact CZ-CD1 4.16Å; L271-L359 HydrophobicContact CB-CD2 4.01Å; L271-L359 HydrophobicContact CD2-CD2 4.27Å; G346-L359 CarbonylContact C-O 3.58Å; G346-L359 WeakPolarHBondContact CA-O 3.19Å; V347-L359 HydrophobicContact CG2-CB 3.97Å; V347-L359 PolarHBondContact N-O 2.69Å; I356-L359 HydrophobicContact CD1-CD1 3.81Å; I356-L359 HydrophobicContact CD1-CG 4.17Å; Q357-L359 PolarHBondContact O-N 3.33Å
360	Y	98.3	Very high	92.7	Very high	28 Å²	28	25.5 Å²	25.5	11%	0.11	13%	0.127	C	C	.	.			trans	-106.3	163.4	-179.2	-61.9	-82.3	0	0	0	111.4	W342 T343 V344 P358 K397 Q399	W342-Y360 WeakPolarHBondContact O-CD1 3.49Å; T343-Y360 WeakPolarHBondContact O-CD1 3.43Å; T343-Y360 WeakPolarHBondContact O-CE1 3.26Å; V344-Y360 WeakPolarHBondContact O-CE1 3.3Å; V344-Y360 PolarHBondContact O-OH 2.84Å; P358-Y360 HydrophobicContact CB-CE2 3.68Å; Y360-K397 HydrophobicContact CD2-CG 4.46Å; Y360-K397 WeakPolarHBondContact CE1-O 3.42Å; Y360-K397 HydrophobicContact CE2-CG 3.86Å; Y360-K397 VanDerWaalsContact CZ-O 3.3Å; Y360-K397 PolarHBondContact OH-N 2.88Å; Y360-K397 PolarHBondContact OH-O 3.42Å; Y360-Q399 HydrophobicContact CD1-CB 3.62Å; Y360-Q399 HydrophobicContact CD1-CG 4.48Å; Y360-Q399 HydrophobicContact CD2-CB 4.34Å; Y360-Q399 HydrophobicContact CE1-CB 4.3Å; Y360-Q399 HydrophobicContact CG-CB 3.63Å; Y360-Q399 HydrophobicContact CG-CG 4.12Å
361	I	98.5	Very high	90.9	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.155	C	C	.	.			trans	-95.9	125.9	173.8	-53	177.7	0	0	0	107.7	F183 L277 L279 L339 W342 V347 T363 I364 I401	F183-I361 HydrophobicContact CE1-CD1 3.82Å; F183-I361 HydrophobicContact CE1-CG1 4.11Å; F183-I361 HydrophobicContact CZ-CD1 4.18Å; L277-I361 CarbonylContact O-C 3.59Å; L277-I361 WeakPolarHBondContact O-CA 3.48Å; L279-I361 HydrophobicContact CB-CG2 4.11Å; L279-I361 HydrophobicContact CD2-CD1 4Å; L339-I361 HydrophobicContact CD2-CD1 4.16Å; W342-I361 HydrophobicContact CE3-CD1 4.42Å; V347-I361 HydrophobicContact CG1-CD1 3.95Å; V347-I361 HydrophobicContact CG1-CG1 3.76Å; I361-T363 VanDerWaalsContact CG2-O 3.3Å; I361-T363 WeakPolarHBondContact CG2-O 3.4Å; I361-I364 HydrophobicContact CG2-CG1 3.95Å; I361-I401 HydrophobicContact CB-CD1 4.08Å; I361-I401 HydrophobicContact CB-CG1 4.21Å; I361-I401 HydrophobicContact CD1-CD1 4.42Å; I361-I401 HydrophobicContact CG2-CG2 4.22Å
362	T	97.3	Very high	89.4	Confident	36 Å²	36	33.2 Å²	33.2	22%	0.221	16%	0.163	C	C	.	.			trans	-79.9	-53.2	179.1	-55.2	0	0	0	0	111	W146 L277 L402	W146-T362 HydrophobicContact CD2-CG2 4.12Å; W146-T362 HydrophobicContact CG-CG2 4.47Å; W146-T362 HydrophobicContact CZ2-CG2 3.86Å; L277-T362 PolarHBondContact O-N 3.11Å; T362-L402 PolarHBondContact O-N 2.94Å
363	T	96.7	Very high	88.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.5	174.6	76.8	0	0	0	0	112.9	W146 H151 H278 L279 I361 L402 L404	W146-T363 HydrophobicContact CB-CG2 3.71Å; W146-T363 HydrophobicContact CG-CG2 3.75Å; H151-T363 PolarHBondContact NE2-OG1 2.8Å; H151-T363 VanDerWaalsContact NE2-OG1 3.07Å; H278-T363 PolarHBondContact ND1-OG1 3.01Å; L279-T363 PolarHBondContact N-O 2.69Å; I361-T363 VanDerWaalsContact CG2-O 3.3Å; I361-T363 WeakPolarHBondContact CG2-O 3.4Å; T363-L402 CarbonylContact C-O 3.59Å; T363-L402 WeakPolarHBondContact CA-O 3.36Å; T363-L402 WeakPolarHBondContact CB-O 3.31Å; T363-L402 HydrophobicContact CG2-CB 4.02Å; T363-L402 HydrophobicContact CG2-CD2 4.06Å; T363-L402 HydrophobicContact CG2-CG 4.31Å; T363-L404 HydrophobicContact CG2-CD1 4.21Å
364	I	95.8	Very high	87.4	Confident	1 Å²	1	41 Å²	41	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121	163.8	-73.3	173.4	0	0	0	109.1	L279 T281 L339 I361 L366 I401 L402 F403 L404	L279-I364 HydrophobicContact CB-CG1 4.01Å; L279-I364 HydrophobicContact CD2-CD1 4.02Å; L279-I364 HydrophobicContact CD2-CG1 4.05Å; L279-I364 HydrophobicContact CG-CG1 4.27Å; L279-I364 CarbonylContact O-C 3.56Å; L279-I364 VanDerWaalsContact O-CA 3.26Å; L279-I364 WeakPolarHBondContact O-CA 3.41Å; T281-I364 HydrophobicContact CG2-CG2 4.35Å; L339-I364 HydrophobicContact CD1-CD1 4.31Å; L339-I364 HydrophobicContact CD2-CD1 3.84Å; I361-I364 HydrophobicContact CG2-CG1 3.95Å; I364-L366 HydrophobicContact CG2-CD2 3.42Å; I364-L366 VanDerWaalsContact CG2-CD2 3.42Å; I364-L366 HydrophobicContact CG2-CG 3.91Å; I364-I401 HydrophobicContact CB-CG2 4Å; I364-I401 HydrophobicContact CD1-CD1 4.11Å; I364-I401 HydrophobicContact CD1-CG2 3.78Å; I364-I401 HydrophobicContact CG1-CG2 3.62Å; I364-L402 PolarHBondContact N-O 3.31Å; I364-F403 HydrophobicContact CB-CD1 3.85Å; I364-F403 HydrophobicContact CB-CE1 3.77Å; I364-F403 HydrophobicContact CB-CZ 4.39Å; I364-F403 HydrophobicContact CD1-CE1 3.77Å; I364-F403 HydrophobicContact CD1-CZ 3.75Å; I364-F403 HydrophobicContact CG1-CE1 4.34Å; I364-F403 HydrophobicContact CG2-CD1 3.83Å; I364-F403 HydrophobicContact CG2-CE1 3.69Å; I364-F403 WeakPolarHBondContact O-CA 3.37Å; I364-L404 PolarHBondContact O-N 3.24Å
365	V	95.1	Very high	86.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.1	171.6	178.3	0	0	0	0	108.5	K152 M155 L279 Y280 T281 L404	K152-V365 HydrophobicContact CB-CG1 4.18Å; M155-V365 HydrophobicContact CB-CB 4.27Å; M155-V365 HydrophobicContact CB-CG1 4.41Å; M155-V365 HydrophobicContact CB-CG2 3.89Å; M155-V365 HydrophobicContact CG-CG2 4.01Å; L279-V365 PolarHBondContact O-N 3.42Å; Y280-V365 HydrophobicContact CD2-CB 3.97Å; Y280-V365 HydrophobicContact CD2-CG1 3.74Å; Y280-V365 WeakPolarHBondContact CD2-O 3.3Å; Y280-V365 HydrophobicContact CE2-CG1 4.08Å; T281-V365 PolarHBondContact N-O 3.31Å; V365-L404 WeakPolarHBondContact CA-O 3.29Å; V365-L404 HydrophobicContact CG2-CB 4.23Å; V365-L404 HydrophobicContact CG2-CD1 4.31Å
366	L	92.2	Very high	85.8	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.058	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	99.2	179.1	-63.7	-173.8	0	0	0	110.5	T281 I364 N373 V376 F403 L404 G406	T281-L366 HydrophobicContact CG2-CD2 3.35Å; I364-L366 HydrophobicContact CG2-CD2 3.42Å; I364-L366 VanDerWaalsContact CG2-CD2 3.42Å; I364-L366 HydrophobicContact CG2-CG 3.91Å; L366-N373 WeakPolarHBondContact CD1-OD1 3.31Å; L366-V376 HydrophobicContact CD1-CB 4.24Å; L366-V376 HydrophobicContact CD1-CG1 4.06Å; L366-V376 HydrophobicContact CD1-CG2 4.35Å; L366-F403 HydrophobicContact CD1-CD1 3.8Å; L366-F403 HydrophobicContact CD1-CE1 4.27Å; L366-F403 HydrophobicContact CD2-CD1 4.46Å; L366-F403 HydrophobicContact CD2-CE1 4.49Å; L366-F403 HydrophobicContact CG-CD1 4.01Å; L366-F403 HydrophobicContact CG-CE1 4.49Å; L366-L404 PolarHBondContact N-O 3.49Å; L366-G406 WeakPolarHBondContact O-CA 3.44Å; L366-G406 PolarHBondContact O-N 2.63Å
367	G	87	Confident	85.3	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.7	164.7	0	0	0	0	0	110.8	T281 N282 D407	T281-G367 PolarHBondContact O-N 2.79Å; N282-G367 CarbonylContact C-O 3.47Å; G367-D407 VanDerWaalsContact CA-O 3.29Å; G367-D407 WeakPolarHBondContact CA-O 3.48Å
368	G	75.1	Confident	84.8	Confident	31 Å²	31	42.7 Å²	42.7	32%	0.32	21%	0.211	S	C	.	.	S	Bend	trans	130.4	-140.5	174.7	0	0	0	0	0	114.4	R370	G368-R370 PolarHBondContact O-N 2.88Å
369	Q	65.3	Low	84.1	Confident	141 Å²	141	42.1 Å²	42.1	66%	0.659	21%	0.207	S	C	*	.			trans	-68.3	97.7	-174.9	-72.5	165.8	-49.2	0	0	110.9	I371 Y372	Q369-I371 PolarHBondContact O-N 2.86Å; Q369-Y372 HydrophobicContact CB-CD2 3.81Å; Q369-Y372 HydrophobicContact CB-CE2 3.76Å; Q369-Y372 HydrophobicContact CG-CE2 4.45Å; Q369-Y372 PolarHBondContact O-N 2.87Å
370	R	64.8	Low	83.8	Confident	153 Å²	153	41.5 Å²	41.5	58%	0.577	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-56.6	-19.4	-175.5	-65.4	-176.2	178.5	177.9	-0.3	114.8	G368 Y372 N373 P405 D407	G368-R370 PolarHBondContact O-N 2.88Å; R370-Y372 VanDerWaalsContact C-N 3.26Å; R370-Y372 PolarHBondContact O-N 3Å; R370-N373 WeakPolarHBondContact CA-ND2 3.43Å; R370-N373 PolarHBondContact O-ND2 3.1Å; R370-P405 HydrophobicContact CG-CB 4.12Å; R370-D407 IonicContact NH2-OD1 2.83Å; R370-D407 PolarHBondContact NH2-OD1 2.78Å
371	I	60.3	Low	83.4	Confident	129 Å²	129	40.5 Å²	40.5	66%	0.662	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-58.4	-34.1	-177.7	-61.7	170.7	0	0	0	112.2	Q369	Q369-I371 PolarHBondContact O-N 2.86Å
372	Y	68.3	Low	82.9	Confident	51 Å²	51	45.6 Å²	45.6	20%	0.2	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-95.3	7.3	-168.4	-53.3	-62.5	0	0	0	115.7	F292 Q369 R370 E374 E375 V376	F292-Y372 AromaticContact CD2-CD1 3.58Å; F292-Y372 HydrophobicContact CD2-CD1 3.58Å; F292-Y372 HydrophobicContact CD2-CE1 4.03Å; F292-Y372 HydrophobicContact CD2-CG 4.38Å; F292-Y372 AromaticContact CE2-CD1 3.93Å; F292-Y372 HydrophobicContact CE2-CD1 3.93Å; F292-Y372 HydrophobicContact CE2-CG 4.36Å; Q369-Y372 HydrophobicContact CB-CD2 3.81Å; Q369-Y372 HydrophobicContact CB-CE2 3.76Å; Q369-Y372 HydrophobicContact CG-CE2 4.45Å; Q369-Y372 PolarHBondContact O-N 2.87Å; R370-Y372 VanDerWaalsContact C-N 3.26Å; R370-Y372 PolarHBondContact O-N 3Å; Y372-E374 PolarHBondContact O-N 3.35Å; Y372-E375 VanDerWaalsContact C-OE2 3.31Å; Y372-E375 VanDerWaalsContact CA-OE2 3.29Å; Y372-E375 WeakPolarHBondContact CA-OE2 3.26Å; Y372-V376 WeakPolarHBondContact O-CB 3.3Å; Y372-V376 WeakPolarHBondContact O-CG2 3.21Å; Y372-V376 PolarHBondContact O-N 2.83Å
373	N	75	Confident	82.4	Confident	15 Å²	15	44.4 Å²	44.4	8%	0.08	21%	0.214	C	C	.	.	H	α-helix	trans	-65.6	-41.6	-171.7	-76.9	-74	0	0	0	112.8	L366 R370 S377	L366-N373 WeakPolarHBondContact CD1-OD1 3.31Å; R370-N373 WeakPolarHBondContact CA-ND2 3.43Å; R370-N373 PolarHBondContact O-ND2 3.1Å; N373-S377 WeakPolarHBondContact O-CB 3.27Å; N373-S377 PolarHBondContact O-N 3.05Å
374	E	80.1	Confident	82.1	Confident	157 Å²	157	44.4 Å²	44.4	73%	0.734	21%	0.214	S	C	*	.	H	α-helix	trans	-69.6	-43.8	-177.3	-65.6	-178.3	-167.5	0	0	110.8	Y372 S377 D378	Y372-E374 PolarHBondContact O-N 3.35Å; E374-S377 WeakPolarHBondContact O-CB 3.46Å; E374-S377 PolarHBondContact O-N 3.05Å; E374-D378 PolarHBondContact O-N 2.89Å
375	E	79.1	Confident	81.7	Confident	56 Å²	56	45.2 Å²	45.2	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-75.6	-29.2	-178.3	-49.5	99.4	127.3	0	0	112.9	F292 W302 Y372 I379	F292-E375 HydrophobicContact CD1-CB 4.15Å; F292-E375 HydrophobicContact CE1-CB 3.33Å; F292-E375 HydrophobicContact CE1-CG 4.17Å; F292-E375 HydrophobicContact CE2-CB 4.02Å; F292-E375 HydrophobicContact CZ-CB 3.24Å; F292-E375 HydrophobicContact CZ-CG 4.34Å; W302-E375 HydrophobicContact CH2-CB 3.95Å; W302-E375 HydrophobicContact CH2-CG 4.29Å; Y372-E375 VanDerWaalsContact C-OE2 3.31Å; Y372-E375 VanDerWaalsContact CA-OE2 3.29Å; Y372-E375 WeakPolarHBondContact CA-OE2 3.26Å; E375-I379 WeakPolarHBondContact O-CB 3.4Å; E375-I379 VanDerWaalsContact O-CG1 3.28Å; E375-I379 WeakPolarHBondContact O-CG1 3.34Å; E375-I379 PolarHBondContact O-N 2.78Å
376	V	82.4	Confident	81.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-41	168.1	175.6	0	0	0	0	110.3	C284 A289 L366 Y372 T380 F403	C284-V376 WeakPolarHBondContact SG-CG2 3.41Å; A289-V376 HydrophobicContact CB-CB 4.49Å; A289-V376 HydrophobicContact CB-CG2 3.71Å; L366-V376 HydrophobicContact CD1-CB 4.24Å; L366-V376 HydrophobicContact CD1-CG1 4.06Å; L366-V376 HydrophobicContact CD1-CG2 4.35Å; Y372-V376 WeakPolarHBondContact O-CB 3.3Å; Y372-V376 WeakPolarHBondContact O-CG2 3.21Å; Y372-V376 PolarHBondContact O-N 2.83Å; V376-T380 VanDerWaalsContact O-CB 3.29Å; V376-T380 WeakPolarHBondContact O-CB 3.34Å; V376-T380 PolarHBondContact O-N 2.93Å; V376-T380 PolarHBondContact O-OG1 3.41Å; V376-F403 HydrophobicContact CG1-CD1 3.99Å; V376-F403 HydrophobicContact CG1-CE1 3.48Å; V376-F403 VanDerWaalsContact CG1-CE1 3.48Å; V376-F403 HydrophobicContact CG1-CZ 3.91Å
377	S	88.1	Confident	81.1	Confident	28 Å²	28	51.5 Å²	51.5	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-50.5	174.5	-171.2	0	0	0	0	111.1	N373 E374 I379 T380 N381 F403	N373-S377 WeakPolarHBondContact O-CB 3.27Å; N373-S377 PolarHBondContact O-N 3.05Å; E374-S377 WeakPolarHBondContact O-CB 3.46Å; E374-S377 PolarHBondContact O-N 3.05Å; S377-I379 PolarHBondContact O-N 2.84Å; S377-T380 PolarHBondContact O-N 2.92Å; S377-T380 VanDerWaalsContact O-N 3.12Å; S377-N381 VanDerWaalsContact O-CB 3.32Å; S377-N381 WeakPolarHBondContact O-CB 3.34Å; S377-N381 PolarHBondContact O-N 3Å; S377-N381 PolarHBondContact O-ND2 3.19Å; S377-N381 PolarHBondContact OG-ND2 2.91Å; S377-N381 VanDerWaalsContact OG-ND2 3.13Å; S377-F403 VanDerWaalsContact CA-CD2 3.5Å
378	D	85.8	Confident	81.4	Confident	29 Å²	29	51.9 Å²	51.9	16%	0.155	27%	0.266	C	S	.	.	I	π-helix	trans	-59.5	-45.5	178.5	-88.3	34.2	0	0	0	112.7	W302 E374 T380 K382 R383	W302-D378 HydrophobicContact CD2-CB 4.42Å; W302-D378 HydrophobicContact CH2-CB 4.02Å; W302-D378 HydrophobicContact CZ2-CB 3.46Å; W302-D378 VanDerWaalsContact CZ2-CB 3.46Å; W302-D378 PolarHBondContact NE1-OD2 2.74Å; W302-D378 VanDerWaalsContact NE1-OD2 3.1Å; E374-D378 PolarHBondContact O-N 2.89Å; D378-T380 VanDerWaalsContact C-N 3.27Å; D378-T380 PolarHBondContact O-N 3.23Å; D378-K382 HydrophobicContact CB-CD 4.29Å; D378-K382 WeakPolarHBondContact O-CB 3.41Å; D378-K382 PolarHBondContact O-N 3.07Å; D378-K382 WeakPolarHBondContact OD1-CE 3.44Å; D378-K382 IonicContact OD1-NZ 3.83Å; D378-K382 PolarHBondContact OD1-NZ 3.48Å; D378-K382 WeakPolarHBondContact OD2-CD 3.21Å; D378-K382 IonicContact OD2-NZ 2.65Å; D378-K382 PolarHBondContact OD2-NZ 3.06Å; D378-R383 PolarHBondContact O-N 3.07Å
379	I	84.1	Confident	81.8	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	28%	0.282	C	S	.	.	I	π-helix	trans	-64	-33.1	176.8	-75.6	177.3	0	0	0	112.1	A288 A289 F292 W302 L305 C340 E375 S377 R383	A288-I379 HydrophobicContact CB-CD1 4.02Å; A288-I379 HydrophobicContact CB-CG2 3.96Å; A289-I379 HydrophobicContact CB-CD1 4.04Å; F292-I379 HydrophobicContact CE1-CD1 3.56Å; F292-I379 HydrophobicContact CZ-CD1 3.77Å; W302-I379 HydrophobicContact CE3-CD1 4.45Å; W302-I379 HydrophobicContact CE3-CG1 3.79Å; W302-I379 HydrophobicContact CH2-CG1 4.42Å; W302-I379 HydrophobicContact CZ3-CD1 3.9Å; W302-I379 HydrophobicContact CZ3-CG1 3.55Å; L305-I379 HydrophobicContact CD1-CD1 3.8Å; L305-I379 HydrophobicContact CD1-CG1 3.97Å; C340-I379 PolarHBondContact SG-O 2.63Å; E375-I379 WeakPolarHBondContact O-CB 3.4Å; E375-I379 VanDerWaalsContact O-CG1 3.28Å; E375-I379 WeakPolarHBondContact O-CG1 3.34Å; E375-I379 PolarHBondContact O-N 2.78Å; S377-I379 PolarHBondContact O-N 2.84Å; I379-R383 VanDerWaalsContact O-CB 3.24Å; I379-R383 WeakPolarHBondContact O-CB 3.35Å
380	T	89.6	Confident	82.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-81.3	-49.1	-177.8	-57.1	0	0	0	0	111.7	L339 C340 T343 V376 S377 D378 I401 F403	L339-T380 HydrophobicContact CB-CG2 4.01Å; C340-T380 WeakPolarHBondContact CA-O 3.23Å; C340-T380 PolarHBondContact SG-O 3.42Å; T343-T380 HydrophobicContact CG2-CG2 3.87Å; V376-T380 VanDerWaalsContact O-CB 3.29Å; V376-T380 WeakPolarHBondContact O-CB 3.34Å; V376-T380 PolarHBondContact O-N 2.93Å; V376-T380 PolarHBondContact O-OG1 3.41Å; S377-T380 PolarHBondContact O-N 2.92Å; S377-T380 VanDerWaalsContact O-N 3.12Å; D378-T380 VanDerWaalsContact C-N 3.27Å; D378-T380 PolarHBondContact O-N 3.23Å; T380-I401 HydrophobicContact CG2-CD1 4.06Å; T380-F403 HydrophobicContact CG2-CE2 3.91Å; T380-F403 HydrophobicContact CG2-CZ 3.9Å; T380-F403 WeakPolarHBondContact OG1-CZ 3.48Å
381	N	91.6	Very high	84.1	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	29%	0.29	C	S	.	.	I	π-helix	trans	-91.9	-47.1	-168.8	-65.3	-30.6	0	0	0	112.5	S377 K398 D400 I401	S377-N381 VanDerWaalsContact O-CB 3.32Å; S377-N381 WeakPolarHBondContact O-CB 3.34Å; S377-N381 PolarHBondContact O-N 3Å; S377-N381 PolarHBondContact O-ND2 3.19Å; S377-N381 PolarHBondContact OG-ND2 2.91Å; S377-N381 VanDerWaalsContact OG-ND2 3.13Å; N381-K398 WeakPolarHBondContact O-CE 3.29Å; N381-K398 PolarHBondContact O-NZ 3.38Å; N381-D400 HydrophobicContact CB-CB 4.19Å; N381-I401 PolarHBondContact ND2-O 3.25Å; N381-I401 PolarHBondContact OD1-N 3.05Å
382	K	88.2	Confident	85.8	Confident	110 Å²	110	46.7 Å²	46.7	48%	0.478	26%	0.263	S	S	.	.	I	π-helix	trans	-86.7	-21.6	-170.6	-57.1	-178.8	-172.8	162.1	0	114.2	D378 L384 G385	D378-K382 HydrophobicContact CB-CD 4.29Å; D378-K382 WeakPolarHBondContact O-CB 3.41Å; D378-K382 PolarHBondContact O-N 3.07Å; D378-K382 WeakPolarHBondContact OD1-CE 3.44Å; D378-K382 IonicContact OD1-NZ 3.83Å; D378-K382 PolarHBondContact OD1-NZ 3.48Å; D378-K382 WeakPolarHBondContact OD2-CD 3.21Å; D378-K382 IonicContact OD2-NZ 2.65Å; D378-K382 PolarHBondContact OD2-NZ 3.06Å; K382-L384 VanDerWaalsContact C-N 3.32Å; K382-L384 PolarHBondContact O-N 2.84Å; K382-G385 WeakPolarHBondContact O-CA 3.42Å; K382-G385 PolarHBondContact O-N 3Å
383	R	86.8	Confident	87	Confident	11 Å²	11	46.1 Å²	46.1	4%	0.042	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.2	-172.9	-172.2	-175.3	-173.6	-175.8	7.7	114.7	L305 K306 D337 D378 I379 G385 N509	L305-R383 PolarHBondContact O-NH2 2.95Å; K306-R383 VanDerWaalsContact C-NH2 3.28Å; K306-R383 PolarHBondContact O-NH2 2.96Å; K306-R383 VanDerWaalsContact O-NH2 3.16Å; D337-R383 IonicContact OD1-CZ 2.7Å; D337-R383 IonicContact OD1-NH1 2.8Å; D337-R383 PolarHBondContact OD1-NH1 2.7Å; D378-R383 PolarHBondContact O-N 3.07Å; I379-R383 VanDerWaalsContact O-CB 3.24Å; I379-R383 WeakPolarHBondContact O-CB 3.35Å; R383-G385 VanDerWaalsContact C-N 3.26Å; R383-N509 PolarHBondContact O-ND2 2.79Å
384	L	89.9	Confident	87.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.5	172	-78.8	-178.2	0	0	0	113.1	C340 V344 K382 W388 I502 R505 F506	C340-L384 WeakPolarHBondContact O-CD1 3.5Å; V344-L384 HydrophobicContact CB-CD1 4.45Å; V344-L384 HydrophobicContact CG2-CD1 3.81Å; K382-L384 VanDerWaalsContact C-N 3.32Å; K382-L384 PolarHBondContact O-N 2.84Å; L384-W388 HydrophobicContact CB-CZ2 4.01Å; L384-W388 HydrophobicContact CD1-CZ2 4.47Å; L384-W388 HydrophobicContact CD2-CZ2 4.44Å; L384-W388 PolarHBondContact O-NE1 3.37Å; L384-I502 HydrophobicContact CD1-CG1 4.4Å; L384-I502 HydrophobicContact CD1-CG2 4.27Å; L384-I502 HydrophobicContact CD2-CG2 4.16Å; L384-R505 HydrophobicContact CD2-CB 4.05Å; L384-R505 HydrophobicContact CD2-CG 3.97Å; L384-R505 WeakPolarHBondContact O-CG 3.39Å; L384-R505 PolarHBondContact O-NE 3.47Å; L384-F506 HydrophobicContact CD2-CD1 4.11Å; L384-F506 HydrophobicContact CD2-CD2 4.5Å; L384-F506 HydrophobicContact CD2-CE1 3.76Å; L384-F506 HydrophobicContact CD2-CE2 4.19Å; L384-F506 HydrophobicContact CD2-CG 4.46Å; L384-F506 HydrophobicContact CD2-CZ 3.81Å; L384-F506 HydrophobicContact CG-CE1 4.38Å; L384-F506 HydrophobicContact CG-CZ 4.35Å
385	G	86.8	Confident	88.1	Confident	17 Å²	17	48.7 Å²	48.7	18%	0.175	29%	0.286	C	S	.	.			trans	64.2	177.7	-175.1	0	0	0	0	0	113.4	K382 R383 W388 K398	K382-G385 WeakPolarHBondContact O-CA 3.42Å; K382-G385 PolarHBondContact O-N 3Å; R383-G385 VanDerWaalsContact C-N 3.26Å; G385-W388 VanDerWaalsContact O-CD1 3.29Å; G385-W388 PolarHBondContact O-NE1 2.78Å; G385-K398 WeakPolarHBondContact O-CD 3.48Å; G385-K398 VanDerWaalsContact O-CE 3.3Å; G385-K398 WeakPolarHBondContact O-CE 3.43Å
386	D	87.9	Confident	88.8	Confident	104 Å²	104	46.5 Å²	46.5	56%	0.556	28%	0.276	S	S	*	.	S	Bend	trans	-104.7	-175.6	177.7	-51.7	-65.2	0	0	0	110.4	K398 R505	D386-K398 WeakPolarHBondContact OD1-CE 3.48Å; D386-K398 IonicContact OD1-NZ 3.65Å; D386-K398 PolarHBondContact OD1-NZ 3.1Å; D386-R505 PolarHBondContact O-NH2 3.23Å
387	G	87.8	Confident	89.4	Confident	39 Å²	39	51.6 Å²	51.6	40%	0.402	30%	0.298	S	S	.	.			trans	76.3	48	-173.9	0	0	0	0	0	111.8	E389 I391	G387-E389 WeakPolarHBondContact CA-OE2 3.26Å; G387-E389 PolarHBondContact N-OE2 3Å; G387-I391 VanDerWaalsContact O-CD1 3.25Å; G387-I391 WeakPolarHBondContact O-CD1 3.31Å
388	W	91.8	Very high	89.8	Confident	10 Å²	10	51.5 Å²	51.5	4%	0.038	29%	0.294	C	S	.	.			trans	-96.8	-13.2	171.1	-70.6	90.7	0	0	0	112.2	V344 L384 G385 G390 I391 L392 K398 L501 I502 R505	V344-W388 HydrophobicContact CG1-CE3 4.2Å; V344-W388 HydrophobicContact CG1-CZ3 4.2Å; V344-W388 HydrophobicContact CG2-CZ2 4.4Å; L384-W388 HydrophobicContact CB-CZ2 4.01Å; L384-W388 HydrophobicContact CD1-CZ2 4.47Å; L384-W388 HydrophobicContact CD2-CZ2 4.44Å; L384-W388 PolarHBondContact O-NE1 3.37Å; G385-W388 VanDerWaalsContact O-CD1 3.29Å; G385-W388 PolarHBondContact O-NE1 2.78Å; W388-G390 PolarHBondContact O-N 3.41Å; W388-I391 PolarHBondContact O-N 2.91Å; W388-L392 HydrophobicContact CB-CD1 3.79Å; W388-L392 HydrophobicContact CB-CG 4.09Å; W388-L392 HydrophobicContact CD2-CD1 4.5Å; W388-L392 HydrophobicContact CE3-CD1 4.22Å; W388-L392 HydrophobicContact CE3-CD2 3.69Å; W388-L392 HydrophobicContact CE3-CG 3.88Å; W388-L392 HydrophobicContact CG-CD1 4.37Å; W388-L392 HydrophobicContact CZ3-CD2 4.11Å; W388-L392 PolarHBondContact O-N 3.1Å; W388-K398 HydrophobicContact CB-CB 4.38Å; W388-K398 HydrophobicContact CG-CB 4.27Å; W388-K398 HydrophobicContact CG-CD 4.5Å; W388-L501 HydrophobicContact CZ3-CB 4.08Å; W388-I502 HydrophobicContact CH2-CG1 4.11Å; W388-R505 HydrophobicContact CH2-CB 4.11Å; W388-R505 HydrophobicContact CH2-CG 4.28Å; W388-R505 HydrophobicContact CZ2-CB 4.25Å; W388-R505 HydrophobicContact CZ2-CG 3.92Å
389	E	85.2	Confident	90.2	Very high	142 Å²	142	52.9 Å²	52.9	66%	0.664	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	124	176.8	-62.2	63.7	-136.8	0	0	109.2	G387 I391	G387-E389 WeakPolarHBondContact CA-OE2 3.26Å; G387-E389 PolarHBondContact N-OE2 3Å; E389-I391 PolarHBondContact O-N 2.99Å
390	G	85.3	Confident	90.8	Very high	89 Å²	89	55.8 Å²	55.8	92%	0.918	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-9.7	-174.8	0	0	0	0	0	115.8	W388	W388-G390 PolarHBondContact O-N 3.41Å
391	I	92.9	Very high	91	Very high	93 Å²	93	56 Å²	56	48%	0.477	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-37.5	173.6	-51.2	-173.4	0	0	0	111.1	G387 W388 E389 L501	G387-I391 VanDerWaalsContact O-CD1 3.25Å; G387-I391 WeakPolarHBondContact O-CD1 3.31Å; W388-I391 PolarHBondContact O-N 2.91Å; E389-I391 PolarHBondContact O-N 2.99Å; I391-L501 HydrophobicContact CG2-CD1 4.08Å; I391-L501 HydrophobicContact CG2-CD2 4.09Å
392	L	95.4	Very high	91.1	Very high	22 Å²	22	59.2 Å²	59.2	12%	0.115	33%	0.333	C	S	.	.	S	Bend	trans	-77.6	142.2	178.2	-67.1	174.9	0	0	0	112	V344 W388 Y396 K397 V498 L501	V344-L392 HydrophobicContact CG1-CD1 4Å; V344-L392 HydrophobicContact CG1-CD2 3.83Å; W388-L392 HydrophobicContact CB-CD1 3.79Å; W388-L392 HydrophobicContact CB-CG 4.09Å; W388-L392 HydrophobicContact CD2-CD1 4.5Å; W388-L392 HydrophobicContact CE3-CD1 4.22Å; W388-L392 HydrophobicContact CE3-CD2 3.69Å; W388-L392 HydrophobicContact CE3-CG 3.88Å; W388-L392 HydrophobicContact CG-CD1 4.37Å; W388-L392 HydrophobicContact CZ3-CD2 4.11Å; W388-L392 PolarHBondContact O-N 3.1Å; L392-Y396 WeakPolarHBondContact CB-O 3.48Å; L392-K397 VanDerWaalsContact CD1-C 3.45Å; L392-V498 HydrophobicContact CD2-CG1 3.9Å; L392-V498 HydrophobicContact CD2-CG2 4.09Å; L392-L501 HydrophobicContact CD2-CD1 4.49Å
393	P	93	Very high	91.3	Very high	38 Å²	38	54.8 Å²	54.8	25%	0.247	31%	0.314	C	S	.	.			trans	-58.9	144.9	166.9	-21	33.6	0	0	0	111	S395 Y396 I494 V498	P393-S395 PolarHBondContact O-N 3.38Å; P393-Y396 PolarHBondContact O-N 3.06Å; P393-I494 HydrophobicContact CB-CG2 3.68Å; P393-I494 HydrophobicContact CG-CG2 3.77Å; P393-V498 HydrophobicContact CG-CG2 3.94Å
394	L	88.3	Confident	91.6	Very high	190 Å²	190	55.7 Å²	55.7	100%	0.995	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-30.7	-167.1	-64.3	171.9	0	0	0	116.7
395	S	89.8	Confident	91.7	Very high	36 Å²	36	57.9 Å²	57.9	25%	0.252	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-6.5	178.3	55.1	0	0	0	0	114.8	P358 P393	P358-S395 WeakPolarHBondContact CD-O 3.26Å; P358-S395 VanDerWaalsContact CG-O 3.25Å; P358-S395 WeakPolarHBondContact CG-O 3.34Å; P393-S395 PolarHBondContact O-N 3.38Å
396	Y	95.5	Very high	91.8	Very high	11 Å²	11	57.1 Å²	57.1	4%	0.043	33%	0.326	C	S	.	.			trans	-113.8	141.3	-180	-71.9	-102.5	0	0	0	111.2	I345 P358 L392 P393 I494 Y495 V498	I345-Y396 HydrophobicContact CG1-CE1 4.13Å; P358-Y396 HydrophobicContact CB-CD1 4.02Å; P358-Y396 HydrophobicContact CB-CE1 4Å; P358-Y396 HydrophobicContact CG-CD1 3.51Å; P358-Y396 HydrophobicContact CG-CD2 3.76Å; P358-Y396 HydrophobicContact CG-CE1 3.42Å; P358-Y396 VanDerWaalsContact CG-CE1 3.42Å; P358-Y396 HydrophobicContact CG-CE2 3.66Å; P358-Y396 HydrophobicContact CG-CG 3.68Å; P358-Y396 VanDerWaalsContact CG-CZ 3.49Å; L392-Y396 WeakPolarHBondContact CB-O 3.48Å; P393-Y396 PolarHBondContact O-N 3.06Å; Y396-I494 HydrophobicContact CD2-CG2 4.04Å; Y396-I494 HydrophobicContact CE2-CG2 3.66Å; Y396-Y495 WeakPolarHBondContact OH-CD2 3.44Å; Y396-V498 HydrophobicContact CD1-CB 4.22Å; Y396-V498 HydrophobicContact CD1-CG1 3.87Å; Y396-V498 HydrophobicContact CD1-CG2 3.95Å; Y396-V498 HydrophobicContact CD2-CG2 4.01Å; Y396-V498 HydrophobicContact CE1-CB 4.38Å; Y396-V498 HydrophobicContact CE1-CG1 4.32Å; Y396-V498 HydrophobicContact CE1-CG2 4.34Å; Y396-V498 HydrophobicContact CE2-CG2 4.42Å; Y396-V498 HydrophobicContact CG-CG1 4.4Å; Y396-V498 HydrophobicContact CG-CG2 3.77Å
397	K	95	Very high	92	Very high	106 Å²	106	54.9 Å²	54.9	46%	0.461	31%	0.314	S	S	.	.			trans	-135.3	164.8	172.7	56.9	166.6	171.1	168.5	0	111.4	Y360 L392	Y360-K397 HydrophobicContact CD2-CG 4.46Å; Y360-K397 WeakPolarHBondContact CE1-O 3.42Å; Y360-K397 HydrophobicContact CE2-CG 3.86Å; Y360-K397 VanDerWaalsContact CZ-O 3.3Å; Y360-K397 PolarHBondContact OH-N 2.88Å; Y360-K397 PolarHBondContact OH-O 3.42Å; L392-K397 VanDerWaalsContact CD1-C 3.45Å
398	K	95.4	Very high	92.2	Very high	27 Å²	27	56.4 Å²	56.4	12%	0.117	31%	0.308	C	S	.	.			trans	-76.5	124.4	154.4	179.2	167.9	178	-82.3	0	107.6	V344 N381 G385 D386 W388 D400	V344-K398 HydrophobicContact CG2-CB 4.22Å; V344-K398 HydrophobicContact CG2-CG 4.31Å; N381-K398 WeakPolarHBondContact O-CE 3.29Å; N381-K398 PolarHBondContact O-NZ 3.38Å; G385-K398 WeakPolarHBondContact O-CD 3.48Å; G385-K398 VanDerWaalsContact O-CE 3.3Å; G385-K398 WeakPolarHBondContact O-CE 3.43Å; D386-K398 WeakPolarHBondContact OD1-CE 3.48Å; D386-K398 IonicContact OD1-NZ 3.65Å; D386-K398 PolarHBondContact OD1-NZ 3.1Å; W388-K398 HydrophobicContact CB-CB 4.38Å; W388-K398 HydrophobicContact CG-CB 4.27Å; W388-K398 HydrophobicContact CG-CD 4.5Å; K398-D400 WeakPolarHBondContact CE-OD1 3.43Å; K398-D400 WeakPolarHBondContact CG-OD1 3.42Å; K398-D400 IonicContact NZ-OD1 2.65Å; K398-D400 PolarHBondContact NZ-OD1 2.78Å; K398-D400 IonicContact NZ-OD2 2.68Å; K398-D400 PolarHBondContact NZ-OD2 3.16Å
399	Q	95.3	Very high	92.2	Very high	57 Å²	57	56.9 Å²	56.9	27%	0.266	31%	0.312	S	S	.	.			trans	-121.2	108.4	171.2	178.3	60.8	64.2	0	0	108	T343 Y360	T343-Q399 WeakPolarHBondContact CA-O 3.09Å; T343-Q399 VanDerWaalsContact CB-O 3.3Å; T343-Q399 WeakPolarHBondContact CB-O 3.35Å; T343-Q399 PolarHBondContact O-N 3.21Å; Y360-Q399 HydrophobicContact CD1-CB 3.62Å; Y360-Q399 HydrophobicContact CD1-CG 4.48Å; Y360-Q399 HydrophobicContact CD2-CB 4.34Å; Y360-Q399 HydrophobicContact CE1-CB 4.3Å; Y360-Q399 HydrophobicContact CG-CB 3.63Å; Y360-Q399 HydrophobicContact CG-CG 4.12Å
400	D	94.9	Very high	92.5	Very high	63 Å²	63	51.1 Å²	51.1	34%	0.337	29%	0.291	S	S	.	.			trans	-71.7	140.7	174	-74	17.6	0	0	0	109.5	N381 K398	N381-D400 HydrophobicContact CB-CB 4.19Å; K398-D400 WeakPolarHBondContact CE-OD1 3.43Å; K398-D400 WeakPolarHBondContact CG-OD1 3.42Å; K398-D400 IonicContact NZ-OD1 2.65Å; K398-D400 PolarHBondContact NZ-OD1 2.78Å; K398-D400 IonicContact NZ-OD2 2.68Å; K398-D400 PolarHBondContact NZ-OD2 3.16Å
401	I	95.1	Very high	92.7	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.253	C	S	.	.			trans	-96	125.7	-176.8	-58.6	172.9	0	0	0	108.2	T343 I361 I364 T380 N381 F403	T343-I401 HydrophobicContact CG2-CD1 3.87Å; T343-I401 HydrophobicContact CG2-CG1 4.05Å; I361-I401 HydrophobicContact CB-CD1 4.08Å; I361-I401 HydrophobicContact CB-CG1 4.21Å; I361-I401 HydrophobicContact CD1-CD1 4.42Å; I361-I401 HydrophobicContact CG2-CG2 4.22Å; I364-I401 HydrophobicContact CB-CG2 4Å; I364-I401 HydrophobicContact CD1-CD1 4.11Å; I364-I401 HydrophobicContact CD1-CG2 3.78Å; I364-I401 HydrophobicContact CG1-CG2 3.62Å; T380-I401 HydrophobicContact CG2-CD1 4.06Å; N381-I401 PolarHBondContact ND2-O 3.25Å; N381-I401 PolarHBondContact OD1-N 3.05Å; I401-F403 HydrophobicContact CB-CD2 4.41Å; I401-F403 HydrophobicContact CB-CE2 3.94Å; I401-F403 HydrophobicContact CG2-CD2 4.32Å; I401-F403 HydrophobicContact CG2-CE2 4.02Å; I401-F403 HydrophobicContact CG2-CZ 4.4Å; I401-F403 VanDerWaalsContact O-CD2 3.27Å; I401-F403 WeakPolarHBondContact O-CD2 3.13Å; I401-F403 PolarHBondContact O-N 2.77Å
402	L	94	Very high	92.2	Very high	74 Å²	74	48.5 Å²	48.5	39%	0.387	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	110	173.4	176.9	60.3	0	0	0	110	T362 T363 I364 L404	T362-L402 PolarHBondContact O-N 2.94Å; T363-L402 CarbonylContact C-O 3.59Å; T363-L402 WeakPolarHBondContact CA-O 3.36Å; T363-L402 WeakPolarHBondContact CB-O 3.31Å; T363-L402 HydrophobicContact CG2-CB 4.02Å; T363-L402 HydrophobicContact CG2-CD2 4.06Å; T363-L402 HydrophobicContact CG2-CG 4.31Å; I364-L402 PolarHBondContact N-O 3.31Å; L402-L404 HydrophobicContact CD1-CD2 4.18Å; L402-L404 HydrophobicContact CD2-CD2 4.11Å; L402-L404 HydrophobicContact CD2-CG 4.49Å; L402-L404 HydrophobicContact CG-CD2 3.87Å; L402-L404 HydrophobicContact CG-CG 4.1Å
403	F	92.5	Very high	91.4	Very high	17 Å²	17	55.6 Å²	55.6	8%	0.075	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.2	175.1	-77.1	-92.1	0	0	0	110.8	I364 L366 V376 S377 T380 I401	I364-F403 HydrophobicContact CB-CD1 3.85Å; I364-F403 HydrophobicContact CB-CE1 3.77Å; I364-F403 HydrophobicContact CB-CZ 4.39Å; I364-F403 HydrophobicContact CD1-CE1 3.77Å; I364-F403 HydrophobicContact CD1-CZ 3.75Å; I364-F403 HydrophobicContact CG1-CE1 4.34Å; I364-F403 HydrophobicContact CG2-CD1 3.83Å; I364-F403 HydrophobicContact CG2-CE1 3.69Å; I364-F403 WeakPolarHBondContact O-CA 3.37Å; L366-F403 HydrophobicContact CD1-CD1 3.8Å; L366-F403 HydrophobicContact CD1-CE1 4.27Å; L366-F403 HydrophobicContact CD2-CD1 4.46Å; L366-F403 HydrophobicContact CD2-CE1 4.49Å; L366-F403 HydrophobicContact CG-CD1 4.01Å; L366-F403 HydrophobicContact CG-CE1 4.49Å; V376-F403 HydrophobicContact CG1-CD1 3.99Å; V376-F403 HydrophobicContact CG1-CE1 3.48Å; V376-F403 VanDerWaalsContact CG1-CE1 3.48Å; V376-F403 HydrophobicContact CG1-CZ 3.91Å; S377-F403 VanDerWaalsContact CA-CD2 3.5Å; T380-F403 HydrophobicContact CG2-CE2 3.91Å; T380-F403 HydrophobicContact CG2-CZ 3.9Å; T380-F403 WeakPolarHBondContact OG1-CZ 3.48Å; I401-F403 HydrophobicContact CB-CD2 4.41Å; I401-F403 HydrophobicContact CB-CE2 3.94Å; I401-F403 HydrophobicContact CG2-CD2 4.32Å; I401-F403 HydrophobicContact CG2-CE2 4.02Å; I401-F403 HydrophobicContact CG2-CZ 4.4Å; I401-F403 VanDerWaalsContact O-CD2 3.27Å; I401-F403 WeakPolarHBondContact O-CD2 3.13Å; I401-F403 PolarHBondContact O-N 2.77Å
404	L	92.3	Very high	90.7	Very high	30 Å²	30	56.9 Å²	56.9	16%	0.157	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.5	-175.2	-62.8	175.8	0	0	0	110.7	W146 T363 I364 V365 L366 L402 G406	W146-L404 WeakPolarHBondContact O-CD1 3.42Å; T363-L404 HydrophobicContact CG2-CD1 4.21Å; I364-L404 PolarHBondContact O-N 3.24Å; V365-L404 WeakPolarHBondContact CA-O 3.29Å; V365-L404 HydrophobicContact CG2-CB 4.23Å; V365-L404 HydrophobicContact CG2-CD1 4.31Å; L366-L404 PolarHBondContact N-O 3.49Å; L402-L404 HydrophobicContact CD1-CD2 4.18Å; L402-L404 HydrophobicContact CD2-CD2 4.11Å; L402-L404 HydrophobicContact CD2-CG 4.49Å; L402-L404 HydrophobicContact CG-CD2 3.87Å; L402-L404 HydrophobicContact CG-CG 4.1Å; L404-G406 PolarHBondContact O-N 3Å
405	P	91.3	Very high	90.1	Very high	46 Å²	46	50.8 Å²	50.8	30%	0.299	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	115.5	174.8	26.8	-33.1	0	0	0	109.9	K152 R370	K152-P405 WeakPolarHBondContact CD-O 3.5Å; R370-P405 HydrophobicContact CG-CB 4.12Å
406	G	89.7	Confident	89.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	171.7	176.3	0	0	0	0	0	112.9	L366 L404	L366-G406 WeakPolarHBondContact O-CA 3.44Å; L366-G406 PolarHBondContact O-N 2.63Å; L404-G406 PolarHBondContact O-N 3Å
407	D	91.1	Very high	88.7	Confident	58 Å²	58	63.4 Å²	63.4	31%	0.31	34%	0.342	S	S	.	.			trans	-86.5	144.5	171.8	-54.2	-54.3	0	0	0	110	S153 Y280 G367 R370 V409	S153-D407 WeakPolarHBondContact CB-OD2 3.4Å; S153-D407 PolarHBondContact OG-OD2 3.07Å; Y280-D407 PolarHBondContact OH-O 2.89Å; G367-D407 VanDerWaalsContact CA-O 3.29Å; G367-D407 WeakPolarHBondContact CA-O 3.48Å; R370-D407 IonicContact NH2-OD1 2.83Å; R370-D407 PolarHBondContact NH2-OD1 2.78Å; D407-V409 PolarHBondContact O-N 2.94Å
408	Y	93.1	Very high	88.2	Confident	70 Å²	70	59.5 Å²	59.5	28%	0.275	33%	0.326	S	S	.	.			trans	-77	121	178.4	172.6	-100.3	0	0	0	110.3	N282 R283 P411	N282-Y408 HydrophobicContact CB-CD2 3.92Å; N282-Y408 HydrophobicContact CB-CE2 4.07Å; N282-Y408 WeakPolarHBondContact O-CD2 3.03Å; N282-Y408 WeakPolarHBondContact O-CE2 3.34Å; R283-Y408 PolarHBondContact NH2-OH 3.11Å; Y408-P411 WeakPolarHBondContact CE1-O 3.07Å; Y408-P411 PolarHBondContact OH-O 3.03Å
409	V	91.6	Very high	87.7	Confident	21 Å²	21	59.7 Å²	59.7	13%	0.127	33%	0.328	C	S	.	.			trans	-114.8	114.2	174	-50.7	0	0	0	0	110	A156 M180 Y280 N282 D407	A156-V409 HydrophobicContact CB-CG1 4.05Å; M180-V409 HydrophobicContact SD-CG2 4.17Å; Y280-V409 HydrophobicContact CE1-CG2 3.64Å; Y280-V409 WeakPolarHBondContact OH-CG2 3.29Å; Y280-V409 PolarHBondContact OH-N 3.25Å; N282-V409 PolarHBondContact ND2-O 3.21Å; D407-V409 PolarHBondContact O-N 2.94Å
410	G	90.8	Very high	87.6	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	34%	0.339	C	S	.	.	S	Bend	trans	166.2	175.8	-174.9	0	0	0	0	0	111.7
411	P	89.9	Confident	87.6	Confident	21 Å²	21	59.9 Å²	59.9	14%	0.136	33%	0.331	C	S	.	.			trans	-61.4	145.6	171.9	29	-37	0	0	0	110.6	Y174 Y408 E413	Y174-P411 HydrophobicContact CE1-CB 4.2Å; Y408-P411 WeakPolarHBondContact CE1-O 3.07Å; Y408-P411 PolarHBondContact OH-O 3.03Å; P411-E413 WeakPolarHBondContact CB-O 3.27Å
412	A	83.3	Confident	87.8	Confident	105 Å²	105	59.7 Å²	59.7	87%	0.868	33%	0.33	S	S	*	.	S	Bend	trans	-67.4	-40.8	178.1	0	0	0	0	0	111.7
413	E	78	Confident	87.9	Confident	172 Å²	172	56.5 Å²	56.5	80%	0.804	31%	0.313	S	S	*	.	S	Bend	trans	-101.3	147.1	174.9	-63.7	-176.3	178.2	0	0	111.3	P411	P411-E413 WeakPolarHBondContact CB-O 3.27Å
414	T	77	Confident	88.2	Confident	64 Å²	64	55.8 Å²	55.8	39%	0.393	31%	0.31	S	S	.	.			trans	-109.4	102.1	-179.9	59.2	0	0	0	0	110.7
415	S	75.8	Confident	88.5	Confident	63 Å²	63	54.8 Å²	54.8	44%	0.441	30%	0.304	S	S	.	.			trans	-75	128.7	175.4	175	0	0	0	0	111.8	M417 H418	S415-M417 PolarHBondContact O-N 2.73Å; S415-M417 VanDerWaalsContact O-N 3.14Å; S415-M417 WeakPolarHBondContact OG-CB 3.31Å; S415-M417 PolarHBondContact OG-N 2.82Å; S415-H418 PolarHBondContact O-N 2.71Å
416	Q	79.2	Confident	88.9	Confident	159 Å²	159	52.6 Å²	52.6	74%	0.743	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-61.3	-19.1	176.1	-66.2	-178.6	5.2	0	0	113.3	H418 D419	Q416-H418 PolarHBondContact O-N 3Å; Q416-H418 VanDerWaalsContact O-N 3.1Å; Q416-D419 WeakPolarHBondContact O-CB 3.44Å; Q416-D419 PolarHBondContact O-N 3.25Å
417	M	78.3	Confident	89.3	Confident	152 Å²	152	55.3 Å²	55.3	75%	0.749	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-55.4	-28.5	178.7	-174.8	175.7	172.2	0	0	113	S415	S415-M417 PolarHBondContact O-N 2.73Å; S415-M417 VanDerWaalsContact O-N 3.14Å; S415-M417 WeakPolarHBondContact OG-CB 3.31Å; S415-M417 PolarHBondContact OG-N 2.82Å
418	H	83.6	Confident	89.5	Confident	24 Å²	24	55.6 Å²	55.6	11%	0.111	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-102.4	2.7	-177.8	-46.5	-76.2	0	0	0	113.5	D172 S415 Q416 N420 L421	D172-H418 PolarHBondContact O-CE1 2.88Å; S415-H418 PolarHBondContact O-N 2.71Å; Q416-H418 PolarHBondContact O-N 3Å; Q416-H418 VanDerWaalsContact O-N 3.1Å; H418-N420 PolarHBondContact O-N 2.99Å; H418-L421 PolarHBondContact O-N 3.36Å
419	D	84.9	Confident	89.7	Confident	32 Å²	32	53.1 Å²	53.1	17%	0.171	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.8	-176.8	-73.2	7.8	0	0	0	112.6	R209 S210 Q416	R209-D419 VanDerWaalsContact CD-OD1 3.3Å; R209-D419 WeakPolarHBondContact CD-OD1 3.23Å; R209-D419 HydrophobicContact CG-CB 4.42Å; R209-D419 IonicContact CZ-OD1 3.77Å; R209-D419 IonicContact CZ-OD2 3.25Å; R209-D419 IonicContact NE-OD1 2.91Å; R209-D419 IonicContact NH1-OD1 2.66Å; R209-D419 PolarHBondContact NH1-OD1 2.58Å; R209-D419 IonicContact NH1-OD2 2.66Å; R209-D419 PolarHBondContact NH1-OD2 2.82Å; S210-D419 WeakPolarHBondContact CB-O 3.24Å; S210-D419 PolarHBondContact OG-O 3.31Å; Q416-D419 WeakPolarHBondContact O-CB 3.44Å; Q416-D419 PolarHBondContact O-N 3.25Å
420	N	92.9	Very high	89.8	Confident	92 Å²	92	61.7 Å²	61.7	49%	0.492	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	10	175.9	-68.3	-51.6	0	0	0	113.5	H418 S437	H418-N420 PolarHBondContact O-N 2.99Å; N420-S437 WeakPolarHBondContact O-CB 3.45Å; N420-S437 PolarHBondContact O-N 3.34Å
421	L	96.1	Very high	90	Very high	32 Å²	32	62.6 Å²	62.6	17%	0.168	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	155.2	172.6	-63.7	-179.2	0	0	0	111.2	F173 H418 V434 L435 S437 V443	F173-L421 HydrophobicContact CD1-CD1 4.16Å; F173-L421 HydrophobicContact CE1-CD1 4.45Å; H418-L421 PolarHBondContact O-N 3.36Å; L421-V434 HydrophobicContact CD2-CG1 4.24Å; L421-L435 CarbonylContact C-O 3.28Å; L421-L435 WeakPolarHBondContact CA-O 3.43Å; L421-S437 PolarHBondContact O-OG 3.15Å; L421-S437 VanDerWaalsContact O-OG 3.11Å; L421-V443 HydrophobicContact CD2-CG1 4Å
422	S	97.5	Very high	90.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.7	164.9	44.6	0	0	0	0	110.2	A207 C226 V434 L435 S437	A207-S422 CarbonylContact O-C 3.14Å; A207-S422 WeakPolarHBondContact O-CA 3.36Å; A207-S422 WeakPolarHBondContact O-CB 3.3Å; C226-S422 WeakPolarHBondContact CB-OG 3.37Å; S422-V434 CarbonylContact O-C 3.27Å; S422-V434 VanDerWaalsContact O-CA 3.31Å; S422-V434 WeakPolarHBondContact O-CA 3.17Å; S422-L435 PolarHBondContact N-O 2.89Å; S422-L435 PolarHBondContact O-N 3.26Å; S422-S437 WeakPolarHBondContact CB-OG 3.45Å; S422-S437 PolarHBondContact N-OG 2.76Å; S422-S437 PolarHBondContact OG-OG 3.2Å
423	I	98.1	Very high	91	Very high	7 Å²	7	56.6 Å²	56.6	4%	0.036	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.4	-177.4	-49.7	-174.3	0	0	0	108.5	F163 L167 F173 C176 G206 A207 I231 I432 V434	F163-I423 HydrophobicContact CZ-CD1 4.18Å; L167-I423 HydrophobicContact CD1-CD1 4.19Å; L167-I423 HydrophobicContact CD2-CD1 4.11Å; F173-I423 HydrophobicContact CB-CD1 3.83Å; C176-I423 HydrophobicContact CB-CD1 3.51Å; C176-I423 HydrophobicContact CB-CG1 3.86Å; G206-I423 CarbonylContact C-O 3.53Å; G206-I423 VanDerWaalsContact CA-O 3.27Å; G206-I423 WeakPolarHBondContact CA-O 3.39Å; A207-I423 HydrophobicContact CB-CB 4.31Å; A207-I423 PolarHBondContact N-O 2.83Å; A207-I423 PolarHBondContact O-N 3.06Å; I231-I423 VanDerWaalsContact CG2-O 3.29Å; I231-I423 WeakPolarHBondContact CG2-O 3.49Å; I423-I432 HydrophobicContact CG2-CB 3.75Å; I423-I432 HydrophobicContact CG2-CD1 4.08Å; I423-I432 HydrophobicContact CG2-CG1 4.31Å; I423-I432 HydrophobicContact CG2-CG2 4.06Å; I423-V434 HydrophobicContact CG1-CG2 4.27Å; I423-V434 HydrophobicContact CG2-CG2 4.46Å
424	N	98.4	Very high	92	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.2	171.8	79.3	92.9	0	0	0	113.6	I231 E433 L435 R457 L458	I231-N424 HydrophobicContact CG2-CB 3.52Å; N424-E433 PolarHBondContact N-O 3.02Å; N424-E433 WeakPolarHBondContact ND2-CB 3.49Å; N424-E433 PolarHBondContact ND2-O 3.14Å; N424-E433 VanDerWaalsContact ND2-O 3.11Å; N424-E433 PolarHBondContact ND2-OE1 2.62Å; N424-E433 PolarHBondContact O-N 2.84Å; N424-L435 VanDerWaalsContact ND2-CD1 3.31Å; N424-L435 WeakPolarHBondContact ND2-CD1 3.45Å; N424-R457 PolarHBondContact O-NH2 2.75Å; N424-R457 PolarHBondContact OD1-NE 3.06Å; N424-L458 HydrophobicContact CB-CD1 3.58Å; N424-L458 HydrophobicContact CB-CD2 4.27Å; N424-L458 HydrophobicContact CB-CG 4.09Å; N424-L458 WeakPolarHBondContact OD1-CD2 3.28Å
425	W	98.6	Very high	92.9	Very high	9 Å²	9	45.4 Å²	45.4	3%	0.034	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	144.2	171.7	174.6	89.2	0	0	0	109.8	K162 L166 V202 M205 L427 D429	K162-W425 VanDerWaalsContact CE-CZ2 3.41Å; K162-W425 VanDerWaalsContact CE-CZ3 3.46Å; K162-W425 HydrophobicContact CG-CZ3 4.46Å; L166-W425 HydrophobicContact CD1-CB 3.91Å; L166-W425 HydrophobicContact CD1-CD2 3.74Å; L166-W425 HydrophobicContact CD1-CE3 4.06Å; L166-W425 HydrophobicContact CD1-CG 3.66Å; L166-W425 HydrophobicContact CD2-CD2 4.23Å; L166-W425 HydrophobicContact CD2-CG 3.97Å; V202-W425 HydrophobicContact CG1-CZ3 4.32Å; M205-W425 HydrophobicContact CB-CE3 4.19Å; M205-W425 PolarHBondContact N-O 3.45Å; M205-W425 PolarHBondContact O-N 3.38Å; M205-W425 VanDerWaalsContact O-N 3.11Å; W425-L427 HydrophobicContact CH2-CB 3.99Å; W425-L427 HydrophobicContact CH2-CD1 3.87Å; W425-L427 HydrophobicContact CZ2-CD1 4.21Å; W425-D429 PolarHBondContact NE1-O 3.18Å
426	C	98.6	Very high	93.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	163.1	162.4	77.5	0	0	0	0	112.4	V203 A204 A235 R238 F239 G428 D429	V203-C426 CarbonylContact O-C 3.57Å; V203-C426 WeakPolarHBondContact O-CA 3.36Å; V203-C426 WeakPolarHBondContact O-CB 3.44Å; A204-C426 HydrophobicContact CB-CB 4.09Å; A235-C426 HydrophobicContact CB-CB 4.16Å; A235-C426 VanDerWaalsContact O-CB 3.26Å; A235-C426 WeakPolarHBondContact O-CB 3.47Å; R238-C426 PolarHBondContact NH1-SG 2.97Å; R238-C426 VanDerWaalsContact NH1-SG 3.45Å; F239-C426 HydrophobicContact CB-CB 4.01Å; C426-G428 PolarHBondContact O-N 3.05Å; C426-D429 PolarHBondContact N-OD2 3.18Å; C426-D429 VanDerWaalsContact O-CB 3.27Å; C426-D429 WeakPolarHBondContact O-CB 3.11Å; C426-D429 VanDerWaalsContact O-CG 3.3Å; C426-D429 PolarHBondContact O-N 3.04Å
427	L	98.2	Very high	94.6	Very high	59 Å²	59	36 Å²	36	31%	0.309	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	134.7	-174.5	-174.2	61.9	0	0	0	111.3	K201 V203 F239 K242 W425 D429	K201-L427 HydrophobicContact CD-CD2 4.22Å; K201-L427 HydrophobicContact CG-CD2 4.35Å; V203-L427 HydrophobicContact CG1-CD2 4.4Å; V203-L427 PolarHBondContact O-N 3.44Å; F239-L427 HydrophobicContact CD2-CB 3.95Å; F239-L427 HydrophobicContact CE2-CB 4.1Å; F239-L427 HydrophobicContact CE2-CD2 4.12Å; K242-L427 WeakPolarHBondContact CD-O 3.42Å; K242-L427 PolarHBondContact NZ-O 2.79Å; W425-L427 HydrophobicContact CH2-CB 3.99Å; W425-L427 HydrophobicContact CH2-CD1 3.87Å; W425-L427 HydrophobicContact CZ2-CD1 4.21Å; L427-D429 VanDerWaalsContact C-N 3.31Å
428	G	95.1	Very high	95.3	Very high	63 Å²	63	30.8 Å²	30.8	65%	0.649	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	20.6	-170.3	0	0	0	0	0	114.3	K242 C426	K242-G428 PolarHBondContact NZ-O 2.83Å; C426-G428 PolarHBondContact O-N 3.05Å
429	D	96.8	Very high	95.7	Very high	18 Å²	18	35.5 Å²	35.5	10%	0.096	20%	0.195	C	C	.	.			trans	-88.8	136.7	152.2	-66.4	-23.4	0	0	0	107.7	R238 K242 W425 C426 L427 R457	R238-D429 IonicContact CZ-OD1 3Å; R238-D429 IonicContact CZ-OD2 3.7Å; R238-D429 VanDerWaalsContact NH1-CG 3.3Å; R238-D429 IonicContact NH1-OD1 3.82Å; R238-D429 PolarHBondContact NH1-OD1 2.84Å; R238-D429 VanDerWaalsContact NH1-OD1 3.09Å; R238-D429 IonicContact NH1-OD2 3.03Å; R238-D429 PolarHBondContact NH1-OD2 3.38Å; R238-D429 IonicContact NH2-OD1 2.61Å; R238-D429 PolarHBondContact NH2-OD1 2.93Å; R238-D429 IonicContact NH2-OD2 2.62Å; K242-D429 VanDerWaalsContact NZ-N 3.17Å; K242-D429 IonicContact NZ-OD1 2.8Å; K242-D429 PolarHBondContact NZ-OD1 2.61Å; W425-D429 PolarHBondContact NE1-O 3.18Å; C426-D429 PolarHBondContact N-OD2 3.18Å; C426-D429 VanDerWaalsContact O-CB 3.27Å; C426-D429 WeakPolarHBondContact O-CB 3.11Å; C426-D429 VanDerWaalsContact O-CG 3.3Å; C426-D429 PolarHBondContact O-N 3.04Å; L427-D429 VanDerWaalsContact C-N 3.31Å; D429-R457 IonicContact OD2-CZ 3.7Å; D429-R457 IonicContact OD2-NE 3.09Å; D429-R457 IonicContact OD2-NH1 2.72Å; D429-R457 IonicContact OD2-NH2 3.34Å; D429-R457 PolarHBondContact OD2-NH2 2.93Å
430	E	93.9	Very high	96.2	Very high	201 Å²	201	34 Å²	34	94%	0.939	19%	0.186	S	C	*	.	S	Bend	trans	-62.3	-46.9	175.9	-62.2	175.7	158.5	0	0	111
431	D	95.5	Very high	96.3	Very high	40 Å²	40	31.7 Å²	31.7	21%	0.214	18%	0.176	C	C	.	.	S	Bend	trans	-142.1	170.8	-175.8	-141.8	-42.2	0	0	0	112.9	Y170 P447 R457	Y170-D431 WeakPolarHBondContact CE2-OD1 3.38Å; Y170-D431 WeakPolarHBondContact CE2-OD2 3.27Å; Y170-D431 PolarHBondContact OH-OD2 3.16Å; D431-P447 HydrophobicContact CB-CB 4.23Å; D431-R457 VanDerWaalsContact O-CZ 3.31Å; D431-R457 PolarHBondContact O-NH1 3.45Å; D431-R457 PolarHBondContact O-NH2 2.8Å
432	I	97.4	Very high	96.3	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.169	C	C	.	.			trans	-66.1	157.9	173.6	73.4	-176.4	0	0	0	111.9	L166 L167 Y170 F173 I423 V434 P447 S448	L166-I432 HydrophobicContact CB-CG2 3.85Å; L166-I432 HydrophobicContact CD1-CG2 4.39Å; L166-I432 HydrophobicContact CD2-CG2 4.17Å; L166-I432 HydrophobicContact CG-CG2 4.36Å; L167-I432 HydrophobicContact CD2-CD1 3.41Å; L167-I432 VanDerWaalsContact CD2-CD1 3.41Å; L167-I432 HydrophobicContact CD2-CG2 4.43Å; Y170-I432 HydrophobicContact CD2-CD1 4.15Å; F173-I432 HydrophobicContact CD2-CD1 4.14Å; I423-I432 HydrophobicContact CG2-CB 3.75Å; I423-I432 HydrophobicContact CG2-CD1 4.08Å; I423-I432 HydrophobicContact CG2-CG1 4.31Å; I423-I432 HydrophobicContact CG2-CG2 4.06Å; I432-V434 HydrophobicContact CD1-CG2 3.93Å; I432-V434 HydrophobicContact CG1-CG2 4.19Å; I432-P447 HydrophobicContact CD1-CG 3.98Å; I432-P447 HydrophobicContact CG1-CB 4.11Å; I432-P447 HydrophobicContact CG1-CG 3.71Å; I432-S448 WeakPolarHBondContact O-CB 3.3Å; I432-S448 PolarHBondContact O-N 2.65Å
433	E	97.8	Very high	96.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.2	165.6	174.1	-166.3	86.1	0	0	108.2	N424 L435 V442 S446 N450 S456 R457	N424-E433 PolarHBondContact N-O 3.02Å; N424-E433 WeakPolarHBondContact ND2-CB 3.49Å; N424-E433 PolarHBondContact ND2-O 3.14Å; N424-E433 VanDerWaalsContact ND2-O 3.11Å; N424-E433 PolarHBondContact ND2-OE1 2.62Å; N424-E433 PolarHBondContact O-N 2.84Å; E433-L435 HydrophobicContact CG-CD1 4.2Å; E433-V442 HydrophobicContact CG-CG1 4.17Å; E433-V442 HydrophobicContact CG-CG2 3.72Å; E433-S446 WeakPolarHBondContact CA-OG 3.44Å; E433-N450 PolarHBondContact OE2-ND2 3.33Å; E433-S456 VanDerWaalsContact OE1-CA 3.3Å; E433-S456 WeakPolarHBondContact OE1-CA 3.27Å; E433-S456 WeakPolarHBondContact OE1-CB 3.36Å; E433-S456 PolarHBondContact OE1-OG 2.63Å; E433-R457 VanDerWaalsContact N-NH2 3.2Å; E433-R457 WeakPolarHBondContact OE1-CG 3.4Å; E433-R457 PolarHBondContact OE1-N 3.31Å; E433-R457 WeakPolarHBondContact OE2-CB 3.41Å; E433-R457 WeakPolarHBondContact OE2-CD 3.46Å; E433-R457 VanDerWaalsContact OE2-CG 3.32Å; E433-R457 WeakPolarHBondContact OE2-CG 3.3Å; E433-R457 PolarHBondContact OE2-N 3.08Å
434	V	97.7	Very high	95.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.7	-176	-175.2	0	0	0	0	109.5	F173 L421 S422 I423 I432 V442 V443 S446	F173-V434 HydrophobicContact CD1-CG1 4.33Å; F173-V434 HydrophobicContact CD2-CG2 3.89Å; F173-V434 HydrophobicContact CE1-CG1 4.16Å; F173-V434 HydrophobicContact CE2-CG2 3.88Å; F173-V434 HydrophobicContact CG-CG2 4.25Å; F173-V434 HydrophobicContact CZ-CG1 4.46Å; F173-V434 HydrophobicContact CZ-CG2 4.2Å; L421-V434 HydrophobicContact CD2-CG1 4.24Å; S422-V434 CarbonylContact O-C 3.27Å; S422-V434 VanDerWaalsContact O-CA 3.31Å; S422-V434 WeakPolarHBondContact O-CA 3.17Å; I423-V434 HydrophobicContact CG1-CG2 4.27Å; I423-V434 HydrophobicContact CG2-CG2 4.46Å; I432-V434 HydrophobicContact CD1-CG2 3.93Å; I432-V434 HydrophobicContact CG1-CG2 4.19Å; V434-V442 WeakPolarHBondContact O-CA 3.17Å; V434-V442 WeakPolarHBondContact O-CG1 3.35Å; V434-V443 HydrophobicContact CB-CG2 3.84Å; V434-V443 HydrophobicContact CG1-CG2 3.79Å; V434-V443 PolarHBondContact O-N 3.07Å; V434-S446 PolarHBondContact N-OG 2.89Å
435	L	96.8	Very high	95.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.3	-178.5	-67.3	75	0	0	0	111.5	V223 L421 S422 N424 E433 S437 V441	V223-L435 HydrophobicContact CB-CD2 3.77Å; V223-L435 HydrophobicContact CG1-CD2 4.04Å; V223-L435 HydrophobicContact CG2-CD2 3.69Å; L421-L435 CarbonylContact C-O 3.28Å; L421-L435 WeakPolarHBondContact CA-O 3.43Å; S422-L435 PolarHBondContact N-O 2.89Å; S422-L435 PolarHBondContact O-N 3.26Å; N424-L435 VanDerWaalsContact ND2-CD1 3.31Å; N424-L435 WeakPolarHBondContact ND2-CD1 3.45Å; E433-L435 HydrophobicContact CG-CD1 4.2Å; L435-S437 PolarHBondContact O-N 2.64Å; L435-V441 CarbonylContact C-O 3.32Å; L435-V441 WeakPolarHBondContact CA-O 3.25Å; L435-V441 WeakPolarHBondContact CB-O 3.35Å
436	D	95.4	Very high	95.1	Very high	24 Å²	24	42.8 Å²	42.8	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	108.6	157.9	-179.6	-34.6	0	0	0	108	S438 K439 G440 V441 V443	D436-S438 PolarHBondContact O-N 3.23Å; D436-S438 WeakPolarHBondContact OD1-CA 3.43Å; D436-S438 VanDerWaalsContact OD1-CB 3.29Å; D436-S438 WeakPolarHBondContact OD1-CB 3.14Å; D436-S438 PolarHBondContact OD1-N 2.95Å; D436-S438 PolarHBondContact OD1-OG 3.44Å; D436-K439 HydrophobicContact CB-CB 4.22Å; D436-K439 HydrophobicContact CB-CG 4.47Å; D436-K439 PolarHBondContact O-N 2.88Å; D436-K439 PolarHBondContact OD1-N 3.27Å; D436-K439 WeakPolarHBondContact OD2-CD 2.96Å; D436-K439 WeakPolarHBondContact OD2-CE 3.43Å; D436-K439 WeakPolarHBondContact OD2-CG 3.45Å; D436-K439 IonicContact OD2-NZ 2.71Å; D436-K439 PolarHBondContact OD2-NZ 3.4Å; D436-G440 WeakPolarHBondContact O-CA 3.3Å; D436-G440 PolarHBondContact O-N 3.07Å; D436-V441 PolarHBondContact N-O 2.65Å; D436-V443 HydrophobicContact CB-CG1 4.04Å
437	S	94.9	Very high	94.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.1	-178.3	-62	0	0	0	0	113.6	S210 C211 C212 C226 N420 L421 S422 L435	S210-S437 WeakPolarHBondContact OG-CB 3.34Å; C211-S437 CarbonylContact C-O 3.53Å; C211-S437 VanDerWaalsContact C-O 3.27Å; C212-S437 PolarHBondContact N-O 3.04Å; C212-S437 VanDerWaalsContact N-O 3.15Å; C212-S437 PolarHBondContact SG-O 3.26Å; C212-S437 VanDerWaalsContact SG-O 3.36Å; C226-S437 VanDerWaalsContact CB-OG 3.27Å; C226-S437 WeakPolarHBondContact CB-OG 3.45Å; N420-S437 WeakPolarHBondContact O-CB 3.45Å; N420-S437 PolarHBondContact O-N 3.34Å; L421-S437 PolarHBondContact O-OG 3.15Å; L421-S437 VanDerWaalsContact O-OG 3.11Å; S422-S437 WeakPolarHBondContact CB-OG 3.45Å; S422-S437 PolarHBondContact N-OG 2.76Å; S422-S437 PolarHBondContact OG-OG 3.2Å; L435-S437 PolarHBondContact O-N 2.64Å
438	S	92.6	Very high	94.6	Very high	43 Å²	43	43.1 Å²	43.1	30%	0.301	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-34.1	176.9	80.1	0	0	0	0	112.1	C212 D436	C212-S438 WeakPolarHBondContact CA-O 3.32Å; C212-S438 WeakPolarHBondContact CB-O 3.13Å; D436-S438 PolarHBondContact O-N 3.23Å; D436-S438 WeakPolarHBondContact OD1-CA 3.43Å; D436-S438 VanDerWaalsContact OD1-CB 3.29Å; D436-S438 WeakPolarHBondContact OD1-CB 3.14Å; D436-S438 PolarHBondContact OD1-N 2.95Å; D436-S438 PolarHBondContact OD1-OG 3.44Å
439	K	93	Very high	94.1	Very high	124 Å²	124	43.2 Å²	43.2	54%	0.539	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-23.6	-179.7	-59.8	-174.2	-170.9	96.6	0	114.2	M222 D436 V441	M222-K439 WeakPolarHBondContact CG-O 3.34Å; D436-K439 HydrophobicContact CB-CB 4.22Å; D436-K439 HydrophobicContact CB-CG 4.47Å; D436-K439 PolarHBondContact O-N 2.88Å; D436-K439 PolarHBondContact OD1-N 3.27Å; D436-K439 WeakPolarHBondContact OD2-CD 2.96Å; D436-K439 WeakPolarHBondContact OD2-CE 3.43Å; D436-K439 WeakPolarHBondContact OD2-CG 3.45Å; D436-K439 IonicContact OD2-NZ 2.71Å; D436-K439 PolarHBondContact OD2-NZ 3.4Å; K439-V441 HydrophobicContact CB-CG2 3.83Å; K439-V441 HydrophobicContact CD-CG2 4.47Å
440	G	94.6	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	27.9	-178.5	0	0	0	0	0	114.4	C212 V223 D436	C212-G440 VanDerWaalsContact SG-CA 3.51Å; C212-G440 PolarHBondContact SG-N 2.94Å; C212-G440 VanDerWaalsContact SG-N 3.38Å; V223-G440 PolarHBondContact N-O 3.03Å; V223-G440 VanDerWaalsContact O-CA 3.31Å; V223-G440 WeakPolarHBondContact O-CA 3.44Å; D436-G440 WeakPolarHBondContact O-CA 3.3Å; D436-G440 PolarHBondContact O-N 3.07Å
441	V	94.8	Very high	91.6	Very high	44 Å²	44	37.9 Å²	37.9	27%	0.267	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	164.1	-178.3	-61.7	0	0	0	0	110.6	L435 D436 K439	L435-V441 CarbonylContact C-O 3.32Å; L435-V441 WeakPolarHBondContact CA-O 3.25Å; L435-V441 WeakPolarHBondContact CB-O 3.35Å; D436-V441 PolarHBondContact N-O 2.65Å; K439-V441 HydrophobicContact CB-CG2 3.83Å; K439-V441 HydrophobicContact CD-CG2 4.47Å
442	V	96.6	Very high	90.2	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	142.6	179.4	-178.2	0	0	0	0	110.4	E433 V434 V449 F454 S456	E433-V442 HydrophobicContact CG-CG1 4.17Å; E433-V442 HydrophobicContact CG-CG2 3.72Å; V434-V442 WeakPolarHBondContact O-CA 3.17Å; V434-V442 WeakPolarHBondContact O-CG1 3.35Å; V442-V449 HydrophobicContact CG1-CG1 4.42Å; V442-V449 HydrophobicContact CG1-CG2 4.05Å; V442-F454 HydrophobicContact CB-CB 4.29Å; V442-F454 HydrophobicContact CB-CD1 4.5Å; V442-F454 WeakPolarHBondContact CB-O 3.22Å; V442-F454 WeakPolarHBondContact CG2-O 3.49Å; V442-F454 PolarHBondContact N-O 3.22Å; V442-S456 VanDerWaalsContact CG2-CA 3.5Å
443	V	94.6	Very high	89.1	Confident	28 Å²	28	45 Å²	45	17%	0.17	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-78.6	150.4	173.9	-60	0	0	0	0	111.8	L421 V434 D436 S446	L421-V443 HydrophobicContact CD2-CG1 4Å; V434-V443 HydrophobicContact CB-CG2 3.84Å; V434-V443 HydrophobicContact CG1-CG2 3.79Å; V434-V443 PolarHBondContact O-N 3.07Å; D436-V443 HydrophobicContact CB-CG1 4.04Å; V443-S446 VanDerWaalsContact O-CB 3.28Å; V443-S446 WeakPolarHBondContact O-CB 3.39Å; V443-S446 PolarHBondContact O-N 3.19Å; V443-S446 VanDerWaalsContact O-N 3.16Å
444	E	90.1	Very high	88.6	Confident	179 Å²	179	49.2 Å²	49.2	84%	0.836	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	135.2	158.8	-171.6	167.4	-157.5	0	0	109.1	F454	E444-F454 HydrophobicContact CB-CE1 4.48Å
445	G	88.6	Confident	88.4	Confident	61 Å²	61	50.3 Å²	50.3	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	4.2	-171.4	0	0	0	0	0	116
446	S	94.3	Very high	88.3	Confident	8 Å²	8	50.3 Å²	50.3	6%	0.056	30%	0.304	C	S	.	.			trans	-62.9	131.6	168.5	176	0	0	0	0	110.9	E433 V434 V443 S448 V449	E433-S446 WeakPolarHBondContact CA-OG 3.44Å; V434-S446 PolarHBondContact N-OG 2.89Å; V443-S446 VanDerWaalsContact O-CB 3.28Å; V443-S446 WeakPolarHBondContact O-CB 3.39Å; V443-S446 PolarHBondContact O-N 3.19Å; V443-S446 VanDerWaalsContact O-N 3.16Å; S446-S448 PolarHBondContact O-N 2.93Å; S446-S448 PolarHBondContact OG-O 3.24Å; S446-V449 WeakPolarHBondContact O-CG2 3.39Å
447	P	93.8	Very high	88.3	Confident	41 Å²	41	49.7 Å²	49.7	27%	0.266	30%	0.3	S	S	.	.	S	Bend	trans	-58	-42.3	-178.3	-30.3	39.1	0	0	0	114.1	Y170 F173 D431 I432	Y170-P447 HydrophobicContact CD1-CG 3.74Å; Y170-P447 HydrophobicContact CD2-CB 4.41Å; Y170-P447 HydrophobicContact CD2-CG 3.76Å; Y170-P447 HydrophobicContact CE1-CB 4.1Å; Y170-P447 HydrophobicContact CE1-CG 3.63Å; Y170-P447 HydrophobicContact CE2-CB 3.82Å; Y170-P447 HydrophobicContact CE2-CG 3.65Å; Y170-P447 HydrophobicContact CG-CG 3.82Å; F173-P447 HydrophobicContact CE2-CG 4.39Å; D431-P447 HydrophobicContact CB-CB 4.23Å; I432-P447 HydrophobicContact CD1-CG 3.98Å; I432-P447 HydrophobicContact CG1-CB 4.11Å; I432-P447 HydrophobicContact CG1-CG 3.71Å
448	S	91.6	Very high	88.5	Confident	25 Å²	25	49.7 Å²	49.7	18%	0.175	30%	0.3	C	S	.	.	S	Bend	trans	-102.9	129	166.1	-171.4	0	0	0	0	110.2	I432 S446 N450 R457	I432-S448 WeakPolarHBondContact O-CB 3.3Å; I432-S448 PolarHBondContact O-N 2.65Å; S446-S448 PolarHBondContact O-N 2.93Å; S446-S448 PolarHBondContact OG-O 3.24Å; S448-N450 PolarHBondContact OG-ND2 3.11Å; S448-R457 PolarHBondContact OG-NH1 3.38Å
449	V	85.7	Confident	88.6	Confident	65 Å²	65	47.8 Å²	47.8	39%	0.394	29%	0.286	S	S	.	.			trans	-126.8	125	169.2	-175.9	0	0	0	0	108.5	V442 S446 F454	V442-V449 HydrophobicContact CG1-CG1 4.42Å; V442-V449 HydrophobicContact CG1-CG2 4.05Å; S446-V449 WeakPolarHBondContact O-CG2 3.39Å; V449-F454 HydrophobicContact CG1-CD1 4.16Å; V449-F454 HydrophobicContact CG1-CE1 4.44Å
450	N	71.8	Confident	88.9	Confident	64 Å²	64	43.6 Å²	43.6	34%	0.342	27%	0.268	S	S	.	.			trans	-105.9	91.1	-171.6	-70.1	-87.1	0	0	0	111.1	E433 S448 T455 R457	E433-N450 PolarHBondContact OE2-ND2 3.33Å; S448-N450 PolarHBondContact OG-ND2 3.11Å; N450-T455 PolarHBondContact O-OG1 3.01Å; N450-R457 HydrophobicContact CB-CB 4.37Å; N450-R457 WeakPolarHBondContact ND2-CD 3.44Å
451	G	65.8	Low	88.9	Confident	43 Å²	43	46.8 Å²	46.8	44%	0.443	28%	0.28	S	S	.	.	S	Bend	trans	86.5	169.3	-179.5	0	0	0	0	0	114.3	S453	G451-S453 PolarHBondContact O-N 3.09Å
452	P	66	Low	88.9	Confident	133 Å²	133	45.8 Å²	45.8	86%	0.864	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.3	-169.9	31	-37.5	0	0	0	114.6
453	S	75.4	Confident	89	Confident	59 Å²	59	46 Å²	46	41%	0.413	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	12	-169.9	42.6	0	0	0	0	114.1	G451 T455	G451-S453 PolarHBondContact O-N 3.09Å; S453-T455 PolarHBondContact O-N 3.24Å; S453-T455 PolarHBondContact OG-OG1 2.98Å; S453-T455 VanDerWaalsContact OG-OG1 3.14Å
454	F	87.4	Confident	89.2	Confident	88 Å²	88	44.7 Å²	44.7	39%	0.386	27%	0.269	S	S	.	.			trans	50.2	28.5	-173.1	-65.6	-89.4	0	0	0	113.4	V442 E444 V449 S456	V442-F454 HydrophobicContact CB-CB 4.29Å; V442-F454 HydrophobicContact CB-CD1 4.5Å; V442-F454 WeakPolarHBondContact CB-O 3.22Å; V442-F454 WeakPolarHBondContact CG2-O 3.49Å; V442-F454 PolarHBondContact N-O 3.22Å; E444-F454 HydrophobicContact CB-CE1 4.48Å; V449-F454 HydrophobicContact CG1-CD1 4.16Å; V449-F454 HydrophobicContact CG1-CE1 4.44Å; F454-S456 PolarHBondContact O-N 3.03Å
455	T	92.1	Very high	89.5	Confident	22 Å²	22	39.3 Å²	39.3	14%	0.135	25%	0.251	C	S	.	.			trans	-77.4	123.4	179.1	39.7	0	0	0	0	111	M221 N450 S453 R457	M221-T455 HydrophobicContact CB-CG2 3.82Å; M221-T455 HydrophobicContact CE-CG2 3.45Å; M221-T455 VanDerWaalsContact CE-CG2 3.45Å; M221-T455 HydrophobicContact CG-CG2 3.91Å; N450-T455 PolarHBondContact O-OG1 3.01Å; S453-T455 PolarHBondContact O-N 3.24Å; S453-T455 PolarHBondContact OG-OG1 2.98Å; S453-T455 VanDerWaalsContact OG-OG1 3.14Å; T455-R457 PolarHBondContact O-N 3.31Å
456	S	95.7	Very high	89.9	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	23%	0.232	C	C	.	.			trans	-61.4	137.5	176.5	168.3	0	0	0	0	111	E433 V442 F454 L458 C459	E433-S456 VanDerWaalsContact OE1-CA 3.3Å; E433-S456 WeakPolarHBondContact OE1-CA 3.27Å; E433-S456 WeakPolarHBondContact OE1-CB 3.36Å; E433-S456 PolarHBondContact OE1-OG 2.63Å; V442-S456 VanDerWaalsContact CG2-CA 3.5Å; F454-S456 PolarHBondContact O-N 3.03Å; S456-L458 PolarHBondContact O-N 2.83Å; S456-L458 WeakPolarHBondContact OG-CB 3.3Å; S456-L458 PolarHBondContact OG-N 2.71Å; S456-C459 VanDerWaalsContact O-CB 3.28Å; S456-C459 WeakPolarHBondContact O-CB 3.39Å; S456-C459 PolarHBondContact O-N 2.87Å; S456-C459 PolarHBondContact O-SG 3.14Å
457	R	96.1	Very high	90.1	Very high	11 Å²	11	38.7 Å²	38.7	4%	0.042	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-19.7	169.7	67.4	-154.5	-178.4	177.5	1	113.1	R238 N424 D429 D431 E433 S448 N450 T455 A462	R238-R457 VanDerWaalsContact CD-O 3.3Å; R238-R457 WeakPolarHBondContact CD-O 3.35Å; N424-R457 PolarHBondContact O-NH2 2.75Å; N424-R457 PolarHBondContact OD1-NE 3.06Å; D429-R457 IonicContact OD2-CZ 3.7Å; D429-R457 IonicContact OD2-NE 3.09Å; D429-R457 IonicContact OD2-NH1 2.72Å; D429-R457 IonicContact OD2-NH2 3.34Å; D429-R457 PolarHBondContact OD2-NH2 2.93Å; D431-R457 VanDerWaalsContact O-CZ 3.31Å; D431-R457 PolarHBondContact O-NH1 3.45Å; D431-R457 PolarHBondContact O-NH2 2.8Å; E433-R457 VanDerWaalsContact N-NH2 3.2Å; E433-R457 WeakPolarHBondContact OE1-CG 3.4Å; E433-R457 PolarHBondContact OE1-N 3.31Å; E433-R457 WeakPolarHBondContact OE2-CB 3.41Å; E433-R457 WeakPolarHBondContact OE2-CD 3.46Å; E433-R457 VanDerWaalsContact OE2-CG 3.32Å; E433-R457 WeakPolarHBondContact OE2-CG 3.3Å; E433-R457 PolarHBondContact OE2-N 3.08Å; S448-R457 PolarHBondContact OG-NH1 3.38Å; N450-R457 HydrophobicContact CB-CB 4.37Å; N450-R457 WeakPolarHBondContact ND2-CD 3.44Å; T455-R457 PolarHBondContact O-N 3.31Å; R457-A462 VanDerWaalsContact O-CB 3.24Å; R457-A462 WeakPolarHBondContact O-CB 3.3Å
458	L	97.3	Very high	90.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.2	173.4	-54.2	-168.5	0	0	0	114.6	V223 I231 R234 A235 R238 N424 S456 L463	V223-L458 HydrophobicContact CG2-CB 4.47Å; I231-L458 HydrophobicContact CD1-CD1 3.87Å; I231-L458 HydrophobicContact CG2-CD1 3.84Å; R234-L458 HydrophobicContact CB-CB 4.28Å; R234-L458 HydrophobicContact CB-CD1 4.09Å; R234-L458 HydrophobicContact CB-CD2 4.4Å; R234-L458 VanDerWaalsContact NH1-CB 3.34Å; R234-L458 PolarHBondContact NH1-O 3.12Å; R234-L458 PolarHBondContact NH2-O 2.66Å; A235-L458 HydrophobicContact CB-CD2 4.17Å; R238-L458 HydrophobicContact CG-CD2 4.39Å; N424-L458 HydrophobicContact CB-CD1 3.58Å; N424-L458 HydrophobicContact CB-CD2 4.27Å; N424-L458 HydrophobicContact CB-CG 4.09Å; N424-L458 WeakPolarHBondContact OD1-CD2 3.28Å; S456-L458 PolarHBondContact O-N 2.83Å; S456-L458 WeakPolarHBondContact OG-CB 3.3Å; S456-L458 PolarHBondContact OG-N 2.71Å; L458-L463 VanDerWaalsContact O-CD1 3.27Å; L458-L463 WeakPolarHBondContact O-CD1 3.34Å
459	C	96.6	Very high	90.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.02	24%	0.241	C	C	.	.	S	Bend	trans	-57.4	160.6	-172.1	76	0	0	0	0	112.8	M221 V223 S456 R461 A462 L463	M221-C459 WeakPolarHBondContact O-CB 3.48Å; V223-C459 HydrophobicContact CG2-CB 4.33Å; S456-C459 VanDerWaalsContact O-CB 3.28Å; S456-C459 WeakPolarHBondContact O-CB 3.39Å; S456-C459 PolarHBondContact O-N 2.87Å; S456-C459 PolarHBondContact O-SG 3.14Å; C459-R461 PolarHBondContact O-N 2.97Å; C459-A462 PolarHBondContact O-N 3.04Å; C459-A462 VanDerWaalsContact SG-CB 3.5Å; C459-A462 PolarHBondContact SG-N 2.95Å; C459-L463 PolarHBondContact O-N 2.92Å
460	K	97.4	Very high	91.2	Very high	35 Å²	35	40.8 Å²	40.8	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-38.2	-175.4	-59.7	158.6	169.8	-81.5	0	111.1	G220 Y464 Y485 V520 D521 F523	G220-K460 WeakPolarHBondContact O-CA 3.24Å; G220-K460 WeakPolarHBondContact O-CB 3.3Å; G220-K460 PolarHBondContact O-N 3.34Å; K460-Y464 WeakPolarHBondContact O-CB 3.36Å; K460-Y464 PolarHBondContact O-N 2.74Å; K460-Y485 HydrophobicContact CB-CE1 3.87Å; K460-Y485 HydrophobicContact CD-CE1 4.33Å; K460-Y485 HydrophobicContact CG-CE1 4.2Å; K460-V520 HydrophobicContact CD-CG1 4.45Å; K460-V520 VanDerWaalsContact CE-CG1 3.47Å; K460-D521 IonicContact NZ-OD1 2.89Å; K460-D521 PolarHBondContact NZ-OD1 3.06Å; K460-F523 HydrophobicContact CB-CE1 4.19Å; K460-F523 HydrophobicContact CB-CZ 3.62Å; K460-F523 HydrophobicContact CD-CE1 4.11Å; K460-F523 HydrophobicContact CD-CZ 4.37Å
461	R	95.4	Very high	92.4	Very high	68 Å²	68	37.8 Å²	37.8	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-65.6	-45.4	176.3	-174.1	168.9	-74.8	-97.5	-3.1	112.5	S219 G220 C459 Y464 S465 F523 S524 A525	S219-R461 PolarHBondContact O-NE 3.47Å; S219-R461 PolarHBondContact O-NH2 2.8Å; G220-R461 PolarHBondContact O-N 3.11Å; G220-R461 VanDerWaalsContact O-N 3.16Å; C459-R461 PolarHBondContact O-N 2.97Å; R461-Y464 WeakPolarHBondContact O-CA 3.36Å; R461-Y464 WeakPolarHBondContact O-CB 3.47Å; R461-Y464 PolarHBondContact O-N 3.31Å; R461-S465 PolarHBondContact O-N 2.8Å; R461-F523 HydrophobicContact CB-CE2 4.4Å; R461-S524 PolarHBondContact NH1-O 3.4Å; R461-S524 PolarHBondContact NH2-O 3.01Å; R461-A525 PolarHBondContact NH1-O 2.67Å; R461-A525 PolarHBondContact NH1-OXT 3.3Å
462	A	95.6	Very high	93.9	Very high	22 Å²	22	40.4 Å²	40.4	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-38.6	175.1	0	0	0	0	0	112.7	R457 C459 Y464 S465 Y466	R457-A462 VanDerWaalsContact O-CB 3.24Å; R457-A462 WeakPolarHBondContact O-CB 3.3Å; C459-A462 PolarHBondContact O-N 3.04Å; C459-A462 VanDerWaalsContact SG-CB 3.5Å; C459-A462 PolarHBondContact SG-N 2.95Å; A462-Y464 PolarHBondContact O-N 2.89Å; A462-S465 PolarHBondContact O-OG 3.4Å; A462-S465 VanDerWaalsContact O-OG 3.06Å; A462-Y466 VanDerWaalsContact O-CD2 3.3Å; A462-Y466 WeakPolarHBondContact O-CD2 3.45Å; A462-Y466 PolarHBondContact O-N 3.32Å
463	L	97.8	Very high	95.4	Very high	9 Å²	9	38 Å²	38	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-24.8	171	-71.2	172.6	0	0	0	112.8	L237 R238 Y241 L458 C459 F467	L237-L463 HydrophobicContact CB-CD2 4.03Å; R238-L463 HydrophobicContact CG-CD2 3.63Å; Y241-L463 HydrophobicContact CD2-CD2 4.32Å; Y241-L463 HydrophobicContact CE2-CD2 4.14Å; Y241-L463 WeakPolarHBondContact CE2-O 3.34Å; L458-L463 VanDerWaalsContact O-CD1 3.27Å; L458-L463 WeakPolarHBondContact O-CD1 3.34Å; C459-L463 PolarHBondContact O-N 2.92Å; L463-F467 PolarHBondContact O-N 3.43Å
464	Y	97.9	Very high	96.3	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-80.5	-36.8	178.8	-171.8	-142.9	0	0	0	112.5	L351 K460 R461 A462 Y466 F467 Q468 Y485 V488 F523 A525	L351-Y464 HydrophobicContact CD2-CD2 3.95Å; K460-Y464 WeakPolarHBondContact O-CB 3.36Å; K460-Y464 PolarHBondContact O-N 2.74Å; R461-Y464 WeakPolarHBondContact O-CA 3.36Å; R461-Y464 WeakPolarHBondContact O-CB 3.47Å; R461-Y464 PolarHBondContact O-N 3.31Å; A462-Y464 PolarHBondContact O-N 2.89Å; Y464-Y466 VanDerWaalsContact C-N 3.32Å; Y464-Y466 PolarHBondContact O-N 3.33Å; Y464-F467 HydrophobicContact CD2-CB 4.22Å; Y464-F467 AromaticContact CD2-CD1 3.75Å; Y464-F467 HydrophobicContact CD2-CD1 3.75Å; Y464-F467 HydrophobicContact CD2-CG 4.29Å; Y464-F467 AromaticContact CE2-CD1 3.64Å; Y464-F467 HydrophobicContact CE2-CD1 3.64Å; Y464-F467 HydrophobicContact CE2-CE1 4.11Å; Y464-F467 CarbonylContact O-C 3.55Å; Y464-F467 WeakPolarHBondContact O-CA 3.44Å; Y464-F467 WeakPolarHBondContact O-CB 3.3Å; Y464-F467 PolarHBondContact O-N 2.74Å; Y464-F467 VanDerWaalsContact O-N 3.08Å; Y464-Q468 HydrophobicContact CD2-CG 4.19Å; Y464-Q468 HydrophobicContact CE2-CG 3.95Å; Y464-Q468 WeakPolarHBondContact O-CG 3.32Å; Y464-Q468 PolarHBondContact O-N 3.4Å; Y464-Y485 HydrophobicContact CD1-CD2 4.09Å; Y464-Y485 AromaticContact CD2-CD2 3.67Å; Y464-Y485 HydrophobicContact CD2-CD2 3.67Å; Y464-Y485 HydrophobicContact CD2-CE2 4.33Å; Y464-Y485 HydrophobicContact CE2-CD2 4.28Å; Y464-Y485 AromaticContact CG-CD2 3.57Å; Y464-Y485 HydrophobicContact CG-CD2 3.57Å; Y464-Y485 HydrophobicContact CG-CE2 4.25Å; Y464-Y485 HydrophobicContact CG-CG 4.48Å; Y464-V488 HydrophobicContact CE2-CB 4.36Å; Y464-V488 HydrophobicContact CE2-CG1 4.3Å; Y464-V488 HydrophobicContact CE2-CG2 3.98Å; Y464-V488 WeakPolarHBondContact OH-CG2 3.41Å; Y464-F523 HydrophobicContact CD1-CE2 4.48Å; Y464-A525 HydrophobicContact CD1-CB 4.47Å; Y464-A525 HydrophobicContact CE1-CB 4.06Å
465	S	96.9	Very high	96.7	Very high	65 Å²	65	35 Å²	35	46%	0.455	19%	0.193	S	C	.	.	H	α-helix	trans	-65.6	-35	174.4	61.1	0	0	0	0	112.5	R461 A462 R469	R461-S465 PolarHBondContact O-N 2.8Å; A462-S465 PolarHBondContact O-OG 3.4Å; A462-S465 VanDerWaalsContact O-OG 3.06Å; S465-R469 PolarHBondContact O-N 3.36Å; S465-R469 VanDerWaalsContact O-N 3.13Å
466	Y	97.6	Very high	96.8	Very high	57 Å²	57	36.2 Å²	36.2	22%	0.224	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-46.9	166.7	-85.1	-71.9	0	0	0	112	R238 Y241 L245 A462 Y464 R469 V470	R238-Y466 HydrophobicContact CG-CE2 4.37Å; Y241-Y466 HydrophobicContact CD2-CG 4.29Å; Y241-Y466 HydrophobicContact CG-CG 4.28Å; L245-Y466 HydrophobicContact CD1-CD1 4.12Å; L245-Y466 HydrophobicContact CD1-CE1 4.16Å; A462-Y466 VanDerWaalsContact O-CD2 3.3Å; A462-Y466 WeakPolarHBondContact O-CD2 3.45Å; A462-Y466 PolarHBondContact O-N 3.32Å; Y464-Y466 VanDerWaalsContact C-N 3.32Å; Y464-Y466 PolarHBondContact O-N 3.33Å; Y466-R469 PolarHBondContact O-N 2.71Å; Y466-V470 WeakPolarHBondContact O-CG2 3.33Å; Y466-V470 PolarHBondContact O-N 3.5Å
467	F	98.6	Very high	96.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-48.3	176.5	169.8	-88.7	0	0	0	112.2	Y241 L351 H354 F355 L463 Y464 R469 V470 A471 L479 V488	Y241-F467 HydrophobicContact CE1-CB 3.97Å; Y241-F467 HydrophobicContact CE1-CD2 4.48Å; L351-F467 HydrophobicContact CB-CD2 3.66Å; L351-F467 HydrophobicContact CB-CE2 4.14Å; L351-F467 HydrophobicContact CB-CG 4.3Å; L351-F467 HydrophobicContact CD2-CB 3.83Å; L351-F467 HydrophobicContact CD2-CD1 4.31Å; L351-F467 HydrophobicContact CD2-CD2 3.98Å; L351-F467 HydrophobicContact CD2-CG 3.76Å; L351-F467 HydrophobicContact CG-CD2 3.72Å; L351-F467 HydrophobicContact CG-CE2 4.08Å; L351-F467 HydrophobicContact CG-CG 4Å; L351-F467 WeakPolarHBondContact O-CD2 3.29Å; L351-F467 VanDerWaalsContact O-CE2 3.3Å; L351-F467 WeakPolarHBondContact O-CE2 3.32Å; H354-F467 HydrophobicContact CB-CE2 4.23Å; H354-F467 AromaticContact CD2-CE2 3.68Å; H354-F467 AromaticContact CD2-CZ 3.92Å; F355-F467 HydrophobicContact CE1-CE2 4.41Å; F355-F467 AromaticContact CE2-CD2 3.42Å; F355-F467 HydrophobicContact CE2-CD2 3.42Å; F355-F467 VanDerWaalsContact CE2-CD2 3.42Å; F355-F467 AromaticContact CE2-CE2 3.49Å; F355-F467 HydrophobicContact CE2-CE2 3.49Å; F355-F467 VanDerWaalsContact CE2-CE2 3.49Å; F355-F467 HydrophobicContact CE2-CG 4.37Å; F355-F467 HydrophobicContact CE2-CZ 4.47Å; F355-F467 AromaticContact CZ-CD2 3.74Å; F355-F467 HydrophobicContact CZ-CD2 3.74Å; F355-F467 AromaticContact CZ-CE2 3.38Å; F355-F467 HydrophobicContact CZ-CE2 3.38Å; F355-F467 AromaticContact CZ-CZ 3.97Å; F355-F467 HydrophobicContact CZ-CZ 3.97Å; L463-F467 PolarHBondContact O-N 3.43Å; Y464-F467 HydrophobicContact CD2-CB 4.22Å; Y464-F467 AromaticContact CD2-CD1 3.75Å; Y464-F467 HydrophobicContact CD2-CD1 3.75Å; Y464-F467 HydrophobicContact CD2-CG 4.29Å; Y464-F467 AromaticContact CE2-CD1 3.64Å; Y464-F467 HydrophobicContact CE2-CD1 3.64Å; Y464-F467 HydrophobicContact CE2-CE1 4.11Å; Y464-F467 CarbonylContact O-C 3.55Å; Y464-F467 WeakPolarHBondContact O-CA 3.44Å; Y464-F467 WeakPolarHBondContact O-CB 3.3Å; Y464-F467 PolarHBondContact O-N 2.74Å; Y464-F467 VanDerWaalsContact O-N 3.08Å; F467-R469 VanDerWaalsContact C-N 3.34Å; F467-R469 PolarHBondContact O-N 3.02Å; F467-V470 PolarHBondContact O-N 2.8Å; F467-A471 HydrophobicContact CE1-CB 4.24Å; F467-A471 HydrophobicContact CZ-CB 4.43Å; F467-A471 WeakPolarHBondContact O-CB 3.35Å; F467-A471 PolarHBondContact O-N 2.83Å; F467-L479 HydrophobicContact CE1-CB 4.13Å; F467-L479 HydrophobicContact CZ-CB 3.93Å; F467-L479 HydrophobicContact CZ-CD1 3.91Å; F467-L479 HydrophobicContact CZ-CG 4.46Å; F467-V488 HydrophobicContact CD1-CG1 4.09Å; F467-V488 HydrophobicContact CE1-CG1 3.38Å; F467-V488 HydrophobicContact CE1-CG2 4.4Å; F467-V488 HydrophobicContact CE2-CG1 4.07Å; F467-V488 HydrophobicContact CZ-CG1 3.36Å
468	Q	98	Very high	96.9	Very high	35 Å²	35	43.6 Å²	43.6	16%	0.164	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-41.4	-179.1	-69.5	177.1	-69.7	0	0	111.7	Y464 V470 A471 L472 V480 A525	Y464-Q468 HydrophobicContact CD2-CG 4.19Å; Y464-Q468 HydrophobicContact CE2-CG 3.95Å; Y464-Q468 WeakPolarHBondContact O-CG 3.32Å; Y464-Q468 PolarHBondContact O-N 3.4Å; Q468-V470 VanDerWaalsContact C-N 3.34Å; Q468-V470 PolarHBondContact O-N 3.43Å; Q468-A471 PolarHBondContact O-N 3.41Å; Q468-L472 WeakPolarHBondContact O-CG 3.43Å; Q468-L472 PolarHBondContact O-N 2.93Å; Q468-V480 HydrophobicContact CB-CG1 4.37Å; Q468-V480 HydrophobicContact CB-CG2 4.5Å; Q468-V480 HydrophobicContact CG-CG1 4.26Å; Q468-A525 VanDerWaalsContact NE2-CB 3.3Å
469	R	97.9	Very high	96.9	Very high	140 Å²	140	43.6 Å²	43.6	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-41.6	175.4	-175	175.7	170.3	169.2	-5.2	111.8	L245 S465 Y466 F467 L473	L245-R469 HydrophobicContact CD2-CB 4.47Å; L245-R469 HydrophobicContact CD2-CG 3.8Å; S465-R469 PolarHBondContact O-N 3.36Å; S465-R469 VanDerWaalsContact O-N 3.13Å; Y466-R469 PolarHBondContact O-N 2.71Å; F467-R469 VanDerWaalsContact C-N 3.34Å; F467-R469 PolarHBondContact O-N 3.02Å; R469-L473 HydrophobicContact CG-CD1 4.08Å; R469-L473 VanDerWaalsContact O-CG 3.29Å; R469-L473 WeakPolarHBondContact O-CG 3.31Å; R469-L473 PolarHBondContact O-N 3.13Å; R469-L473 VanDerWaalsContact O-N 3.15Å
470	V	98.1	Very high	96.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.7	-38.5	176.6	173.7	0	0	0	0	111.7	Y241 L244 L245 F248 F355 Y466 F467 Q468 L472 L473 G474	Y241-V470 HydrophobicContact CD1-CG2 4.18Å; L244-V470 HydrophobicContact CB-CG1 3.86Å; L244-V470 HydrophobicContact CB-CG2 3.95Å; L244-V470 HydrophobicContact CD1-CG1 4.01Å; L244-V470 HydrophobicContact CG-CG1 4.49Å; L245-V470 HydrophobicContact CD2-CG2 3.79Å; L245-V470 HydrophobicContact CG-CG2 4.1Å; F248-V470 HydrophobicContact CE2-CG1 4.1Å; F355-V470 HydrophobicContact CD1-CG1 4.38Å; F355-V470 HydrophobicContact CD2-CB 4.45Å; F355-V470 HydrophobicContact CD2-CG1 3.57Å; F355-V470 HydrophobicContact CE1-CG1 4.4Å; F355-V470 HydrophobicContact CE2-CB 4.01Å; F355-V470 HydrophobicContact CE2-CG1 3.56Å; F355-V470 HydrophobicContact CG-CG1 4Å; F355-V470 HydrophobicContact CZ-CB 4.43Å; F355-V470 HydrophobicContact CZ-CG1 4Å; Y466-V470 WeakPolarHBondContact O-CG2 3.33Å; Y466-V470 PolarHBondContact O-N 3.5Å; F467-V470 PolarHBondContact O-N 2.8Å; Q468-V470 VanDerWaalsContact C-N 3.34Å; Q468-V470 PolarHBondContact O-N 3.43Å; V470-L472 PolarHBondContact O-N 3.49Å; V470-L473 PolarHBondContact O-N 3.13Å; V470-G474 PolarHBondContact O-N 3.12Å
471	A	97.9	Very high	96.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-47.1	175.7	0	0	0	0	0	111.6	F355 F467 Q468 G474 G475 H476 L479 V480	F355-A471 HydrophobicContact CE1-CB 4.39Å; F355-A471 HydrophobicContact CZ-CB 3.91Å; F467-A471 HydrophobicContact CE1-CB 4.24Å; F467-A471 HydrophobicContact CZ-CB 4.43Å; F467-A471 WeakPolarHBondContact O-CB 3.35Å; F467-A471 PolarHBondContact O-N 2.83Å; Q468-A471 PolarHBondContact O-N 3.41Å; A471-G474 PolarHBondContact O-N 3.22Å; A471-G475 PolarHBondContact O-N 2.97Å; A471-G475 VanDerWaalsContact O-N 3.15Å; A471-H476 HydrophobicContact CB-CB 4.34Å; A471-H476 PolarHBondContact O-N 3.44Å; A471-L479 HydrophobicContact CB-CB 4.49Å; A471-V480 HydrophobicContact CB-CG2 3.63Å
472	L	97.3	Very high	97	Very high	99 Å²	99	49.7 Å²	49.7	52%	0.518	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-45.2	176	-67.5	174.1	0	0	0	112.1	Q468 V470 G474 G475 V480	Q468-L472 WeakPolarHBondContact O-CG 3.43Å; Q468-L472 PolarHBondContact O-N 2.93Å; V470-L472 PolarHBondContact O-N 3.49Å; L472-G474 VanDerWaalsContact C-N 3.33Å; L472-G474 PolarHBondContact O-N 3.06Å; L472-G475 PolarHBondContact O-N 3.1Å; L472-G475 VanDerWaalsContact O-N 3.15Å; L472-V480 HydrophobicContact CD2-CB 4.46Å; L472-V480 HydrophobicContact CD2-CG2 4.01Å; L472-V480 HydrophobicContact CG-CG2 4.08Å
473	L	96.3	Very high	97	Very high	82 Å²	82	53.4 Å²	53.4	43%	0.429	29%	0.29	S	S	.	.	H	α-helix	trans	-66.9	-32.2	179.6	-72	168.9	0	0	0	113.1	L245 F248 R469 V470 G475	L245-L473 HydrophobicContact CD2-CD1 3.63Å; F248-L473 HydrophobicContact CB-CB 3.88Å; F248-L473 HydrophobicContact CB-CD1 4.24Å; F248-L473 HydrophobicContact CB-CG 4.47Å; F248-L473 HydrophobicContact CD1-CB 4.49Å; F248-L473 HydrophobicContact CD2-CB 3.97Å; F248-L473 HydrophobicContact CG-CB 3.87Å; R469-L473 HydrophobicContact CG-CD1 4.08Å; R469-L473 VanDerWaalsContact O-CG 3.29Å; R469-L473 WeakPolarHBondContact O-CG 3.31Å; R469-L473 PolarHBondContact O-N 3.13Å; R469-L473 VanDerWaalsContact O-N 3.15Å; V470-L473 PolarHBondContact O-N 3.13Å; L473-G475 VanDerWaalsContact C-N 3.32Å
474	G	94.4	Very high	97	Very high	27 Å²	27	54.6 Å²	54.6	28%	0.278	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	1.5	172.8	0	0	0	0	0	115	V470 A471 L472 H476	V470-G474 PolarHBondContact O-N 3.12Å; A471-G474 PolarHBondContact O-N 3.22Å; L472-G474 VanDerWaalsContact C-N 3.33Å; L472-G474 PolarHBondContact O-N 3.06Å; G474-H476 VanDerWaalsContact C-N 3.31Å; G474-H476 PolarHBondContact O-CD2 3.39Å; G474-H476 VanDerWaalsContact O-CD2 3.28Å; G474-H476 PolarHBondContact O-N 3.25Å
475	G	95.1	Very high	97	Very high	58 Å²	58	55.4 Å²	55.4	60%	0.598	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	7.2	-179.2	0	0	0	0	0	115.7	A471 L472 L473 S477	A471-G475 PolarHBondContact O-N 2.97Å; A471-G475 VanDerWaalsContact O-N 3.15Å; L472-G475 PolarHBondContact O-N 3.1Å; L472-G475 VanDerWaalsContact O-N 3.15Å; L473-G475 VanDerWaalsContact C-N 3.32Å; G475-S477 PolarHBondContact O-N 3.49Å
476	H	95.6	Very high	97.1	Very high	47 Å²	47	56.4 Å²	56.4	22%	0.218	30%	0.299	C	S	.	.			trans	-83.5	48.2	179.1	-57	-99.7	0	0	0	112.5	F355 A471 G474 Y478 L479	F355-H476 AromaticContact CE1-CD2 3.79Å; A471-H476 HydrophobicContact CB-CB 4.34Å; A471-H476 PolarHBondContact O-N 3.44Å; G474-H476 VanDerWaalsContact C-N 3.31Å; G474-H476 PolarHBondContact O-CD2 3.39Å; G474-H476 VanDerWaalsContact O-CD2 3.28Å; G474-H476 PolarHBondContact O-N 3.25Å; H476-Y478 HydrophobicContact CB-CD1 4.44Å; H476-Y478 HydrophobicContact CB-CE1 3.98Å; H476-Y478 PolarHBondContact O-N 2.88Å; H476-Y478 VanDerWaalsContact O-N 3.15Å; H476-L479 HydrophobicContact CB-CB 4.49Å; H476-L479 HydrophobicContact CB-CD1 3.7Å; H476-L479 HydrophobicContact CB-CG 4.09Å; H476-L479 WeakPolarHBondContact O-CB 3.19Å; H476-L479 PolarHBondContact O-N 3.24Å
477	S	95.6	Very high	97.1	Very high	53 Å²	53	54.8 Å²	54.8	37%	0.371	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.2	-174.6	-56.5	0	0	0	0	113.6	G475 L479 V480 E481	G475-S477 PolarHBondContact O-N 3.49Å; S477-L479 PolarHBondContact O-N 2.99Å; S477-L479 VanDerWaalsContact O-N 3.17Å; S477-V480 WeakPolarHBondContact O-CA 3.42Å; S477-V480 WeakPolarHBondContact O-CB 3.4Å; S477-V480 PolarHBondContact O-N 3.48Å; S477-E481 PolarHBondContact O-N 3Å
478	Y	97.1	Very high	97.1	Very high	114 Å²	114	54.8 Å²	54.8	45%	0.447	30%	0.296	S	S	.	.	H	α-helix	trans	-56.3	-31.5	176.6	75.2	-80.2	0	0	0	113.4	H476 V480 E481 L482 E491	H476-Y478 HydrophobicContact CB-CD1 4.44Å; H476-Y478 HydrophobicContact CB-CE1 3.98Å; H476-Y478 PolarHBondContact O-N 2.88Å; H476-Y478 VanDerWaalsContact O-N 3.15Å; Y478-V480 PolarHBondContact O-N 3.3Å; Y478-E481 PolarHBondContact O-N 2.68Å; Y478-L482 PolarHBondContact O-N 3.5Å; Y478-E491 HydrophobicContact CE2-CG 4.39Å
479	L	97.3	Very high	97.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70.8	-18.1	175.9	-63.2	178.1	0	0	0	113.1	H354 F355 F467 A471 H476 S477 L482 V488 E491	H354-L479 HydrophobicContact CB-CD1 4.06Å; F355-L479 HydrophobicContact CE1-CD1 4.45Å; F467-L479 HydrophobicContact CE1-CB 4.13Å; F467-L479 HydrophobicContact CZ-CB 3.93Å; F467-L479 HydrophobicContact CZ-CD1 3.91Å; F467-L479 HydrophobicContact CZ-CG 4.46Å; A471-L479 HydrophobicContact CB-CB 4.49Å; H476-L479 HydrophobicContact CB-CB 4.49Å; H476-L479 HydrophobicContact CB-CD1 3.7Å; H476-L479 HydrophobicContact CB-CG 4.09Å; H476-L479 WeakPolarHBondContact O-CB 3.19Å; H476-L479 PolarHBondContact O-N 3.24Å; S477-L479 PolarHBondContact O-N 2.99Å; S477-L479 VanDerWaalsContact O-N 3.17Å; L479-L482 HydrophobicContact CD2-CD1 4.13Å; L479-V488 VanDerWaalsContact O-CG2 3.25Å; L479-V488 WeakPolarHBondContact O-CG2 3.44Å; L479-E491 HydrophobicContact CD2-CB 4.26Å; L479-E491 HydrophobicContact CD2-CG 3.64Å
480	V	97	Very high	97	Very high	38 Å²	38	51.9 Å²	51.9	23%	0.23	29%	0.293	C	S	.	.	H	α-helix	trans	-90.9	-27.5	177.9	-171.3	0	0	0	0	111	Q468 A471 L472 S477 Y478 L482	Q468-V480 HydrophobicContact CB-CG1 4.37Å; Q468-V480 HydrophobicContact CB-CG2 4.5Å; Q468-V480 HydrophobicContact CG-CG1 4.26Å; A471-V480 HydrophobicContact CB-CG2 3.63Å; L472-V480 HydrophobicContact CD2-CB 4.46Å; L472-V480 HydrophobicContact CD2-CG2 4.01Å; L472-V480 HydrophobicContact CG-CG2 4.08Å; S477-V480 WeakPolarHBondContact O-CA 3.42Å; S477-V480 WeakPolarHBondContact O-CB 3.4Å; S477-V480 PolarHBondContact O-N 3.48Å; Y478-V480 PolarHBondContact O-N 3.3Å; V480-L482 VanDerWaalsContact C-N 3.31Å
481	E	96.9	Very high	97	Very high	153 Å²	153	56 Å²	56	72%	0.715	31%	0.312	S	S	*	.	H	α-helix	trans	-74.8	-18.6	174.7	-67	164.1	-163.5	0	0	112.9	S477 Y478	S477-E481 PolarHBondContact O-N 3Å; Y478-E481 PolarHBondContact O-N 2.68Å
482	L	97.6	Very high	97	Very high	42 Å²	42	56.3 Å²	56.3	22%	0.22	32%	0.315	C	S	.	.	S	Bend	trans	-60.9	129.1	175.5	-72.5	177.5	0	0	0	111.5	Y478 L479 V480 T484 V488 E491	Y478-L482 PolarHBondContact O-N 3.5Å; L479-L482 HydrophobicContact CD2-CD1 4.13Å; V480-L482 VanDerWaalsContact C-N 3.31Å; L482-T484 VanDerWaalsContact C-N 3.27Å; L482-T484 PolarHBondContact O-N 2.82Å; L482-T484 VanDerWaalsContact O-N 3.08Å; L482-V488 HydrophobicContact CB-CG2 3.8Å; L482-V488 HydrophobicContact CD1-CG2 3.98Å; L482-E491 HydrophobicContact CD1-CB 3.93Å; L482-E491 HydrophobicContact CD1-CG 4.03Å
483	P	96.5	Very high	97.1	Very high	100 Å²	100	55.6 Å²	55.6	65%	0.649	32%	0.315	S	S	*	.	S	Bend	trans	-69.1	-19.5	-161.5	26.1	-36.5	0	0	0	114.9
484	T	97.6	Very high	97.1	Very high	35 Å²	35	55 Å²	55	22%	0.215	31%	0.311	C	S	.	.	S	Bend	trans	-141.8	156.6	-179.2	67.6	0	0	0	0	113.5	L482 H486 S487 V488 F523	L482-T484 VanDerWaalsContact C-N 3.27Å; L482-T484 PolarHBondContact O-N 2.82Å; L482-T484 VanDerWaalsContact O-N 3.08Å; T484-H486 PolarHBondContact O-N 3.48Å; T484-H486 VanDerWaalsContact O-N 3.16Å; T484-H486 PolarHBondContact OG1-N 3.36Å; T484-S487 PolarHBondContact N-OG 3.47Å; T484-S487 PolarHBondContact O-N 3.25Å; T484-S487 VanDerWaalsContact O-N 3.13Å; T484-S487 PolarHBondContact O-OG 2.76Å; T484-S487 PolarHBondContact OG1-N 3.29Å; T484-S487 VanDerWaalsContact OG1-N 3.07Å; T484-S487 PolarHBondContact OG1-OG 2.65Å; T484-V488 PolarHBondContact O-N 3.18Å; T484-F523 CarbonylContact C-O 3.52Å; T484-F523 VanDerWaalsContact CA-O 3.28Å; T484-F523 WeakPolarHBondContact CA-O 3.24Å
485	Y	98.2	Very high	97.3	Very high	18 Å²	18	55 Å²	55	7%	0.071	30%	0.303	C	S	.	.	H	α-helix	trans	-56.9	-22	166.1	178	-106.8	0	0	0	113.4	L351 K460 Y464 K489 D521 F523	L351-Y485 HydrophobicContact CD1-CE2 4.19Å; L351-Y485 HydrophobicContact CD2-CD2 3.91Å; L351-Y485 HydrophobicContact CD2-CE2 3.42Å; L351-Y485 VanDerWaalsContact CD2-CE2 3.42Å; L351-Y485 HydrophobicContact CG-CE2 4.48Å; K460-Y485 HydrophobicContact CB-CE1 3.87Å; K460-Y485 HydrophobicContact CD-CE1 4.33Å; K460-Y485 HydrophobicContact CG-CE1 4.2Å; Y464-Y485 HydrophobicContact CD1-CD2 4.09Å; Y464-Y485 AromaticContact CD2-CD2 3.67Å; Y464-Y485 HydrophobicContact CD2-CD2 3.67Å; Y464-Y485 HydrophobicContact CD2-CE2 4.33Å; Y464-Y485 HydrophobicContact CE2-CD2 4.28Å; Y464-Y485 AromaticContact CG-CD2 3.57Å; Y464-Y485 HydrophobicContact CG-CD2 3.57Å; Y464-Y485 HydrophobicContact CG-CE2 4.25Å; Y464-Y485 HydrophobicContact CG-CG 4.48Å; Y485-K489 HydrophobicContact CE1-CD 4.4Å; Y485-K489 WeakPolarHBondContact O-CG 3.31Å; Y485-K489 WeakPolarHBondContact OH-CE 3.41Å; Y485-K489 PolarHBondContact OH-NZ 3.47Å; Y485-D521 CarbonylContact C-O 3.58Å; Y485-D521 HydrophobicContact CD1-CB 3.81Å; Y485-D521 HydrophobicContact CE1-CB 4.27Å; Y485-D521 VanDerWaalsContact CE1-OD1 3.26Å; Y485-D521 WeakPolarHBondContact CE1-OD1 3.29Å; Y485-F523 AromaticContact CD1-CE1 3.48Å; Y485-F523 HydrophobicContact CD1-CE1 3.48Å; Y485-F523 VanDerWaalsContact CD1-CE1 3.48Å; Y485-F523 HydrophobicContact CD1-CE2 4.05Å; Y485-F523 AromaticContact CD1-CZ 3.18Å; Y485-F523 HydrophobicContact CD1-CZ 3.18Å; Y485-F523 HydrophobicContact CD2-CE2 4.31Å; Y485-F523 HydrophobicContact CD2-CZ 4.07Å; Y485-F523 HydrophobicContact CE1-CE1 4.09Å; Y485-F523 AromaticContact CE1-CZ 3.72Å; Y485-F523 HydrophobicContact CE1-CZ 3.72Å; Y485-F523 HydrophobicContact CG-CE1 4.03Å; Y485-F523 AromaticContact CG-CE2 3.76Å; Y485-F523 HydrophobicContact CG-CE2 3.76Å; Y485-F523 AromaticContact CG-CZ 3.38Å; Y485-F523 HydrophobicContact CG-CZ 3.38Å; Y485-F523 PolarHBondContact N-O 2.65Å
486	H	97.9	Very high	97.4	Very high	86 Å²	86	53.8 Å²	53.8	40%	0.398	28%	0.282	S	S	.	.	H	α-helix	trans	-74.2	-48.7	172	-179.5	48.2	0	0	0	112	T484 V488 K489 V490 D521	T484-H486 PolarHBondContact O-N 3.48Å; T484-H486 VanDerWaalsContact O-N 3.16Å; T484-H486 PolarHBondContact OG1-N 3.36Å; H486-V488 VanDerWaalsContact C-N 3.32Å; H486-V488 PolarHBondContact O-N 3.25Å; H486-K489 WeakPolarHBondContact O-CA 3.5Å; H486-K489 WeakPolarHBondContact O-CB 3.48Å; H486-K489 PolarHBondContact O-N 3.38Å; H486-V490 PolarHBondContact O-N 2.89Å; H486-D521 HydrophobicContact CB-CB 3.96Å; H486-D521 WeakPolarHBondContact CB-O 3.48Å; H486-D521 PolarHBondContact N-O 3.17Å
487	S	97.9	Very high	97.5	Very high	23 Å²	23	55.3 Å²	55.3	16%	0.161	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-45	176.8	27.9	0	0	0	0	111.8	T484 K489 V490 E491	T484-S487 PolarHBondContact N-OG 3.47Å; T484-S487 PolarHBondContact O-N 3.25Å; T484-S487 VanDerWaalsContact O-N 3.13Å; T484-S487 PolarHBondContact O-OG 2.76Å; T484-S487 PolarHBondContact OG1-N 3.29Å; T484-S487 VanDerWaalsContact OG1-N 3.07Å; T484-S487 PolarHBondContact OG1-OG 2.65Å; S487-K489 PolarHBondContact O-N 2.98Å; S487-K489 VanDerWaalsContact O-N 3.16Å; S487-V490 PolarHBondContact O-N 3.08Å; S487-E491 PolarHBondContact O-N 2.79Å
488	V	98.2	Very high	97.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.3	-30.2	175.6	174.6	0	0	0	0	113.2	L351 H354 Y464 F467 L479 L482 T484 H486	L351-V488 HydrophobicContact CD1-CG1 4.04Å; L351-V488 HydrophobicContact CG-CG1 3.89Å; H354-V488 PolarHBondContact NE2-O 3.3Å; Y464-V488 HydrophobicContact CE2-CB 4.36Å; Y464-V488 HydrophobicContact CE2-CG1 4.3Å; Y464-V488 HydrophobicContact CE2-CG2 3.98Å; Y464-V488 WeakPolarHBondContact OH-CG2 3.41Å; F467-V488 HydrophobicContact CD1-CG1 4.09Å; F467-V488 HydrophobicContact CE1-CG1 3.38Å; F467-V488 HydrophobicContact CE1-CG2 4.4Å; F467-V488 HydrophobicContact CE2-CG1 4.07Å; F467-V488 HydrophobicContact CZ-CG1 3.36Å; L479-V488 VanDerWaalsContact O-CG2 3.25Å; L479-V488 WeakPolarHBondContact O-CG2 3.44Å; L482-V488 HydrophobicContact CB-CG2 3.8Å; L482-V488 HydrophobicContact CD1-CG2 3.98Å; T484-V488 PolarHBondContact O-N 3.18Å; H486-V488 VanDerWaalsContact C-N 3.32Å; H486-V488 PolarHBondContact O-N 3.25Å
489	K	98	Very high	97.7	Very high	36 Å²	36	50 Å²	50	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-76.3	-40.3	173.6	-72.9	179.4	-178.2	-174.3	0	112.9	A350 L351 Y485 H486 S487 E491 A492 Q496 D521	A350-K489 HydrophobicContact CB-CB 4.29Å; A350-K489 HydrophobicContact CB-CG 4.07Å; L351-K489 HydrophobicContact CD1-CB 4.48Å; L351-K489 HydrophobicContact CD1-CD 4.29Å; L351-K489 HydrophobicContact CD1-CG 3.34Å; Y485-K489 HydrophobicContact CE1-CD 4.4Å; Y485-K489 WeakPolarHBondContact O-CG 3.31Å; Y485-K489 WeakPolarHBondContact OH-CE 3.41Å; Y485-K489 PolarHBondContact OH-NZ 3.47Å; H486-K489 WeakPolarHBondContact O-CA 3.5Å; H486-K489 WeakPolarHBondContact O-CB 3.48Å; H486-K489 PolarHBondContact O-N 3.38Å; S487-K489 PolarHBondContact O-N 2.98Å; S487-K489 VanDerWaalsContact O-N 3.16Å; K489-E491 VanDerWaalsContact C-N 3.25Å; K489-A492 WeakPolarHBondContact O-CB 3.42Å; K489-A492 PolarHBondContact O-N 3.17Å; K489-Q496 PolarHBondContact O-NE2 2.96Å; K489-D521 WeakPolarHBondContact CD-OD2 3.32Å; K489-D521 IonicContact NZ-OD1 2.65Å; K489-D521 PolarHBondContact NZ-OD1 3.18Å; K489-D521 IonicContact NZ-OD2 3.43Å; K489-D521 PolarHBondContact NZ-OD2 2.9Å
490	V	97.6	Very high	97.7	Very high	78 Å²	78	52.8 Å²	52.8	47%	0.473	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-39	178.6	175.6	0	0	0	0	109.8	H486 S487 A492 T493	H486-V490 PolarHBondContact O-N 2.89Å; S487-V490 PolarHBondContact O-N 3.08Å; V490-A492 PolarHBondContact O-N 2.97Å; V490-A492 VanDerWaalsContact O-N 3.16Å; V490-T493 PolarHBondContact O-N 3.08Å
491	E	98.2	Very high	97.7	Very high	86 Å²	86	52.8 Å²	52.8	40%	0.402	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.8	175.7	-158.5	59.1	-151.4	0	0	113.9	H354 Y478 L479 L482 S487 K489 T493	H354-E491 VanDerWaalsContact CE1-C 3.49Å; Y478-E491 HydrophobicContact CE2-CG 4.39Å; L479-E491 HydrophobicContact CD2-CB 4.26Å; L479-E491 HydrophobicContact CD2-CG 3.64Å; L482-E491 HydrophobicContact CD1-CB 3.93Å; L482-E491 HydrophobicContact CD1-CG 4.03Å; S487-E491 PolarHBondContact O-N 2.79Å; K489-E491 VanDerWaalsContact C-N 3.25Å; E491-T493 PolarHBondContact O-N 2.86Å
492	A	97.9	Very high	97.7	Very high	7 Å²	7	45.8 Å²	45.8	6%	0.058	25%	0.248	C	C	.	.			trans	-76.6	60.3	169.3	0	0	0	0	0	110.4	A350 H354 K489 V490 I494 Y495 Q496	A350-A492 HydrophobicContact CB-CB 4.15Å; A350-A492 WeakPolarHBondContact O-CB 3.27Å; H354-A492 PolarHBondContact CE1-N 2.7Å; K489-A492 WeakPolarHBondContact O-CB 3.42Å; K489-A492 PolarHBondContact O-N 3.17Å; V490-A492 PolarHBondContact O-N 2.97Å; V490-A492 VanDerWaalsContact O-N 3.16Å; A492-I494 PolarHBondContact O-N 3.5Å; A492-Y495 WeakPolarHBondContact O-CB 3.3Å; A492-Y495 PolarHBondContact O-N 3Å; A492-Q496 PolarHBondContact O-N 3.04Å
493	T	97.3	Very high	97.6	Very high	85 Å²	85	46.5 Å²	46.5	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-53.7	-52.2	-167.3	53.7	0	0	0	0	112.5	V490 E491 Y495 Q496 T497	V490-T493 PolarHBondContact O-N 3.08Å; E491-T493 PolarHBondContact O-N 2.86Å; T493-Y495 VanDerWaalsContact C-N 3.27Å; T493-Y495 PolarHBondContact O-N 3.14Å; T493-Q496 PolarHBondContact O-N 3.01Å; T493-T497 PolarHBondContact O-N 3.46Å; T493-T497 PolarHBondContact O-OG1 2.83Å
494	I	97.1	Very high	97.5	Very high	68 Å²	68	47.5 Å²	47.5	35%	0.349	25%	0.245	S	C	.	.	H	α-helix	trans	-55.4	-42	178.5	-52.7	180	0	0	0	111.3	P393 Y396 A492 T497 V498	P393-I494 HydrophobicContact CB-CG2 3.68Å; P393-I494 HydrophobicContact CG-CG2 3.77Å; Y396-I494 HydrophobicContact CD2-CG2 4.04Å; Y396-I494 HydrophobicContact CE2-CG2 3.66Å; A492-I494 PolarHBondContact O-N 3.5Å; I494-T497 PolarHBondContact O-N 2.82Å; I494-V498 WeakPolarHBondContact O-CG2 3.01Å; I494-V498 PolarHBondContact O-N 2.86Å; I494-V498 VanDerWaalsContact O-N 3.1Å
495	Y	98.2	Very high	97.4	Very high	28 Å²	28	49.3 Å²	49.3	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-40.9	176.4	-179.8	-78.2	0	0	0	111.7	I345 G349 A350 S353 Y396 A492 T493 K499	I345-Y495 HydrophobicContact CD1-CD1 4.04Å; I345-Y495 HydrophobicContact CD1-CD2 4.06Å; I345-Y495 HydrophobicContact CD1-CE1 3.55Å; I345-Y495 HydrophobicContact CD1-CE2 3.59Å; I345-Y495 HydrophobicContact CD1-CG 4.26Å; I345-Y495 HydrophobicContact CG1-CD2 3.9Å; I345-Y495 HydrophobicContact CG1-CE1 4.4Å; I345-Y495 HydrophobicContact CG1-CE2 3.53Å; I345-Y495 HydrophobicContact CG1-CG 4.48Å; G349-Y495 VanDerWaalsContact C-CE2 3.47Å; A350-Y495 HydrophobicContact CB-CD1 3.57Å; A350-Y495 HydrophobicContact CB-CE1 3.74Å; A350-Y495 HydrophobicContact CB-CG 4.06Å; A350-Y495 VanDerWaalsContact N-CE2 3.33Å; A350-Y495 VanDerWaalsContact N-CZ 3.35Å; S353-Y495 WeakPolarHBondContact OG-CD2 3.49Å; Y396-Y495 WeakPolarHBondContact OH-CD2 3.44Å; A492-Y495 WeakPolarHBondContact O-CB 3.3Å; A492-Y495 PolarHBondContact O-N 3Å; T493-Y495 VanDerWaalsContact C-N 3.27Å; T493-Y495 PolarHBondContact O-N 3.14Å; Y495-K499 HydrophobicContact CE1-CD 4.3Å; Y495-K499 VanDerWaalsContact O-CB 3.26Å; Y495-K499 WeakPolarHBondContact O-CB 3.46Å; Y495-K499 PolarHBondContact O-N 3.14Å
496	Q	98.1	Very high	97.1	Very high	33 Å²	33	48.4 Å²	48.4	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-68.2	-35.7	176.2	-55.5	-49.6	-42.6	0	0	111.8	K489 A492 T493 K499 D500	K489-Q496 PolarHBondContact O-NE2 2.96Å; A492-Q496 PolarHBondContact O-N 3.04Å; T493-Q496 PolarHBondContact O-N 3.01Å; Q496-K499 WeakPolarHBondContact O-CB 3.29Å; Q496-K499 PolarHBondContact O-N 3.01Å; Q496-D500 VanDerWaalsContact O-CB 3.31Å; Q496-D500 WeakPolarHBondContact O-CB 3.05Å; Q496-D500 VanDerWaalsContact O-CG 3.27Å; Q496-D500 PolarHBondContact O-N 2.66Å
497	T	97.7	Very high	96.9	Very high	78 Å²	78	49 Å²	49	48%	0.479	25%	0.25	S	S	.	.	H	α-helix	trans	-59.2	-51.4	173.8	-57.4	0	0	0	0	111.3	T493 I494 K499 D500 L501	T493-T497 PolarHBondContact O-N 3.46Å; T493-T497 PolarHBondContact O-OG1 2.83Å; I494-T497 PolarHBondContact O-N 2.82Å; T497-K499 VanDerWaalsContact C-N 3.34Å; T497-K499 PolarHBondContact O-N 3.35Å; T497-D500 PolarHBondContact O-N 3.24Å; T497-D500 VanDerWaalsContact O-N 3.11Å; T497-L501 HydrophobicContact CG2-CD1 4.48Å; T497-L501 WeakPolarHBondContact O-CG 3.34Å; T497-L501 PolarHBondContact O-N 2.77Å
498	V	98.1	Very high	96.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-40.9	178.1	175.2	0	0	0	0	111.8	V344 I345 L392 P393 Y396 I494 D500 I502	V344-V498 HydrophobicContact CG1-CG1 3.95Å; I345-V498 HydrophobicContact CB-CG1 4.28Å; I345-V498 HydrophobicContact CG1-CB 4.4Å; I345-V498 HydrophobicContact CG1-CG1 3.94Å; L392-V498 HydrophobicContact CD2-CG1 3.9Å; L392-V498 HydrophobicContact CD2-CG2 4.09Å; P393-V498 HydrophobicContact CG-CG2 3.94Å; Y396-V498 HydrophobicContact CD1-CB 4.22Å; Y396-V498 HydrophobicContact CD1-CG1 3.87Å; Y396-V498 HydrophobicContact CD1-CG2 3.95Å; Y396-V498 HydrophobicContact CD2-CG2 4.01Å; Y396-V498 HydrophobicContact CE1-CB 4.38Å; Y396-V498 HydrophobicContact CE1-CG1 4.32Å; Y396-V498 HydrophobicContact CE1-CG2 4.34Å; Y396-V498 HydrophobicContact CE2-CG2 4.42Å; Y396-V498 HydrophobicContact CG-CG1 4.4Å; Y396-V498 HydrophobicContact CG-CG2 3.77Å; I494-V498 WeakPolarHBondContact O-CG2 3.01Å; I494-V498 PolarHBondContact O-N 2.86Å; I494-V498 VanDerWaalsContact O-N 3.1Å; V498-D500 VanDerWaalsContact C-N 3.28Å; V498-D500 PolarHBondContact O-N 2.79Å; V498-I502 HydrophobicContact CG1-CD1 4.19Å; V498-I502 VanDerWaalsContact O-CG1 3.32Å; V498-I502 WeakPolarHBondContact O-CG1 3.08Å; V498-I502 PolarHBondContact O-N 3.16Å; V498-I502 VanDerWaalsContact O-N 3.09Å
499	K	97.7	Very high	96.2	Very high	56 Å²	56	53.2 Å²	53.2	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-39.2	173.8	-173.7	-168.6	174	-160	0	112.6	I345 Y495 Q496 T497 I502 K503	I345-K499 HydrophobicContact CD1-CB 3.5Å; I345-K499 HydrophobicContact CD1-CG 4.11Å; Y495-K499 HydrophobicContact CE1-CD 4.3Å; Y495-K499 VanDerWaalsContact O-CB 3.26Å; Y495-K499 WeakPolarHBondContact O-CB 3.46Å; Y495-K499 PolarHBondContact O-N 3.14Å; Q496-K499 WeakPolarHBondContact O-CB 3.29Å; Q496-K499 PolarHBondContact O-N 3.01Å; T497-K499 VanDerWaalsContact C-N 3.34Å; T497-K499 PolarHBondContact O-N 3.35Å; K499-I502 WeakPolarHBondContact O-CB 3.45Å; K499-I502 PolarHBondContact O-N 2.91Å; K499-K503 WeakPolarHBondContact O-CG 3.49Å; K499-K503 PolarHBondContact O-N 2.8Å
500	D	97.3	Very high	95.8	Very high	58 Å²	58	57.5 Å²	57.5	31%	0.31	30%	0.297	S	S	.	.	H	α-helix	trans	-82.7	-30.4	-173.1	-73.5	17.3	0	0	0	111.5	Q496 T497 V498 I502 K503 Q504	Q496-D500 VanDerWaalsContact O-CB 3.31Å; Q496-D500 WeakPolarHBondContact O-CB 3.05Å; Q496-D500 VanDerWaalsContact O-CG 3.27Å; Q496-D500 PolarHBondContact O-N 2.66Å; T497-D500 PolarHBondContact O-N 3.24Å; T497-D500 VanDerWaalsContact O-N 3.11Å; V498-D500 VanDerWaalsContact C-N 3.28Å; V498-D500 PolarHBondContact O-N 2.79Å; D500-I502 VanDerWaalsContact C-N 3.33Å; D500-K503 HydrophobicContact CB-CD 4.46Å; D500-K503 WeakPolarHBondContact O-CB 3.4Å; D500-K503 PolarHBondContact O-N 2.82Å; D500-K503 WeakPolarHBondContact OD1-CE 3.34Å; D500-K503 IonicContact OD1-NZ 3.3Å; D500-K503 PolarHBondContact OD1-NZ 2.95Å; D500-K503 IonicContact OD2-NZ 3.32Å; D500-K503 PolarHBondContact OD2-NZ 3.39Å; D500-Q504 WeakPolarHBondContact O-CG 3.28Å; D500-Q504 PolarHBondContact O-N 2.82Å
501	L	97.1	Very high	95.4	Very high	39 Å²	39	53.9 Å²	53.9	20%	0.204	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-44.2	161.7	-68.7	168.2	0	0	0	111.6	W388 I391 L392 T497 K503 Q504 R505	W388-L501 HydrophobicContact CZ3-CB 4.08Å; I391-L501 HydrophobicContact CG2-CD1 4.08Å; I391-L501 HydrophobicContact CG2-CD2 4.09Å; L392-L501 HydrophobicContact CD2-CD1 4.49Å; T497-L501 HydrophobicContact CG2-CD1 4.48Å; T497-L501 WeakPolarHBondContact O-CG 3.34Å; T497-L501 PolarHBondContact O-N 2.77Å; L501-K503 PolarHBondContact O-N 3.1Å; L501-Q504 PolarHBondContact O-N 3.02Å; L501-R505 WeakPolarHBondContact O-CB 3.48Å; L501-R505 PolarHBondContact O-N 2.87Å
502	I	96.8	Very high	95.1	Very high	6 Å²	6	50.5 Å²	50.5	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-40.7	175.2	-67.7	163.7	0	0	0	111.6	V344 I345 L384 W388 V498 K499 D500 R505 F506	V344-I502 HydrophobicContact CB-CD1 3.82Å; V344-I502 HydrophobicContact CB-CG1 4.24Å; V344-I502 HydrophobicContact CG1-CD1 3.83Å; V344-I502 HydrophobicContact CG1-CG1 4.05Å; I345-I502 HydrophobicContact CB-CD1 3.81Å; I345-I502 HydrophobicContact CD1-CD1 4.48Å; I345-I502 HydrophobicContact CG1-CD1 4.49Å; L384-I502 HydrophobicContact CD1-CG1 4.4Å; L384-I502 HydrophobicContact CD1-CG2 4.27Å; L384-I502 HydrophobicContact CD2-CG2 4.16Å; W388-I502 HydrophobicContact CH2-CG1 4.11Å; V498-I502 HydrophobicContact CG1-CD1 4.19Å; V498-I502 VanDerWaalsContact O-CG1 3.32Å; V498-I502 WeakPolarHBondContact O-CG1 3.08Å; V498-I502 PolarHBondContact O-N 3.16Å; V498-I502 VanDerWaalsContact O-N 3.09Å; K499-I502 WeakPolarHBondContact O-CB 3.45Å; K499-I502 PolarHBondContact O-N 2.91Å; D500-I502 VanDerWaalsContact C-N 3.33Å; I502-R505 PolarHBondContact O-N 3.45Å; I502-F506 HydrophobicContact CG2-CD2 3.97Å; I502-F506 HydrophobicContact CG2-CE2 3.55Å; I502-F506 HydrophobicContact CG2-CZ 4.37Å; I502-F506 VanDerWaalsContact O-CD2 3.29Å; I502-F506 WeakPolarHBondContact O-CD2 3.35Å; I502-F506 PolarHBondContact O-N 2.66Å; I502-F506 VanDerWaalsContact O-N 3.08Å
503	K	96.1	Very high	94.8	Very high	56 Å²	56	52.6 Å²	52.6	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-47.2	173.2	-62.3	174.7	-172.1	159.1	0	111.3	K499 D500 L501 R505 F506 L507 W514	K499-K503 WeakPolarHBondContact O-CG 3.49Å; K499-K503 PolarHBondContact O-N 2.8Å; D500-K503 HydrophobicContact CB-CD 4.46Å; D500-K503 WeakPolarHBondContact O-CB 3.4Å; D500-K503 PolarHBondContact O-N 2.82Å; D500-K503 WeakPolarHBondContact OD1-CE 3.34Å; D500-K503 IonicContact OD1-NZ 3.3Å; D500-K503 PolarHBondContact OD1-NZ 2.95Å; D500-K503 IonicContact OD2-NZ 3.32Å; D500-K503 PolarHBondContact OD2-NZ 3.39Å; L501-K503 PolarHBondContact O-N 3.1Å; K503-R505 VanDerWaalsContact C-N 3.31Å; K503-R505 PolarHBondContact O-N 2.91Å; K503-F506 PolarHBondContact O-N 3.41Å; K503-L507 WeakPolarHBondContact O-CG 3.38Å; K503-L507 PolarHBondContact O-N 2.95Å; K503-W514 HydrophobicContact CG-CB 4.23Å
504	Q	95.3	Very high	94.6	Very high	121 Å²	121	51 Å²	51	57%	0.565	26%	0.261	S	S	*	.	H	α-helix	trans	-60.5	-41.9	179.2	-73.1	169.7	-11.8	0	0	110.9	D500 L501 F506 L507 S508	D500-Q504 WeakPolarHBondContact O-CG 3.28Å; D500-Q504 PolarHBondContact O-N 2.82Å; L501-Q504 PolarHBondContact O-N 3.02Å; Q504-F506 PolarHBondContact O-N 3.32Å; Q504-L507 WeakPolarHBondContact O-CA 3.48Å; Q504-L507 WeakPolarHBondContact O-CB 3.43Å; Q504-L507 PolarHBondContact O-N 3.34Å; Q504-S508 PolarHBondContact O-N 2.79Å
505	R	94.2	Very high	94.1	Very high	73 Å²	73	50.6 Å²	50.6	28%	0.275	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-36.9	177	-163.8	65.5	146.3	-170.2	-11.9	113.4	L384 D386 W388 L501 I502 K503 L507 S508 N509	L384-R505 HydrophobicContact CD2-CB 4.05Å; L384-R505 HydrophobicContact CD2-CG 3.97Å; L384-R505 WeakPolarHBondContact O-CG 3.39Å; L384-R505 PolarHBondContact O-NE 3.47Å; D386-R505 PolarHBondContact O-NH2 3.23Å; W388-R505 HydrophobicContact CH2-CB 4.11Å; W388-R505 HydrophobicContact CH2-CG 4.28Å; W388-R505 HydrophobicContact CZ2-CB 4.25Å; W388-R505 HydrophobicContact CZ2-CG 3.92Å; L501-R505 WeakPolarHBondContact O-CB 3.48Å; L501-R505 PolarHBondContact O-N 2.87Å; I502-R505 PolarHBondContact O-N 3.45Å; K503-R505 VanDerWaalsContact C-N 3.31Å; K503-R505 PolarHBondContact O-N 2.91Å; R505-L507 VanDerWaalsContact C-N 3.28Å; R505-L507 PolarHBondContact O-N 2.86Å; R505-S508 WeakPolarHBondContact CA-OG 3.46Å; R505-S508 PolarHBondContact O-OG 2.83Å; R505-N509 WeakPolarHBondContact O-CB 3.43Å; R505-N509 PolarHBondContact O-N 3.26Å; R505-N509 PolarHBondContact O-OD1 3.07Å
506	F	93.6	Very high	93.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.4	-28.1	171.7	-73.4	-52.9	0	0	0	113.2	L307 L384 I502 K503 Q504 A511 G512 W514	L307-F506 HydrophobicContact CD1-CB 4.36Å; L307-F506 HydrophobicContact CD1-CD2 4.36Å; L307-F506 HydrophobicContact CD1-CG 4.26Å; L307-F506 HydrophobicContact CD2-CD1 3.99Å; L307-F506 HydrophobicContact CD2-CD2 4.43Å; L307-F506 HydrophobicContact CD2-CE1 3.91Å; L307-F506 HydrophobicContact CD2-CE2 4.34Å; L307-F506 HydrophobicContact CD2-CG 4.26Å; L307-F506 HydrophobicContact CD2-CZ 4.09Å; L384-F506 HydrophobicContact CD2-CD1 4.11Å; L384-F506 HydrophobicContact CD2-CD2 4.5Å; L384-F506 HydrophobicContact CD2-CE1 3.76Å; L384-F506 HydrophobicContact CD2-CE2 4.19Å; L384-F506 HydrophobicContact CD2-CG 4.46Å; L384-F506 HydrophobicContact CD2-CZ 3.81Å; L384-F506 HydrophobicContact CG-CE1 4.38Å; L384-F506 HydrophobicContact CG-CZ 4.35Å; I502-F506 HydrophobicContact CG2-CD2 3.97Å; I502-F506 HydrophobicContact CG2-CE2 3.55Å; I502-F506 HydrophobicContact CG2-CZ 4.37Å; I502-F506 VanDerWaalsContact O-CD2 3.29Å; I502-F506 WeakPolarHBondContact O-CD2 3.35Å; I502-F506 PolarHBondContact O-N 2.66Å; I502-F506 VanDerWaalsContact O-N 3.08Å; K503-F506 PolarHBondContact O-N 3.41Å; Q504-F506 PolarHBondContact O-N 3.32Å; F506-A511 HydrophobicContact CB-CB 4.25Å; F506-A511 HydrophobicContact CD1-CB 3.92Å; F506-A511 WeakPolarHBondContact O-CB 3.19Å; F506-A511 PolarHBondContact O-N 3.18Å; F506-G512 PolarHBondContact O-N 3.19Å; F506-W514 HydrophobicContact CD2-CB 4.4Å; F506-W514 HydrophobicContact CD2-CE3 4.17Å; F506-W514 AromaticContact CE2-CE3 3.69Å; F506-W514 HydrophobicContact CE2-CE3 3.69Å; F506-W514 HydrophobicContact CE2-CZ3 4.14Å; F506-W514 HydrophobicContact CZ-CE3 4.46Å
507	L	93.3	Very high	93	Very high	99 Å²	99	52.6 Å²	52.6	52%	0.518	28%	0.276	S	S	.	.	H	α-helix	trans	-75.6	-47.2	173.6	-66.2	171.8	0	0	0	111.6	K503 Q504 R505 N509 Q510 P513	K503-L507 WeakPolarHBondContact O-CG 3.38Å; K503-L507 PolarHBondContact O-N 2.95Å; Q504-L507 WeakPolarHBondContact O-CA 3.48Å; Q504-L507 WeakPolarHBondContact O-CB 3.43Å; Q504-L507 PolarHBondContact O-N 3.34Å; R505-L507 VanDerWaalsContact C-N 3.28Å; R505-L507 PolarHBondContact O-N 2.86Å; L507-N509 VanDerWaalsContact C-N 3.29Å; L507-N509 PolarHBondContact O-N 3.24Å; L507-Q510 PolarHBondContact O-N 3.27Å; L507-P513 HydrophobicContact CD2-CB 4.21Å
508	S	91.6	Very high	92.4	Very high	76 Å²	76	57.3 Å²	57.3	53%	0.531	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-40.5	176	64.5	0	0	0	0	111.9	Q504 R505 Q510	Q504-S508 PolarHBondContact O-N 2.79Å; R505-S508 WeakPolarHBondContact CA-OG 3.46Å; R505-S508 PolarHBondContact O-OG 2.83Å; S508-Q510 PolarHBondContact O-N 2.97Å
509	N	89.5	Confident	92.1	Very high	35 Å²	35	62.7 Å²	62.7	19%	0.187	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	15.8	-179.9	-58.2	10	0	0	0	111.9	R383 R505 L507 A511	R383-N509 PolarHBondContact O-ND2 2.79Å; R505-N509 WeakPolarHBondContact O-CB 3.43Å; R505-N509 PolarHBondContact O-N 3.26Å; R505-N509 PolarHBondContact O-OD1 3.07Å; L507-N509 VanDerWaalsContact C-N 3.29Å; L507-N509 PolarHBondContact O-N 3.24Å; N509-A511 PolarHBondContact O-N 3.42Å
510	Q	89.2	Confident	91.8	Very high	125 Å²	125	60 Å²	60	58%	0.584	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	13.5	178.7	-54.5	-169.4	18.4	0	0	116.7	K306 L507 S508 G512	K306-Q510 WeakPolarHBondContact CD-O 3.37Å; K306-Q510 WeakPolarHBondContact CE-O 3.49Å; K306-Q510 PolarHBondContact NZ-O 3.12Å; L507-Q510 PolarHBondContact O-N 3.27Å; S508-Q510 PolarHBondContact O-N 2.97Å; Q510-G512 PolarHBondContact O-N 3.33Å
511	A	89.5	Confident	91.8	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.017	30%	0.3	C	S	.	.			trans	-68	-18.1	177.5	0	0	0	0	0	112.5	K306 L307 F506 N509	K306-A511 CarbonylContact C-O 3.49Å; K306-A511 VanDerWaalsContact CA-O 3.26Å; K306-A511 WeakPolarHBondContact CA-O 3.37Å; L307-A511 HydrophobicContact CG-CB 4.24Å; L307-A511 PolarHBondContact N-O 3.05Å; F506-A511 HydrophobicContact CB-CB 4.25Å; F506-A511 HydrophobicContact CD1-CB 3.92Å; F506-A511 WeakPolarHBondContact O-CB 3.19Å; F506-A511 PolarHBondContact O-N 3.18Å; N509-A511 PolarHBondContact O-N 3.42Å
512	G	90.7	Very high	91.7	Very high	16 Å²	16	59.6 Å²	59.6	17%	0.165	31%	0.308	C	S	.	.			trans	93.4	179.6	178.9	0	0	0	0	0	112.9	L307 F506 Q510	L307-G512 WeakPolarHBondContact CD1-O 3.1Å; F506-G512 PolarHBondContact O-N 3.19Å; Q510-G512 PolarHBondContact O-N 3.33Å
513	P	92.1	Very high	91.7	Very high	51 Å²	51	59.8 Å²	59.8	33%	0.331	31%	0.309	S	S	.	.			trans	-76.7	132	-167	29.2	-35.3	0	0	0	113.3	Y309 V318 L507 N515	Y309-P513 PolarHBondContact OH-O 2.83Å; Y309-P513 VanDerWaalsContact OH-O 3.1Å; V318-P513 HydrophobicContact CG2-CG 4.16Å; L507-P513 HydrophobicContact CD2-CB 4.21Å; P513-N515 VanDerWaalsContact C-N 3.28Å; P513-N515 PolarHBondContact O-N 2.97Å
514	W	92.9	Very high	91.5	Very high	50 Å²	50	60.7 Å²	60.7	19%	0.189	32%	0.322	C	S	.	.			trans	-76.2	83.5	162.3	-172.4	-76.1	0	0	0	109.4	L307 V333 D337 K338 C341 K503 F506	L307-W514 HydrophobicContact CD1-CB 4.23Å; L307-W514 HydrophobicContact CD1-CE3 4.27Å; L307-W514 HydrophobicContact CD2-CE3 4.34Å; V333-W514 HydrophobicContact CB-CH2 4.03Å; V333-W514 HydrophobicContact CB-CZ2 4.27Å; V333-W514 HydrophobicContact CB-CZ3 4.4Å; V333-W514 HydrophobicContact CG1-CE3 4.18Å; V333-W514 HydrophobicContact CG1-CH2 3.54Å; V333-W514 HydrophobicContact CG1-CZ2 4.23Å; V333-W514 HydrophobicContact CG1-CZ3 3.52Å; V333-W514 HydrophobicContact CG2-CD2 4.28Å; V333-W514 HydrophobicContact CG2-CE3 4.43Å; V333-W514 HydrophobicContact CG2-CH2 3.98Å; V333-W514 HydrophobicContact CG2-CZ2 3.79Å; V333-W514 HydrophobicContact CG2-CZ3 4.29Å; D337-W514 HydrophobicContact CB-CZ3 4.22Å; D337-W514 WeakPolarHBondContact O-CZ3 3.49Å; K338-W514 HydrophobicContact CB-CH2 4.46Å; K338-W514 HydrophobicContact CG-CH2 3.85Å; K338-W514 HydrophobicContact CG-CZ2 4.43Å; C341-W514 HydrophobicContact CB-CH2 4.46Å; C341-W514 WeakPolarHBondContact SG-CH2 3.26Å; C341-W514 WeakPolarHBondContact SG-CZ3 3.18Å; K503-W514 HydrophobicContact CG-CB 4.23Å; F506-W514 HydrophobicContact CD2-CB 4.4Å; F506-W514 HydrophobicContact CD2-CE3 4.17Å; F506-W514 AromaticContact CE2-CE3 3.69Å; F506-W514 HydrophobicContact CE2-CE3 3.69Å; F506-W514 HydrophobicContact CE2-CZ3 4.14Å; F506-W514 HydrophobicContact CZ-CE3 4.46Å
515	N	86.3	Confident	90.7	Very high	61 Å²	61	58 Å²	58	33%	0.326	32%	0.321	S	S	.	.			trans	-69.2	142.1	-178.9	-71.6	-35.2	0	0	0	110.9	Y309 W326 P513	Y309-N515 PolarHBondContact OH-N 2.95Å; Y309-N515 VanDerWaalsContact OH-N 3.13Å; W326-N515 HydrophobicContact CD2-CB 3.92Å; W326-N515 VanDerWaalsContact CE2-CB 3.47Å; W326-N515 HydrophobicContact CE3-CB 4.11Å; W326-N515 HydrophobicContact CH2-CB 3.54Å; W326-N515 VanDerWaalsContact CH2-O 3.31Å; W326-N515 WeakPolarHBondContact CH2-O 3.5Å; W326-N515 HydrophobicContact CZ2-CB 3.3Å; W326-N515 VanDerWaalsContact CZ2-O 3.31Å; W326-N515 WeakPolarHBondContact CZ2-O 3.45Å; W326-N515 HydrophobicContact CZ3-CB 3.94Å; P513-N515 VanDerWaalsContact C-N 3.28Å; P513-N515 PolarHBondContact O-N 2.97Å
516	S	85.8	Confident	90.5	Very high	55 Å²	55	57.3 Å²	57.3	39%	0.385	32%	0.323	S	S	.	.			trans	-109.3	137.4	176.8	-67.6	0	0	0	0	110.7	W326 K518	W326-S516 PolarHBondContact NE1-O 3.24Å; S516-K518 PolarHBondContact O-N 2.94Å; S516-K518 VanDerWaalsContact O-N 3.07Å
517	K	89.3	Confident	90.4	Very high	48 Å²	48	60.3 Å²	60.3	21%	0.209	34%	0.34	C	S	.	.			trans	-66.9	105.8	176.8	-69.2	-178.6	168.3	74.9	0	108.8	L216 W326 C331 C332 V520	L216-K517 HydrophobicContact CD2-CD 3.76Å; L216-K517 HydrophobicContact CD2-CG 4.3Å; W326-K517 HydrophobicContact CZ2-CG 4.31Å; C331-K517 PolarHBondContact O-NZ 3.26Å; C332-K517 PolarHBondContact SG-NZ 3.32Å; K517-V520 HydrophobicContact CB-CB 4.06Å; K517-V520 HydrophobicContact CB-CG1 4.45Å; K517-V520 HydrophobicContact CB-CG2 3.97Å; K517-V520 HydrophobicContact CD-CG1 4.49Å; K517-V520 HydrophobicContact CD-CG2 4.44Å
518	K	84.9	Confident	90.2	Very high	176 Å²	176	58.2 Å²	58.2	77%	0.765	33%	0.33	S	S	*	.	S	Bend	trans	-62.6	151.1	177.8	-67.5	-176.6	177.3	-177.5	0	110.4	S516 V520	S516-K518 PolarHBondContact O-N 2.94Å; S516-K518 VanDerWaalsContact O-N 3.07Å; K518-V520 PolarHBondContact O-N 2.88Å
519	L	90	Very high	90.1	Very high	113 Å²	113	57.1 Å²	57.1	59%	0.592	32%	0.318	S	S	*	.	S	Bend	trans	59.9	-17.8	176.5	-52.4	179.7	0	0	0	117.9	Y218 D521 C522	Y218-L519 HydrophobicContact CD1-CB 3.83Å; Y218-L519 HydrophobicContact CE1-CB 3.82Å; L519-D521 PolarHBondContact O-N 2.74Å; L519-C522 WeakPolarHBondContact O-CB 3.5Å; L519-C522 PolarHBondContact O-N 3.25Å
520	V	93	Very high	90.2	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.4	-178.7	162.5	0	0	0	0	114.6	L216 Y218 H224 K460 K517 K518 F523	L216-V520 HydrophobicContact CB-CG2 4.01Å; L216-V520 HydrophobicContact CD1-CG2 3.99Å; L216-V520 HydrophobicContact CD2-CG2 4.07Å; L216-V520 HydrophobicContact CG-CG2 4.25Å; Y218-V520 HydrophobicContact CD1-CG2 4.17Å; Y218-V520 HydrophobicContact CE1-CG2 4.14Å; H224-V520 VanDerWaalsContact CE1-CG1 3.47Å; H224-V520 WeakPolarHBondContact CE1-CG1 3.32Å; K460-V520 HydrophobicContact CD-CG1 4.45Å; K460-V520 VanDerWaalsContact CE-CG1 3.47Å; K517-V520 HydrophobicContact CB-CB 4.06Å; K517-V520 HydrophobicContact CB-CG1 4.45Å; K517-V520 HydrophobicContact CB-CG2 3.97Å; K517-V520 HydrophobicContact CD-CG1 4.49Å; K517-V520 HydrophobicContact CD-CG2 4.44Å; K518-V520 PolarHBondContact O-N 2.88Å; V520-F523 WeakPolarHBondContact O-CE1 3.44Å
521	D	96	Very high	90.2	Very high	31 Å²	31	54.1 Å²	54.1	17%	0.166	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-1.9	173.9	-72.4	-18.6	0	0	0	113	K460 Y485 H486 K489 L519 F523	K460-D521 IonicContact NZ-OD1 2.89Å; K460-D521 PolarHBondContact NZ-OD1 3.06Å; Y485-D521 CarbonylContact C-O 3.58Å; Y485-D521 HydrophobicContact CD1-CB 3.81Å; Y485-D521 HydrophobicContact CE1-CB 4.27Å; Y485-D521 VanDerWaalsContact CE1-OD1 3.26Å; Y485-D521 WeakPolarHBondContact CE1-OD1 3.29Å; H486-D521 HydrophobicContact CB-CB 3.96Å; H486-D521 WeakPolarHBondContact CB-O 3.48Å; H486-D521 PolarHBondContact N-O 3.17Å; K489-D521 WeakPolarHBondContact CD-OD2 3.32Å; K489-D521 IonicContact NZ-OD1 2.65Å; K489-D521 PolarHBondContact NZ-OD1 3.18Å; K489-D521 IonicContact NZ-OD2 3.43Å; K489-D521 PolarHBondContact NZ-OD2 2.9Å; L519-D521 PolarHBondContact O-N 2.74Å; D521-F523 VanDerWaalsContact C-N 3.29Å; D521-F523 PolarHBondContact O-N 2.71Å
522	C	95.5	Very high	90.3	Very high	56 Å²	56	57.8 Å²	57.8	38%	0.378	33%	0.33	S	S	.	.			trans	-87.2	59.7	-174	-60.9	0	0	0	0	112.5	L519	L519-C522 WeakPolarHBondContact O-CB 3.5Å; L519-C522 PolarHBondContact O-N 3.25Å
523	F	96	Very high	90.3	Very high	11 Å²	11	61 Å²	61	5%	0.048	34%	0.343	C	S	.	.			trans	-126.5	147.8	173.3	56.4	-88.8	0	0	0	111.2	Y218 K460 R461 Y464 T484 Y485 V520 D521	Y218-F523 WeakPolarHBondContact O-CB 3.45Å; Y218-F523 WeakPolarHBondContact O-CD1 3.39Å; K460-F523 HydrophobicContact CB-CE1 4.19Å; K460-F523 HydrophobicContact CB-CZ 3.62Å; K460-F523 HydrophobicContact CD-CE1 4.11Å; K460-F523 HydrophobicContact CD-CZ 4.37Å; R461-F523 HydrophobicContact CB-CE2 4.4Å; Y464-F523 HydrophobicContact CD1-CE2 4.48Å; T484-F523 CarbonylContact C-O 3.52Å; T484-F523 VanDerWaalsContact CA-O 3.28Å; T484-F523 WeakPolarHBondContact CA-O 3.24Å; Y485-F523 AromaticContact CD1-CE1 3.48Å; Y485-F523 HydrophobicContact CD1-CE1 3.48Å; Y485-F523 VanDerWaalsContact CD1-CE1 3.48Å; Y485-F523 HydrophobicContact CD1-CE2 4.05Å; Y485-F523 AromaticContact CD1-CZ 3.18Å; Y485-F523 HydrophobicContact CD1-CZ 3.18Å; Y485-F523 HydrophobicContact CD2-CE2 4.31Å; Y485-F523 HydrophobicContact CD2-CZ 4.07Å; Y485-F523 HydrophobicContact CE1-CE1 4.09Å; Y485-F523 AromaticContact CE1-CZ 3.72Å; Y485-F523 HydrophobicContact CE1-CZ 3.72Å; Y485-F523 HydrophobicContact CG-CE1 4.03Å; Y485-F523 AromaticContact CG-CE2 3.76Å; Y485-F523 HydrophobicContact CG-CE2 3.76Å; Y485-F523 AromaticContact CG-CZ 3.38Å; Y485-F523 HydrophobicContact CG-CZ 3.38Å; Y485-F523 PolarHBondContact N-O 2.65Å; V520-F523 WeakPolarHBondContact O-CE1 3.44Å; D521-F523 VanDerWaalsContact C-N 3.29Å; D521-F523 PolarHBondContact O-N 2.71Å
524	S	92.4	Very high	90.1	Very high	75 Å²	75	61.8 Å²	61.8	52%	0.524	34%	0.344	S	S	.	.			trans	-73.7	165.8	166.7	53.8	0	0	0	0	111.5	R461	R461-S524 PolarHBondContact NH1-O 3.4Å; R461-S524 PolarHBondContact NH2-O 3.01Å
525	A	79.3	Confident	89.9	Confident	65 Å²	65	62.9 Å²	62.9	54%	0.537	36%	0.358	S	S	.	.			trans	-43	0	177.7	0	0	0	0	0	114.1	R461 Y464 Q468	R461-A525 PolarHBondContact NH1-O 2.67Å; R461-A525 PolarHBondContact NH1-OXT 3.3Å; Y464-A525 HydrophobicContact CD1-CB 4.47Å; Y464-A525 HydrophobicContact CE1-CB 4.06Å; Q468-A525 VanDerWaalsContact NE2-CB 3.3Å

Retrieved 525 of 525 residues in 1181.9 ms (Link to these results)

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