A0A087X8J2_POEFO Loading...

Progesterone receptor

AlphaFold DB (A0A3B3U6M7), UniProt , Accession A0A087X8J2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 642 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	31.5	Very low	221 Å²	221	149.2 Å²	149.2	100%	1.089	80%	0.797	S	S	*	*				0	61.5	0	-54.3	178.3	-170.5	0	0	109.2
2	E	31.7	Very low	31.3	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	80%	0.796	S	S	*	*				71.7	112.3	51.4	-68.2	169.3	104.1	0	0	111.7
3	N	33.2	Very low	30.9	Very low	134 Å²	134	146.1 Å²	146.1	72%	0.717	79%	0.792	S	S	*	*				79.9	146.6	87.5	-71.7	-32	0	0	0	111.4
4	K	33.9	Very low	30.6	Very low	170 Å²	170	146.3 Å²	146.3	74%	0.739	80%	0.8	S	S	*	*			cis	-167	174.3	9.9	-125.9	179.1	177.7	-169.3	0	108.3
5	M	34.3	Very low	30.6	Very low	122 Å²	122	145.5 Å²	145.5	60%	0.601	80%	0.802	S	S	*	*			cis	-160.7	126.3	-0.9	-163.9	159.3	75.3	0	0	112.7
6	H	33.8	Very low	30.5	Very low	181 Å²	181	143.1 Å²	143.1	84%	0.838	80%	0.798	S	S	*	*			trans	69.9	167.9	149.1	-65.4	2.3	0	0	0	119.5
7	G	28.4	Very low	30.6	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	80%	0.801	S	S	*	*			cis	-155.4	-172.1	10.4	0	0	0	0	0	117.2
8	K	31.7	Very low	30.7	Very low	196 Å²	196	140.6 Å²	140.6	85%	0.852	79%	0.792	S	S	*	*			trans	-98.5	170.4	-170	-73.6	-177.6	174	179.6	0	114.1
9	M	28.9	Very low	30.4	Very low	179 Å²	179	140.9 Å²	140.9	88%	0.882	79%	0.791	S	S	*	*			trans	101.5	163.7	132.6	-113.8	154.6	169.8	0	0	118.9
10	S	31.3	Very low	30.4	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	78%	0.783	S	S	*	*			trans	-134	133.7	-152.5	53.8	0	0	0	0	113.7
11	A	26.9	Very low	30.5	Very low	94 Å²	94	137.3 Å²	137.3	78%	0.777	78%	0.78	S	S	*	*			trans	-142.8	135.2	157.3	0	0	0	0	0	106.2
12	I	28.3	Very low	30.3	Very low	153 Å²	153	133.6 Å²	133.6	79%	0.785	77%	0.765	S	S	*	*			cis	77.7	110.4	48.6	-61.8	179.6	0	0	0	112.8
13	S	26.7	Very low	30.2	Very low	105 Å²	105	129.6 Å²	129.6	73%	0.734	75%	0.754	S	S	*	*			trans	65.9	116.4	158.2	-60.2	0	0	0	0	121.3
14	T	26.5	Very low	30	Very low	149 Å²	149	132.1 Å²	132.1	91%	0.914	76%	0.759	S	S	*	*				-146.1	149.1	120.2	25.4	0	0	0	0	110.4
15	T	30.5	Very low	29.6	Very low	135 Å²	135	130.2 Å²	130.2	83%	0.828	76%	0.761	S	S	*	*			trans	-141.4	145.3	-178	40.5	0	0	0	0	111.4
16	S	28.8	Very low	29.1	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	77%	0.77	S	S	*	*			trans	-165.2	113.9	160.9	52.8	0	0	0	0	108.3
17	I	32.7	Very low	28.9	Very low	165 Å²	165	128.8 Å²	128.8	85%	0.846	77%	0.771	S	S	*	*				75.7	129.6	74.4	-66.6	160.7	0	0	0	110.8
18	A	31.4	Very low	28.8	Very low	76 Å²	76	133.3 Å²	133.3	63%	0.628	78%	0.777	S	S	*	*			cis	-121	-157.8	0.9	0	0	0	0	0	110.6
19	D	26.2	Very low	28.7	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	77%	0.771	S	S	*	*			cis	-149.1	164.9	0.2	-107.8	-40.1	0	0	0	106.7
20	S	30.9	Very low	28.5	Very low	89 Å²	89	129.9 Å²	129.9	62%	0.622	77%	0.77	S	S	*	*			cis	79.7	125	42.8	-154.4	0	0	0	0	114
21	T	31.1	Very low	28.2	Very low	118 Å²	118	130.5 Å²	130.5	72%	0.724	77%	0.769	S	S	*	*			cis	-152.4	147.9	3.4	-5.3	0	0	0	0	106.7
22	D	29	Very low	28.1	Very low	143 Å²	143	129.5 Å²	129.5	77%	0.765	77%	0.768	S	S	*	*			cis	70.7	134.3	33	-153.2	79.3	0	0	0	113.3
23	S	30.2	Very low	27.9	Very low	77 Å²	77	132.5 Å²	132.5	54%	0.538	77%	0.771	S	S	.	*			cis	-168.3	173.5	-14.7	51	0	0	0	0	110.1
24	K	27.7	Very low	27.9	Very low	187 Å²	187	133.7 Å²	133.7	81%	0.813	78%	0.779	S	S	*	*			trans	143.3	121.3	150.1	-80	159.6	-174.5	170.7	0	111.7
25	V	26.7	Very low	27.8	Very low	129 Å²	129	137.3 Å²	137.3	78%	0.782	78%	0.776	S	S	*	*				83.9	113.4	62	168.8	0	0	0	0	113.1
26	S	24.5	Very low	27.6	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	78%	0.776	S	S	*	*			trans	-160.9	112.8	134.3	-80.5	0	0	0	0	109.9
27	N	28	Very low	27.4	Very low	159 Å²	159	137.2 Å²	137.2	85%	0.85	78%	0.775	S	S	*	*			trans	-85	143.1	152	-76.5	-42.7	0	0	0	107
28	L	26.9	Very low	27	Very low	170 Å²	170	138.1 Å²	138.1	89%	0.89	77%	0.773	S	S	*	*			trans	-138.7	146.2	156.7	-132.1	120.7	0	0	0	110
29	I	29.1	Very low	26.6	Very low	143 Å²	143	140.8 Å²	140.8	73%	0.733	78%	0.782	S	S	*	*			trans	-104	142.2	-172	-59.5	162	0	0	0	107.7	V31	I29-V31 HydrophobicContact CG2-CG2 4.16Å
30	D	24.9	Very low	26.5	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	77%	0.773	S	S	*	*			trans	-142.2	158.9	146.3	-153.1	-2	0	0	0	111.3
31	V	25.4	Very low	26.3	Very low	121 Å²	121	138.8 Å²	138.8	73%	0.733	78%	0.78	S	S	*	*			trans	-120.5	120.4	-163.9	176.5	0	0	0	0	110.4	I29	I29-V31 HydrophobicContact CG2-CG2 4.16Å
32	G	24.7	Very low	26	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	79%	0.785	S	S	*	*			trans	-143.7	61.4	-166.2	0	0	0	0	0	116.7
33	Y	23.3	Very low	25.9	Very low	216 Å²	216	144.6 Å²	144.6	85%	0.847	79%	0.791	S	S	*	*			trans	35.9	108.1	158.1	-89.7	-90.4	0	0	0	120.1	R35	Y33-R35 PolarHBondContact O-N 3.35Å
34	S	27.7	Very low	25.7	Very low	129 Å²	129	149 Å²	149	90%	0.902	81%	0.807	S	S	*	*			trans	-55.9	121.7	154.4	-55.9	0	0	0	0	111.1
35	R	24.2	Very low	25.6	Very low	225 Å²	225	143.6 Å²	143.6	85%	0.849	80%	0.804	S	S	*	*			trans	-134	107.9	170	-163.2	174.8	-168.6	174.9	4.4	111	Y33 V37	Y33-R35 PolarHBondContact O-N 3.35Å; R35-V37 PolarHBondContact O-N 3.47Å
36	S	26.9	Very low	25.6	Very low	118 Å²	118	142.3 Å²	142.3	83%	0.825	80%	0.801	S	S	*	*			trans	-63.9	103.3	175.8	-52.8	0	0	0	0	110.9	K38	S36-K38 VanDerWaalsContact C-N 3.33Å; S36-K38 PolarHBondContact O-N 3.24Å
37	V	23.3	Very low	25.7	Very low	121 Å²	121	145 Å²	145	73%	0.733	81%	0.806	S	S	*	*			trans	-77.2	87.5	170.4	-175.2	0	0	0	0	108.7	R35 V39	R35-V37 PolarHBondContact O-N 3.47Å; V37-V39 HydrophobicContact CG1-CG2 3.97Å; V37-V39 PolarHBondContact O-N 2.95Å
38	K	24.9	Very low	25.6	Very low	184 Å²	184	143.9 Å²	143.9	80%	0.8	80%	0.799	S	S	*	*			trans	-63.3	102.7	156.3	-75.7	-174.9	176.3	-178.4	0	107.3	S36 V40	S36-K38 VanDerWaalsContact C-N 3.33Å; S36-K38 PolarHBondContact O-N 3.24Å; K38-V40 VanDerWaalsContact C-N 3.26Å; K38-V40 HydrophobicContact CB-CG2 4.39Å; K38-V40 PolarHBondContact O-N 3.1Å
39	V	23	Very low	26.3	Very low	133 Å²	133	141.1 Å²	141.1	81%	0.806	79%	0.792	S	S	*	*			trans	-70.1	91.7	166.2	-178.6	0	0	0	0	107.2	V37 A41	V37-V39 HydrophobicContact CG1-CG2 3.97Å; V37-V39 PolarHBondContact O-N 2.95Å; V39-A41 PolarHBondContact O-N 3.3Å
40	V	24	Very low	26.1	Very low	101 Å²	101	142.8 Å²	142.8	61%	0.612	80%	0.801	S	S	*	*			trans	-71.3	114.1	174.9	175.6	0	0	0	0	107.8	K38 R42	K38-V40 VanDerWaalsContact C-N 3.26Å; K38-V40 HydrophobicContact CB-CG2 4.39Å; K38-V40 PolarHBondContact O-N 3.1Å; V40-R42 HydrophobicContact CG1-CG 4.34Å; V40-R42 PolarHBondContact O-N 3.17Å; V40-R42 VanDerWaalsContact O-N 3.17Å
41	A	26.5	Very low	26.3	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	80%	0.798	S	S	*	*			trans	-56.7	120.2	168.6	0	0	0	0	0	109.3	V39	V39-A41 PolarHBondContact O-N 3.3Å
42	R	25.4	Very low	26.4	Very low	220 Å²	220	146 Å²	146	83%	0.83	81%	0.806	S	S	*	*			trans	-117.9	114.8	172.1	-78.5	-174	170.9	164.2	-2.5	109	V40	V40-R42 HydrophobicContact CG1-CG 4.34Å; V40-R42 PolarHBondContact O-N 3.17Å; V40-R42 VanDerWaalsContact O-N 3.17Å
43	N	26.8	Very low	26.3	Very low	163 Å²	163	145.6 Å²	145.6	87%	0.872	80%	0.802	S	S	*	*			trans	-57.2	135.5	162.6	-58	-30.9	0	0	0	108.7
44	L	26.4	Very low	26.5	Very low	169 Å²	169	143.6 Å²	143.6	89%	0.885	81%	0.805	S	S	*	*			trans	-116.1	125	152.9	-118.1	77.6	0	0	0	107.5
45	G	25.6	Very low	26.4	Very low	73 Å²	73	145.1 Å²	145.1	75%	0.753	80%	0.803	S	S	*	*			trans	-87.4	168.6	169.8	0	0	0	0	0	111.2
46	S	27	Very low	26.6	Very low	102 Å²	102	139.7 Å²	139.7	71%	0.713	80%	0.8	S	S	*	*			trans	-70.1	144.4	176.3	-179.2	0	0	0	0	112.7
47	L	25.8	Very low	26.6	Very low	171 Å²	171	139.6 Å²	139.6	90%	0.895	80%	0.799	S	S	*	*			trans	-157	130.2	142.2	-141.4	76.1	0	0	0	111.1
48	D	24.9	Very low	26.7	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	79%	0.794	S	S	*	*			trans	-85.4	-168.9	170.5	-60.6	-68.8	0	0	0	111.1
49	P	42.5	Very low	26.8	Very low	112 Å²	112	136 Å²	136	73%	0.727	80%	0.799	S	S	*	*				-126.4	173.2	-74.7	38.4	-24.7	0	0	0	111.9
50	L	25.1	Very low	26.9	Very low	179 Å²	179	135.5 Å²	135.5	94%	0.937	80%	0.8	S	S	*	*			trans	-135.6	149.6	163.8	-85.8	179.1	0	0	0	113.3
51	I	28	Very low	27	Very low	151 Å²	151	135.4 Å²	135.4	77%	0.774	80%	0.804	S	S	*	*			trans	-101.8	134.1	-167.2	-64.6	164.8	0	0	0	110.4
52	H	27.9	Very low	27.1	Very low	196 Å²	196	136.5 Å²	136.5	91%	0.907	80%	0.8	S	S	*	*			trans	-166.2	138	135.5	-107.5	-73.9	0	0	0	109.7
53	G	23.9	Very low	27	Very low	66 Å²	66	135.4 Å²	135.4	68%	0.68	80%	0.798	S	S	*	*			trans	-129.5	171.7	179.5	0	0	0	0	0	112.8
54	L	27.3	Very low	27	Very low	175 Å²	175	134.6 Å²	134.6	92%	0.916	79%	0.787	S	S	*	*			trans	-150.2	159.8	169.1	-101.2	170.3	0	0	0	110
55	N	25.7	Very low	26.9	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	78%	0.776	S	S	*	*			trans	-107.3	143.6	-158	-59.2	-33.4	0	0	0	115.5
56	S	27.9	Very low	26.9	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	78%	0.782	S	S	*	*			trans	-166	115.5	144.2	-167.4	0	0	0	0	106.9
57	S	26.4	Very low	26.7	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	79%	0.785	S	S	*	*				60.5	115.8	67.2	-162.8	0	0	0	0	112.5
58	G	26.5	Very low	26.5	Very low	61 Å²	61	134 Å²	134	63%	0.629	78%	0.777	S	S	*	*			cis	-176.2	174.3	-2.1	0	0	0	0	0	114.3
59	D	26.4	Very low	26.5	Very low	168 Å²	168	135.2 Å²	135.2	90%	0.898	78%	0.782	S	S	*	*			trans	52.2	142.7	164.9	-52.9	-24.6	0	0	0	120
60	C	25	Very low	25.6	Very low	123 Å²	123	139.3 Å²	139.3	83%	0.831	79%	0.791	S	S	*	*			cis	-147.9	175.5	24.3	-162.1	0	0	0	0	113.7
61	S	26.3	Very low	25.5	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	78%	0.784	S	S	*	*			trans	-77.4	169.4	-171.5	61	0	0	0	0	115.3
62	V	27.5	Very low	25.2	Very low	115 Å²	115	134 Å²	134	70%	0.697	79%	0.788	S	S	*	*				-170.6	128.5	77.9	153.6	0	0	0	0	113.2
63	Y	24.6	Very low	25	Very low	198 Å²	198	131.7 Å²	131.7	78%	0.776	79%	0.787	S	S	*	*			trans	67.1	124.3	151	-79.2	-132.6	0	0	0	119.8
64	K	26.8	Very low	24.9	Very low	146 Å²	146	134.2 Å²	134.2	64%	0.635	79%	0.794	S	S	*	*				78	139.7	65.6	-76	177.1	142.4	-84.5	0	113.1
65	D	24.1	Very low	24.7	Very low	124 Å²	124	130.3 Å²	130.3	66%	0.663	79%	0.788	S	S	*	*			cis	-149.7	163.3	-9.6	-86.2	-40.9	0	0	0	105.5
66	C	24.7	Very low	24.8	Very low	129 Å²	129	132.6 Å²	132.6	87%	0.872	79%	0.79	S	S	*	*				-175.2	178.2	63	-157.1	0	0	0	0	112
67	N	22.5	Very low	24.6	Very low	147 Å²	147	136.7 Å²	136.7	79%	0.786	80%	0.797	S	S	*	*			trans	-99.7	160.5	-162.9	-88	-29.9	0	0	0	117.3
68	S	22.8	Very low	24.5	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	79%	0.794	S	S	*	*			trans	63.1	130.4	140.9	63.5	0	0	0	0	121.4
69	I	25.7	Very low	24.5	Very low	160 Å²	160	144.7 Å²	144.7	82%	0.821	81%	0.809	S	S	*	*				-153.8	131.9	98.6	-93.3	154.4	0	0	0	108.7
70	E	22.2	Very low	24.5	Very low	197 Å²	197	143.6 Å²	143.6	92%	0.921	80%	0.802	S	S	*	*			trans	-93.6	140.6	163.1	-72.8	-172.5	112.2	0	0	110
71	A	23.7	Very low	24.6	Very low	96 Å²	96	142.1 Å²	142.1	79%	0.793	79%	0.794	S	S	*	*			trans	-153.1	102.4	162.8	0	0	0	0	0	110.1
72	S	22.1	Very low	24.7	Very low	123 Å²	123	141.8 Å²	141.8	86%	0.86	78%	0.784	S	S	*	*			trans	-89.9	129.7	178.5	54.9	0	0	0	0	111.7
73	V	24	Very low	24.6	Very low	148 Å²	148	140.3 Å²	140.3	90%	0.897	78%	0.779	S	S	*	*			trans	-137.2	133.7	164.1	-177.9	0	0	0	0	108.8
74	S	20.3	Very low	24.7	Very low	118 Å²	118	136 Å²	136	83%	0.825	77%	0.769	S	S	*	*			trans	-121.8	119	179.6	176.8	0	0	0	0	110.4
75	A	24.6	Very low	25	Very low	94 Å²	94	138.6 Å²	138.6	78%	0.777	78%	0.777	S	S	*	*			trans	-169.4	138.5	152.1	0	0	0	0	0	112.4
76	K	26.1	Very low	25.3	Very low	209 Å²	209	137.4 Å²	137.4	91%	0.909	77%	0.77	S	S	*	*			trans	-40.4	139.5	172.4	-57.2	164.6	178.1	176.5	0	115
77	Q	24.6	Very low	25.7	Very low	197 Å²	197	139.5 Å²	139.5	92%	0.921	76%	0.764	S	S	*	*			trans	-141	164.1	148.8	-114.7	175.2	6.8	0	0	112.4
78	S	23.3	Very low	25.9	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	77%	0.767	S	S	*	*			trans	-63.8	147.9	-163.8	-162.6	0	0	0	0	114.9	D80	S78-D80 PolarHBondContact O-N 3.49Å
79	Y	27.9	Very low	26.2	Very low	237 Å²	237	137.6 Å²	137.6	93%	0.929	77%	0.767	S	S	*	*			trans	-70.5	107.4	156	-89.7	-96.7	0	0	0	108.9
80	D	26.1	Very low	26.8	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	77%	0.768	S	S	*	*			trans	-159.2	79.3	159.5	-156.7	-4.1	0	0	0	110.8	S78	S78-D80 PolarHBondContact O-N 3.49Å
81	S	27.1	Very low	27.2	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	75%	0.753	S	S	*	*			trans	-158.9	48.6	-178.2	-69.3	0	0	0	0	113.3
82	N	28.3	Very low	27.7	Very low	92 Å²	92	128.7 Å²	128.7	49%	0.492	74%	0.742	S	S	.	*			trans	-110.2	7.8	174.9	-113.3	23	0	0	0	114.2
83	S	26.2	Very low	28.4	Very low	83 Å²	83	132 Å²	132	58%	0.58	74%	0.736	S	S	*	*	S	Bend	trans	-91.3	-29.5	-175.9	-167.7	0	0	0	0	114.1
84	D	26.7	Very low	28.7	Very low	109 Å²	109	130.8 Å²	130.8	58%	0.583	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-87	-20	-162.8	-61.7	-54.5	0	0	0	114.8	L86 K87	D84-L86 PolarHBondContact O-N 3.33Å; D84-L86 VanDerWaalsContact O-N 3.08Å; D84-K87 PolarHBondContact O-N 3.1Å
85	Y	31.9	Very low	29.2	Very low	200 Å²	200	130.7 Å²	130.7	78%	0.784	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-65.5	-10.4	176.1	-73.3	-76.6	0	0	0	114.6
86	L	31.6	Very low	29.6	Very low	99 Å²	99	133 Å²	133	52%	0.518	70%	0.699	S	S	.	*	G	3₁₀ helix	trans	-93.6	-2.3	174.3	-75.7	168.5	0	0	0	113.9	D84	D84-L86 PolarHBondContact O-N 3.33Å; D84-L86 VanDerWaalsContact O-N 3.08Å
87	K	31.9	Very low	30	Very low	172 Å²	172	126.1 Å²	126.1	75%	0.748	67%	0.674	S	S	*	*			trans	-113.3	82.8	177.4	-72.2	-179.4	179.9	172.5	0	111.9	D84	D84-K87 PolarHBondContact O-N 3.1Å
88	S	26.3	Very low	30.3	Very low	122 Å²	122	123.9 Å²	123.9	85%	0.853	66%	0.662	S	S	*	*			trans	-124.6	149.5	158.9	-167.1	0	0	0	0	110
89	A	30.3	Very low	30.7	Very low	88 Å²	88	125.6 Å²	125.6	73%	0.727	66%	0.657	S	S	*	*			trans	-73.9	151.9	-158.8	0	0	0	0	0	114.1	V91	A89-V91 PolarHBondContact O-N 2.87Å
90	G	36.8	Very low	31.4	Very low	81 Å²	81	119.9 Å²	119.9	84%	0.835	64%	0.639	S	S	*	*			trans	-75.3	109.7	168.3	0	0	0	0	0	110.8
91	V	30.6	Very low	31.6	Very low	99 Å²	99	122 Å²	122	60%	0.6	64%	0.636	S	S	*	*			trans	-89.3	127.1	166.3	-179	0	0	0	0	108.3	A89	A89-V91 PolarHBondContact O-N 2.87Å
92	P	34.7	Very low	31.9	Very low	86 Å²	86	122.2 Å²	122.2	56%	0.558	63%	0.634	S	S	*	*			trans	-61.2	148.5	173.8	-24	35.4	0	0	0	112.8	E94	P92-E94 WeakPolarHBondContact CB-OE2 3.37Å; P92-E94 PolarHBondContact O-N 3.14Å
93	W	36.6	Very low	32	Very low	194 Å²	194	122 Å²	122	74%	0.735	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-20.6	-171.3	173.2	-109	0	0	0	113.7	E95 V97	W93-E95 VanDerWaalsContact C-N 3.33Å; W93-E95 PolarHBondContact O-N 3.2Å; W93-V97 HydrophobicContact CZ2-CG2 4.37Å
94	E	30.7	Very low	32.2	Very low	121 Å²	121	121.9 Å²	121.9	57%	0.565	64%	0.644	S	S	*	*	H	α-helix	trans	-65.6	-26.4	-173.9	-65.8	76.7	-171.4	0	0	114.4	P92	P92-E94 WeakPolarHBondContact CB-OE2 3.37Å; P92-E94 PolarHBondContact O-N 3.14Å
95	E	31.4	Very low	32.4	Very low	116 Å²	116	121 Å²	121	54%	0.542	65%	0.647	S	S	.	*	H	α-helix	trans	-82.9	-35.7	-176.7	-62.1	-150.4	129	0	0	113.3	W93 V97 K98 H99	W93-E95 VanDerWaalsContact C-N 3.33Å; W93-E95 PolarHBondContact O-N 3.2Å; E95-V97 VanDerWaalsContact C-N 3.31Å; E95-V97 PolarHBondContact O-N 3.04Å; E95-K98 PolarHBondContact O-N 3.26Å; E95-K98 VanDerWaalsContact O-N 3.12Å; E95-H99 PolarHBondContact O-N 3.07Å
96	F	31.8	Very low	32.5	Very low	143 Å²	143	119.1 Å²	119.1	63%	0.627	65%	0.649	S	S	*	*	H	α-helix	trans	-61.1	-41.2	176.3	-111.8	-92	0	0	0	111.6	K98 H99 Q100	F96-K98 VanDerWaalsContact C-N 3.26Å; F96-K98 PolarHBondContact O-N 3.43Å; F96-H99 PolarHBondContact O-N 2.78Å; F96-Q100 PolarHBondContact O-N 2.9Å
97	V	35	Very low	32.5	Very low	64 Å²	64	119.4 Å²	119.4	39%	0.388	66%	0.659	S	S	.	*	H	α-helix	trans	-68.7	-22.7	178.1	-178.6	0	0	0	0	112.6	W93 E95	W93-V97 HydrophobicContact CZ2-CG2 4.37Å; E95-V97 VanDerWaalsContact C-N 3.31Å; E95-V97 PolarHBondContact O-N 3.04Å
98	K	31.1	Very low	32.4	Very low	150 Å²	150	120.5 Å²	120.5	65%	0.652	67%	0.667	S	S	*	*	H	α-helix	trans	-80.1	-48.3	172.6	-77.8	176.9	177.2	173.3	0	112	E95 F96 Q100 R101	E95-K98 PolarHBondContact O-N 3.26Å; E95-K98 VanDerWaalsContact O-N 3.12Å; F96-K98 VanDerWaalsContact C-N 3.26Å; F96-K98 PolarHBondContact O-N 3.43Å; K98-Q100 VanDerWaalsContact C-N 3.34Å; K98-Q100 PolarHBondContact O-N 3.23Å; K98-R101 PolarHBondContact O-N 3.43Å; K98-R101 VanDerWaalsContact O-N 3.11Å
99	H	31.6	Very low	32.5	Very low	144 Å²	144	120 Å²	120	67%	0.667	66%	0.664	S	S	*	*	H	α-helix	trans	-66	-28.9	-171.8	-93.9	-74.4	0	0	0	114.9	E95 F96 T102	E95-H99 PolarHBondContact O-N 3.07Å; F96-H99 PolarHBondContact O-N 2.78Å; H99-T102 PolarHBondContact O-OG1 3.01Å
100	Q	42.4	Very low	32.4	Very low	117 Å²	117	123.7 Å²	123.7	55%	0.547	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.6	-10.7	174.7	-82.6	-174.5	-30.9	0	0	114.6	F96 K98 S103	F96-Q100 PolarHBondContact O-N 2.9Å; K98-Q100 VanDerWaalsContact C-N 3.34Å; K98-Q100 PolarHBondContact O-N 3.23Å; Q100-S103 PolarHBondContact O-OG 3.39Å
101	R	30.3	Very low	32	Very low	188 Å²	188	125.2 Å²	125.2	71%	0.709	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-20	179.6	-157.4	176.3	-63	-169	-0.6	113.1	K98	K98-R101 PolarHBondContact O-N 3.43Å; K98-R101 VanDerWaalsContact O-N 3.11Å
102	T	33.4	Very low	31.7	Very low	99 Å²	99	125.7 Å²	125.7	61%	0.607	68%	0.682	S	S	*	*	S	Bend	trans	-92.4	-13.5	178.3	33.7	0	0	0	0	114.4	H99	H99-T102 PolarHBondContact O-OG1 3.01Å
103	S	30.6	Very low	31.4	Very low	87 Å²	87	126.2 Å²	126.2	61%	0.608	69%	0.694	S	S	*	*	S	Bend	trans	-83.9	-13.8	175.8	50.5	0	0	0	0	114.1	Q100	Q100-S103 PolarHBondContact O-OG 3.39Å
104	A	31.3	Very low	31	Very low	81 Å²	81	124.6 Å²	124.6	67%	0.669	70%	0.7	S	S	*	*	S	Bend	trans	-91.5	-1.2	-176	0	0	0	0	0	114.7
105	S	30.7	Very low	30.9	Very low	91 Å²	91	127.3 Å²	127.3	64%	0.636	72%	0.717	S	S	*	*	S	Bend	trans	-106.6	18.2	-173.6	65	0	0	0	0	114.6
106	L	32.9	Very low	30.5	Very low	159 Å²	159	126.5 Å²	126.5	83%	0.832	72%	0.724	S	S	*	*	S	Bend	trans	-138	36.1	-174.2	-79.5	174.2	0	0	0	113.6
107	S	33	Very low	30.3	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	73%	0.734	S	S	*	*	S	Bend	trans	-150.7	37.2	176.2	69.3	0	0	0	0	115
108	E	28.5	Very low	29.8	Very low	195 Å²	195	129 Å²	129	91%	0.911	75%	0.749	S	S	*	*			trans	-142.7	72.5	178	-149.9	167.4	-113.9	0	0	113
109	S	28.8	Very low	29.5	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	76%	0.756	S	S	*	*			trans	-154.7	74.3	172	52.1	0	0	0	0	113.3
110	L	28	Very low	29.3	Very low	165 Å²	165	127 Å²	127	86%	0.864	76%	0.764	S	S	*	*	S	Bend	trans	-174.2	143.5	144	-103.7	159.9	0	0	0	113.2
111	S	28.1	Very low	28.8	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	77%	0.773	S	S	*	*			trans	47.4	103.3	161.2	57.8	0	0	0	0	119.5
112	A	24.8	Very low	28.6	Very low	108 Å²	108	121.8 Å²	121.8	89%	0.893	78%	0.78	S	S	*	*			trans	-115.8	132.3	152.4	0	0	0	0	0	109.6
113	A	27.8	Very low	28.4	Very low	97 Å²	97	122 Å²	122	80%	0.802	78%	0.782	S	S	*	*			trans	-148.3	110.3	173.7	0	0	0	0	0	110.8
114	N	28	Very low	28.2	Very low	161 Å²	161	124 Å²	124	86%	0.861	79%	0.794	S	S	*	*			trans	26.2	117.9	159.1	-57.6	-16.1	0	0	0	119.8
115	L	28.7	Very low	28	Very low	177 Å²	177	129.2 Å²	129.2	93%	0.927	80%	0.802	S	S	*	*				-159.9	159.2	116.6	-106.7	168.8	0	0	0	110.5
116	S	24	Very low	27.8	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	81%	0.814	S	S	*	*			trans	-143.6	141.3	-172.2	54	0	0	0	0	112.3
117	L	27.5	Very low	27.8	Very low	161 Å²	161	135.2 Å²	135.2	84%	0.843	82%	0.816	S	S	*	*			trans	-171	148.4	137.2	-128.2	67.3	0	0	0	113.4
118	S	23.7	Very low	27.6	Very low	99 Å²	99	139.3 Å²	139.3	69%	0.692	82%	0.821	S	S	*	*			trans	15.1	137.2	152	57.7	0	0	0	0	120.4
119	S	25.9	Very low	27.7	Very low	115 Å²	115	137 Å²	137	80%	0.804	82%	0.815	S	S	*	*				-160.4	167	53.8	58.3	0	0	0	0	116.2
120	T	27.7	Very low	27.9	Very low	136 Å²	136	141 Å²	141	83%	0.834	82%	0.821	S	S	*	*			trans	-44.4	163.3	-171.5	37.7	0	0	0	0	120.9
121	P	31.8	Very low	28.3	Very low	114 Å²	114	141.4 Å²	141.4	74%	0.74	82%	0.816	S	S	*	*			trans	-107.3	158.8	-158.4	40.6	-34.5	0	0	0	116.7
122	G	26.3	Very low	28.6	Very low	83 Å²	83	143 Å²	143	86%	0.856	81%	0.811	S	S	*	*			trans	-121.1	120.7	155.9	0	0	0	0	0	109.9
123	T	28.8	Very low	29.5	Very low	104 Å²	104	143.8 Å²	143.8	64%	0.638	81%	0.807	S	S	*	*			trans	-112.5	118.2	-161.4	-48.6	0	0	0	0	113.7	K125	T123-K125 HydrophobicContact CG2-CG 3.99Å
124	C	26	Very low	29.6	Very low	128 Å²	128	143.7 Å²	143.7	87%	0.865	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-101.2	125	154.5	-78.5	0	0	0	0	109.3
125	K	27.7	Very low	29.6	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.826	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-90.6	125	-174.7	-65.3	-179.4	179.3	179.1	0	111.3	T123	T123-K125 HydrophobicContact CG2-CG 3.99Å
126	F	26.2	Very low	29.6	Very low	206 Å²	206	140.4 Å²	140.4	90%	0.904	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-81.6	144.8	153.4	-82.2	-97.8	0	0	0	109.7
127	I	33.4	Very low	29.7	Very low	170 Å²	170	144 Å²	144	87%	0.872	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-86.5	146	169.2	-64.1	176.5	0	0	0	108
128	K	28.6	Very low	29.6	Very low	191 Å²	191	142.4 Å²	142.4	83%	0.83	79%	0.792	S	S	*	*			trans	-121.5	146.2	-169.7	-176.4	-168.8	170.6	-168.4	0	110.6
129	D	30	Very low	29.8	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	80%	0.799	S	S	*	*			trans	-63.1	155.2	172.1	-59.7	-77.4	0	0	0	114.4
130	E	33.4	Very low	30.1	Very low	196 Å²	196	144.6 Å²	144.6	92%	0.916	80%	0.799	S	S	*	*			trans	-128.6	155	156.6	-68.1	-159.2	131.2	0	0	110.1
131	K	35.3	Very low	30	Very low	173 Å²	173	143.7 Å²	143.7	75%	0.752	80%	0.797	S	S	*	*			trans	-157.6	145.8	-170.8	-147.4	-160	179.4	-153.8	0	113.6
132	E	34.3	Very low	30.9	Very low	148 Å²	148	143 Å²	143	69%	0.692	79%	0.793	S	S	*	*			trans	67.5	164	161.6	-82.9	173.8	-132.4	0	0	118.5
133	P	44.4	Very low	30.9	Very low	125 Å²	125	147.3 Å²	147.3	81%	0.812	79%	0.788	S	S	*	*			cis	-120.5	-164.3	2.5	38.3	-21.3	0	0	0	114.8
134	A	29.3	Very low	30.8	Very low	95 Å²	95	151.2 Å²	151.2	79%	0.785	80%	0.797	S	S	*	*			trans	-134.3	173.4	-174.7	0	0	0	0	0	113.1
135	V	28	Very low	30.8	Very low	129 Å²	129	151.1 Å²	151.1	78%	0.782	79%	0.787	S	S	*	*			trans	-174.1	120.3	147.8	139.3	0	0	0	0	115.1
136	I	28.9	Very low	30.7	Very low	139 Å²	139	147.5 Å²	147.5	71%	0.713	78%	0.781	S	S	*	*			trans	25.1	127.1	135.6	-29.2	174.2	0	0	0	122.7
137	M	26.5	Very low	30.8	Very low	174 Å²	174	142.5 Å²	142.5	86%	0.857	77%	0.772	S	S	*	*				174.7	155.2	117.8	-90.1	-129.1	65.1	0	0	115.1
138	D	26.5	Very low	31.5	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	77%	0.765	S	S	*	*			trans	-112.1	153.6	-164.8	-72.1	-73.7	0	0	0	116.6
139	T	27.1	Very low	31.7	Very low	135 Å²	135	136.6 Å²	136.6	83%	0.828	75%	0.753	S	S	*	*			trans	66.4	160.6	158.2	35.2	0	0	0	0	118.1
140	P	32.6	Very low	31.9	Very low	125 Å²	125	137 Å²	137	81%	0.812	75%	0.754	S	S	*	*			cis	-130.6	178.8	21.7	43.4	-26.7	0	0	0	118.1
141	C	24.4	Very low	31.7	Very low	117 Å²	117	135.9 Å²	135.9	79%	0.791	74%	0.741	S	S	*	*			trans	-105.4	-176.5	169.4	-134	0	0	0	0	108.8
142	P	52.3	Low	31.2	Very low	100 Å²	100	134.3 Å²	134.3	65%	0.649	75%	0.746	S	S	*	*			cis	-141.2	-169.7	-4.1	27.8	-1.3	0	0	0	115.7
143	K	26.3	Very low	31	Very low	174 Å²	174	133.4 Å²	133.4	76%	0.757	75%	0.745	S	S	*	*			trans	98.6	127.8	148	-63.3	-171.9	-179.4	-179.4	0	121.8
144	F	26.5	Very low	30.1	Very low	186 Å²	186	134 Å²	134	82%	0.816	74%	0.742	S	S	*	*			trans	57.4	144.3	135.8	-77.1	-110.5	0	0	0	119.2
145	D	24.8	Very low	30.2	Very low	126 Å²	126	134.8 Å²	134.8	67%	0.674	74%	0.737	S	S	*	*			cis	-169.6	-169.7	-10	-161.9	36.5	0	0	0	106.4
146	T	26.5	Very low	30.1	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.693	74%	0.738	S	S	*	*			cis	-152.4	167.2	10.1	-49.6	0	0	0	0	110.1
147	S	27.9	Very low	29.9	Very low	101 Å²	101	134 Å²	134	71%	0.706	75%	0.746	S	S	*	*			trans	-70.3	-179.4	163.9	-143.6	0	0	0	0	112.3
148	P	48	Very low	29.9	Very low	114 Å²	114	134 Å²	134	74%	0.74	75%	0.745	S	S	*	*				-155.9	-163.6	63.6	45.9	-23.8	0	0	0	115
149	E	32.9	Very low	29.9	Very low	123 Å²	123	134.4 Å²	134.4	58%	0.575	75%	0.752	S	S	*	*			cis	-134.2	-158.1	-5.6	-133.5	-149.7	107	0	0	108.5	R151	E149-R151 WeakPolarHBondContact OE1-CD 3.26Å; E149-R151 WeakPolarHBondContact OE1-CG 3.47Å; E149-R151 IonicContact OE1-CZ 2.86Å; E149-R151 IonicContact OE1-NE 2.76Å; E149-R151 IonicContact OE1-NH1 3.22Å; E149-R151 PolarHBondContact OE1-NH1 3.1Å; E149-R151 IonicContact OE2-NH1 2.65Å; E149-R151 PolarHBondContact OE2-NH1 2.95Å
150	I	33.2	Very low	29.7	Very low	155 Å²	155	135 Å²	135	80%	0.795	75%	0.75	S	S	*	*			cis	-143.1	178.4	15.5	-165	151.9	0	0	0	111.6
151	R	29.7	Very low	29.4	Very low	174 Å²	174	133.3 Å²	133.3	66%	0.657	74%	0.741	S	S	*	*			trans	-123.7	134.5	-163.1	-58.9	160.3	174.5	114.5	-10.9	115.8	E149 L153	E149-R151 WeakPolarHBondContact OE1-CD 3.26Å; E149-R151 WeakPolarHBondContact OE1-CG 3.47Å; E149-R151 IonicContact OE1-CZ 2.86Å; E149-R151 IonicContact OE1-NE 2.76Å; E149-R151 IonicContact OE1-NH1 3.22Å; E149-R151 PolarHBondContact OE1-NH1 3.1Å; E149-R151 IonicContact OE2-NH1 2.65Å; E149-R151 PolarHBondContact OE2-NH1 2.95Å; R151-L153 HydrophobicContact CB-CD1 3.85Å
152	T	25.9	Very low	29.6	Very low	139 Å²	139	136 Å²	136	85%	0.853	74%	0.739	S	S	*	*			trans	-142.7	91.8	144.3	51.2	0	0	0	0	107.6
153	L	30.3	Very low	28.6	Very low	129 Å²	129	137.5 Å²	137.5	68%	0.675	74%	0.738	S	S	*	*				62	126.3	80.2	-73.6	121.8	0	0	0	114.1	R151	R151-L153 HydrophobicContact CB-CD1 3.85Å
154	D	25.6	Very low	28.7	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	73%	0.734	S	S	*	*			cis	80.3	135.4	36.3	-75.3	-43.7	0	0	0	115.4
155	T	30.1	Very low	28.7	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	73%	0.733	S	S	*	*			cis	-158.9	166.9	-23.2	-26.5	0	0	0	0	108.6
156	C	27.1	Very low	28.7	Very low	118 Å²	118	131.8 Å²	131.8	80%	0.797	73%	0.734	S	S	*	*			trans	64.2	117.2	158.7	-64.1	0	0	0	0	121.5
157	C	24.6	Very low	28.7	Very low	132 Å²	132	134.4 Å²	134.4	89%	0.892	74%	0.743	S	S	*	*				-174.3	179	116.9	-111.5	0	0	0	0	114.1
158	E	24.8	Very low	28.6	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.822	75%	0.747	S	S	*	*			trans	-56.7	-178.4	-164.1	-54.2	-169	115.9	0	0	120.5
159	T	26.8	Very low	27.5	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	75%	0.745	S	S	*	*			trans	101.9	104	161.7	64.7	0	0	0	0	120.2
160	D	23.6	Very low	27.1	Very low	149 Å²	149	140 Å²	140	80%	0.797	76%	0.759	S	S	*	*			trans	66	140.6	130.5	-127.6	-45	0	0	0	124.5
161	S	26.2	Very low	27.7	Very low	88 Å²	88	137.3 Å²	137.3	62%	0.615	75%	0.752	S	S	*	*			trans	58.7	114.8	152.6	-76.7	0	0	0	0	123.3
162	K	27.9	Very low	27.9	Very low	175 Å²	175	140.6 Å²	140.6	76%	0.761	76%	0.764	S	S	*	*				35.8	138.2	113	-65.9	172.7	160.4	177	0	118.5
163	Q	31.7	Very low	28.8	Very low	131 Å²	131	139.7 Å²	139.7	61%	0.612	76%	0.761	S	S	*	*			cis	-164.4	169.2	5.6	-107.8	161.1	-110.5	0	0	105.5
164	H	29	Very low	28.7	Very low	147 Å²	147	143.3 Å²	143.3	68%	0.681	77%	0.766	S	S	*	*			cis	-159.7	-177.8	14.5	-120.2	-28	0	0	0	107.1
165	L	26.8	Very low	28.9	Very low	151 Å²	151	142.7 Å²	142.7	79%	0.791	76%	0.76	S	S	*	*			cis	-143.8	145.7	1.2	-130.6	174.3	0	0	0	106.8
166	G	24.3	Very low	28.7	Very low	68 Å²	68	145.3 Å²	145.3	70%	0.701	77%	0.765	S	S	*	*			trans	-120	-167.7	-169	0	0	0	0	0	115.6
167	L	25.6	Very low	28.7	Very low	167 Å²	167	142.8 Å²	142.8	87%	0.874	76%	0.758	S	S	*	*			trans	-81.7	160.1	177.8	-115.1	71.5	0	0	0	113.4
168	E	25.7	Very low	29.1	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	76%	0.756	S	S	*	*			trans	76	130.2	151.3	-74.3	-158.4	151	0	0	124.6
169	V	26.3	Very low	30.5	Very low	117 Å²	117	139.2 Å²	139.2	71%	0.709	75%	0.752	S	S	*	*			trans	63.7	117.2	135.6	179.9	0	0	0	0	121.4
170	I	24.3	Very low	31.1	Very low	170 Å²	170	140.5 Å²	140.5	87%	0.872	75%	0.753	S	S	*	*			trans	-160.6	154.7	139	-108.7	158.8	0	0	0	109.5
171	P	45	Very low	31.3	Very low	99 Å²	99	142 Å²	142	64%	0.643	75%	0.753	S	S	*	*			trans	-128.7	160.9	-142.1	42	-30	0	0	0	120
172	R	34.4	Very low	31.5	Very low	242 Å²	242	145.3 Å²	145.3	91%	0.913	76%	0.763	S	S	*	*			trans	66.9	167.1	150.6	-82.6	-177.2	174.7	-175.3	-0.6	118.5
173	P	45.2	Very low	31.5	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	76%	0.761	S	S	*	*			cis	-116.3	-150.6	-4.8	46.1	-33.3	0	0	0	110.9
174	R	27.7	Very low	31.1	Very low	204 Å²	204	145.1 Å²	145.1	77%	0.77	77%	0.768	S	S	*	*			cis	-157.9	123.5	-4.7	176.2	173.7	172.9	153.9	5.2	110.1
175	M	29.6	Very low	30.9	Very low	126 Å²	126	144.8 Å²	144.8	62%	0.621	77%	0.77	S	S	*	*			trans	59.3	150.7	163.7	-60.6	168.2	74.5	0	0	116.7
176	E	25.2	Very low	30.9	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	77%	0.771	S	S	*	*			cis	-163.2	175.2	-19.4	-113.3	152.6	-150.7	0	0	107.1
177	G	27.5	Very low	30.9	Very low	64 Å²	64	149.7 Å²	149.7	66%	0.66	78%	0.777	S	S	*	*			cis	-170.1	-158.1	7.7	0	0	0	0	0	111.7
178	S	33.2	Very low	31.8	Very low	123 Å²	123	147.5 Å²	147.5	86%	0.86	77%	0.773	S	S	*	*			trans	-167.9	-170.8	-175.8	-121.1	0	0	0	0	110
179	P	53.7	Low	31.8	Very low	111 Å²	111	146.5 Å²	146.5	72%	0.721	77%	0.768	S	S	*	*			cis	-142.2	-175.2	21	44.6	-25	0	0	0	117.6
180	N	40.6	Very low	31.8	Very low	161 Å²	161	148 Å²	148	86%	0.861	77%	0.767	S	S	*	*			trans	-98.9	157.5	155	-77.6	-45.7	0	0	0	110
181	F	26.7	Very low	31.9	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.794	77%	0.766	S	S	*	*			trans	-152.3	147.5	172.8	-155.9	-92.6	0	0	0	114.1	I183	F181-I183 HydrophobicContact CE1-CB 3.97Å; F181-I183 HydrophobicContact CE1-CG2 4.24Å; F181-I183 HydrophobicContact CZ-CB 4.31Å; F181-I183 HydrophobicContact CZ-CG2 4.42Å
182	L	30.1	Very low	30.9	Very low	157 Å²	157	146.3 Å²	146.3	82%	0.822	77%	0.771	S	S	*	*			trans	-159.7	119.1	165.3	-165.5	171.4	0	0	0	108.3
183	I	28.5	Very low	30.5	Very low	139 Å²	139	142.8 Å²	142.8	71%	0.713	77%	0.77	S	S	*	*			trans	-163.6	164.1	162.4	-111.8	160.3	0	0	0	110.6	F181	F181-I183 HydrophobicContact CE1-CB 3.97Å; F181-I183 HydrophobicContact CE1-CG2 4.24Å; F181-I183 HydrophobicContact CZ-CB 4.31Å; F181-I183 HydrophobicContact CZ-CG2 4.42Å
184	E	23.4	Very low	29.6	Very low	163 Å²	163	141.7 Å²	141.7	76%	0.762	77%	0.766	S	S	*	*			trans	-85.9	172.7	-158.8	-61.2	175.6	83	0	0	118.6
185	L	25.5	Very low	29.5	Very low	140 Å²	140	134.9 Å²	134.9	73%	0.733	76%	0.759	S	S	*	*				111.8	117.6	124.1	-103.5	162.3	0	0	0	121
186	T	25.6	Very low	29.3	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	77%	0.772	S	S	*	*			trans	104.5	138.2	146.1	-12.7	0	0	0	0	120.6
187	K	24.7	Very low	29.4	Very low	193 Å²	193	137.4 Å²	137.4	84%	0.839	77%	0.767	S	S	*	*			trans	-66.5	163	-174.9	-89.5	176.4	-178.5	179.1	0	114.5
188	P	44.4	Very low	29.3	Very low	120 Å²	120	141.3 Å²	141.3	78%	0.779	77%	0.772	S	S	*	*			cis	-136.1	-162.9	46.4	42.5	-22	0	0	0	114.6
189	E	25.8	Very low	29	Very low	149 Å²	149	140.6 Å²	140.6	70%	0.696	77%	0.768	S	S	*	*			cis	-149.5	-129.7	15.4	-142.1	-88.9	147.8	0	0	112.9
190	Q	27.3	Very low	27.8	Very low	147 Å²	147	146.3 Å²	146.3	69%	0.687	78%	0.775	S	S	*	*			trans	-95.6	174.6	-172.2	-68.2	178.6	62.9	0	0	113.8
191	L	25.7	Very low	27	Very low	161 Å²	161	144.3 Å²	144.3	84%	0.843	77%	0.772	S	S	*	*			cis	-158.3	153.7	28	-179.7	67.4	0	0	0	112.9
192	G	25.1	Very low	27	Very low	73 Å²	73	139.8 Å²	139.8	75%	0.753	77%	0.768	S	S	*	*			trans	120.8	130.5	159.3	0	0	0	0	0	116
193	N	24.9	Very low	26.9	Very low	168 Å²	168	138.7 Å²	138.7	90%	0.898	77%	0.767	S	S	*	*			trans	-155.5	168.2	-176.9	-167.2	14.2	0	0	0	112
194	S	26.6	Very low	26.8	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	77%	0.765	S	S	*	*			trans	73.1	147.7	-178.3	-154.5	0	0	0	0	115.2
195	G	25.4	Very low	27.1	Very low	61 Å²	61	134.4 Å²	134.4	63%	0.629	76%	0.763	S	S	*	*			cis	109.5	147.5	0.1	0	0	0	0	0	113.6
196	R	26	Very low	27.3	Very low	236 Å²	236	135.8 Å²	135.8	89%	0.891	77%	0.766	S	S	*	*			trans	81.9	152	-176	-63.6	-175	157.3	175.2	-6.9	115.4
197	T	26.7	Very low	27.3	Very low	110 Å²	110	133.2 Å²	133.2	68%	0.675	75%	0.753	S	S	*	*			cis	-162.1	147.3	-2.7	13.9	0	0	0	0	113.2
198	D	25.3	Very low	27.4	Very low	145 Å²	145	132.6 Å²	132.6	78%	0.775	75%	0.752	S	S	*	*			trans	39.3	150.8	136.5	-71	-47.2	0	0	0	127.7
199	S	27.8	Very low	26.6	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	75%	0.753	S	S	*	*			trans	82.2	95.9	141.3	-73	0	0	0	0	124.4
200	R	26.7	Very low	27.3	Very low	231 Å²	231	131.3 Å²	131.3	87%	0.872	76%	0.76	S	S	*	*				30.1	140.5	113.8	-128.6	-172.6	-64.4	-158.5	0.4	122.1
201	C	25	Very low	27.5	Very low	118 Å²	118	128.6 Å²	128.6	80%	0.797	76%	0.762	S	S	*	*			trans	72.3	156.5	160.9	-60.2	0	0	0	0	117.4
202	A	26.5	Very low	28.5	Very low	86 Å²	86	126 Å²	126	71%	0.711	76%	0.756	S	S	*	*			cis	-167.5	160.2	-27.9	0	0	0	0	0	107.3
203	V	27.1	Very low	28.6	Very low	134 Å²	134	131.3 Å²	131.3	81%	0.812	76%	0.76	S	S	*	*				169.2	160.1	92	159.5	0	0	0	0	109.3
204	S	27.9	Very low	28.7	Very low	94 Å²	94	126.9 Å²	126.9	66%	0.657	75%	0.747	S	S	*	*			trans	-56.1	164.1	-177	53.3	0	0	0	0	118.5
205	T	28.9	Very low	28.6	Very low	119 Å²	119	128.7 Å²	128.7	73%	0.73	75%	0.754	S	S	*	*				-175.5	169.8	89	34.8	0	0	0	0	112
206	H	30.3	Very low	28.5	Very low	169 Å²	169	131.5 Å²	131.5	78%	0.782	76%	0.764	S	S	*	*			cis	-140.2	-84.2	8.1	-146.2	-48.2	0	0	0	118.4
207	S	26.1	Very low	28.3	Very low	76 Å²	76	129.3 Å²	129.3	53%	0.531	76%	0.756	S	S	.	*			trans	-162.3	169.6	-156.6	49.4	0	0	0	0	111.2
208	H	26.6	Very low	28.1	Very low	179 Å²	179	134 Å²	134	83%	0.829	76%	0.761	S	S	*	*			cis	-140.6	167.8	22.2	-80	-91.3	0	0	0	114.4
209	S	26.5	Very low	28.1	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	76%	0.763	S	S	*	*			trans	-97.5	175.9	168.2	-38.7	0	0	0	0	111.5
210	P	41.6	Very low	27.9	Very low	129 Å²	129	137 Å²	137	84%	0.838	76%	0.762	S	S	*	*				-147.9	176	68.9	40.4	-20.8	0	0	0	117
211	A	30.6	Very low	27.8	Very low	90 Å²	90	134.6 Å²	134.6	74%	0.744	76%	0.761	S	S	*	*			trans	-105.3	176.6	161.3	0	0	0	0	0	110
212	P	46.1	Very low	27.8	Very low	108 Å²	108	134.3 Å²	134.3	70%	0.701	76%	0.756	S	S	*	*				-159.5	173.1	89.6	41.4	-21.3	0	0	0	118.4
213	H	28.6	Very low	27.9	Very low	183 Å²	183	136.4 Å²	136.4	85%	0.847	76%	0.762	S	S	*	*			trans	43.1	151	144	-64.9	-44.8	0	0	0	123.6
214	A	26.6	Very low	27.7	Very low	76 Å²	76	136.2 Å²	136.2	63%	0.628	76%	0.761	S	S	*	*			cis	-168.3	157.9	-14	0	0	0	0	0	114.4
215	T	24.1	Very low	27.6	Very low	137 Å²	137	137.6 Å²	137.6	84%	0.84	77%	0.771	S	S	*	*			trans	34.4	116.3	150	55.5	0	0	0	0	124.6
216	S	23.7	Very low	27.4	Very low	120 Å²	120	140.9 Å²	140.9	84%	0.839	78%	0.778	S	S	*	*			trans	179.3	154.6	140	42.9	0	0	0	0	109.9
217	R	22.5	Very low	28.5	Very low	189 Å²	189	137.5 Å²	137.5	71%	0.713	77%	0.771	S	S	*	*			cis	113.8	128.4	-15.8	-153.7	-179.8	-130.6	-71.7	0.1	118.4
218	W	22.6	Very low	28.9	Very low	208 Å²	208	139.9 Å²	139.9	79%	0.788	78%	0.784	S	S	*	*			trans	71.9	156.2	-177	-51.5	113.5	0	0	0	114.3
219	Q	23.7	Very low	28.7	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	78%	0.78	S	S	*	*			cis	-147.7	167.6	18	-158.7	166.2	5	0	0	112.9
220	I	24.7	Very low	28.7	Very low	146 Å²	146	146.6 Å²	146.6	75%	0.749	79%	0.787	S	S	*	*			trans	-107.8	144.4	175.7	-64.5	167.2	0	0	0	109.5
221	Q	24.1	Very low	27.8	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	78%	0.776	S	S	*	*			trans	-138.5	140.8	158.2	-72.8	-167.4	-12.1	0	0	112.2
222	T	25.7	Very low	27.6	Very low	112 Å²	112	149.3 Å²	149.3	69%	0.687	78%	0.776	S	S	*	*			trans	-95.9	-179	165.4	51.3	0	0	0	0	109.8
223	P	28.7	Very low	26.7	Very low	130 Å²	130	150.1 Å²	150.1	84%	0.844	78%	0.779	S	S	*	*				-140.2	165.7	106.1	38.1	-27.1	0	0	0	114.6
224	T	22.1	Very low	26.6	Very low	129 Å²	129	145.6 Å²	145.6	79%	0.791	77%	0.773	S	S	*	*			trans	-142.5	131.1	177.9	46.1	0	0	0	0	111.4
225	S	25.8	Very low	26.6	Very low	123 Å²	123	146.5 Å²	146.5	86%	0.86	78%	0.78	S	S	*	*			trans	-170.8	132.5	161.8	51.9	0	0	0	0	113.1
226	E	24.7	Very low	26.7	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	78%	0.777	S	S	*	*			trans	-124.8	-176.3	163.3	-73.8	-164	152.7	0	0	108
227	P	53	Low	26.9	Very low	99 Å²	99	147.4 Å²	147.4	64%	0.643	77%	0.772	S	S	*	*			cis	-116.6	-158.8	-48.3	30.4	-12.3	0	0	0	109.4
228	P	34.2	Very low	27.1	Very low	125 Å²	125	146.2 Å²	146.2	81%	0.812	77%	0.774	S	S	*	*				-148.6	174.7	99.2	38.5	-21.4	0	0	0	116.7
229	Y	23.5	Very low	27.4	Very low	189 Å²	189	141.3 Å²	141.3	74%	0.741	77%	0.768	S	S	*	*			trans	-68.9	161.1	-177.6	-72.7	-107.4	0	0	0	116	L231	Y229-L231 HydrophobicContact CD1-CD1 4.22Å
230	W	26.4	Very low	27.5	Very low	244 Å²	244	140.4 Å²	140.4	92%	0.924	77%	0.769	S	S	*	*				-146.8	141.5	127.7	-91.1	106	0	0	0	111.9
231	L	23.1	Very low	27.6	Very low	119 Å²	119	137.8 Å²	137.8	62%	0.623	77%	0.769	S	S	*	*			trans	-83.9	158.5	163.5	-77.8	69	0	0	0	109	Y229	Y229-L231 HydrophobicContact CD1-CD1 4.22Å
232	H	25.7	Very low	27.8	Very low	158 Å²	158	139 Å²	139	73%	0.731	77%	0.772	S	S	*	*				162.6	154.1	100.3	-92.3	-73.2	0	0	0	108.4
233	T	26.5	Very low	28.5	Very low	124 Å²	124	139.5 Å²	139.5	76%	0.761	78%	0.777	S	S	*	*			cis	-149.4	161	-7.1	-76.1	0	0	0	0	107.5
234	A	26.8	Very low	28.3	Very low	88 Å²	88	139.6 Å²	139.6	73%	0.727	78%	0.775	S	S	*	*			trans	-91.4	155.8	180	0	0	0	0	0	115.3
235	A	26.8	Very low	28.6	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	77%	0.774	S	S	*	*			trans	-152.4	117.2	150.8	0	0	0	0	0	106.9
236	M	27.2	Very low	28.6	Very low	158 Å²	158	138.7 Å²	138.7	78%	0.778	77%	0.774	S	S	*	*				83.3	113.2	57.6	-75.7	-70.7	159.8	0	0	114.1
237	T	27.6	Very low	28.7	Very low	118 Å²	118	139.5 Å²	139.5	72%	0.724	77%	0.77	S	S	*	*			trans	57.4	157.2	146.9	54.1	0	0	0	0	120.3
238	E	26.8	Very low	27.5	Very low	164 Å²	164	143.2 Å²	143.2	77%	0.766	78%	0.779	S	S	*	*			cis	-170.1	168.3	-32.3	-164.2	163.7	-158.5	0	0	106.7
239	T	28.6	Very low	27.2	Very low	106 Å²	106	140.5 Å²	140.5	65%	0.65	77%	0.774	S	S	*	*			trans	57.4	135.6	154.8	27.6	0	0	0	0	123.7
240	D	25.7	Very low	27.7	Very low	154 Å²	154	139 Å²	139	82%	0.824	78%	0.777	S	S	*	*			trans	95.8	155.8	131.7	-75.3	-22.5	0	0	0	124.9
241	A	27.5	Very low	27.9	Very low	91 Å²	91	136.2 Å²	136.2	75%	0.752	78%	0.775	S	S	*	*			trans	74.2	88.7	166.3	0	0	0	0	0	119.5
242	F	28.4	Very low	28.3	Very low	206 Å²	206	137.6 Å²	137.6	90%	0.904	78%	0.783	S	S	*	*			trans	-63.1	154.1	134.3	-78.5	-89.5	0	0	0	109.5
243	P	38.8	Very low	28.6	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	79%	0.787	S	S	*	*				-133.7	164.5	112.1	37.8	-30.6	0	0	0	115.4
244	T	26.1	Very low	29	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	79%	0.789	S	S	*	*			trans	-83.6	161.4	-167.6	-27	0	0	0	0	114.6
245	S	26.8	Very low	29.1	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	80%	0.796	S	S	*	*			trans	77.2	112.8	140.9	-175	0	0	0	0	120.8
246	S	26.1	Very low	29.7	Very low	123 Å²	123	145.2 Å²	145.2	86%	0.86	80%	0.796	S	S	*	*				-145.1	153.6	129.5	58.7	0	0	0	0	110.2
247	Y	26.9	Very low	30	Very low	204 Å²	204	146.9 Å²	146.9	80%	0.8	80%	0.802	S	S	*	*			trans	-113.7	170.7	-168.5	-167.6	-106.4	0	0	0	111.6
248	E	28.8	Very low	30.5	Very low	177 Å²	177	152.5 Å²	152.5	83%	0.827	81%	0.81	S	S	*	*			trans	63.5	155.6	178.9	-84.8	154.7	-152.9	0	0	117.2
249	G	28.5	Very low	30.6	Very low	69 Å²	69	152.5 Å²	152.5	71%	0.711	82%	0.815	S	S	*	*			cis	-158.4	176	2.9	0	0	0	0	0	113.7
250	I	32.8	Very low	31.1	Very low	157 Å²	157	152.1 Å²	152.1	81%	0.805	82%	0.815	S	S	*	*			trans	-84.4	135.6	-171.4	-63.1	162	0	0	0	112.1
251	Q	30.9	Very low	31.7	Very low	185 Å²	185	150.1 Å²	150.1	86%	0.864	81%	0.813	S	S	*	*			trans	-158.6	140.4	141	-117	160.9	65.2	0	0	114.1
252	N	31.7	Very low	32.5	Very low	148 Å²	148	150.4 Å²	150.4	79%	0.791	81%	0.807	S	S	*	*			trans	-87.3	138.4	169.2	-72.7	-58.3	0	0	0	109.4
253	H	31.3	Very low	32.8	Very low	180 Å²	180	150.1 Å²	150.1	83%	0.833	81%	0.806	S	S	*	*			trans	-145.4	119.1	151.9	-123.5	-81.2	0	0	0	112.5
254	T	34.4	Very low	32.7	Very low	130 Å²	130	149.6 Å²	149.6	80%	0.798	81%	0.805	S	S	*	*			trans	-85.1	116.1	169.8	48.6	0	0	0	0	109.9
255	Q	30.1	Very low	33	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	80%	0.799	S	S	*	*			trans	-154.1	146.3	143.9	-126.7	171.7	9.8	0	0	114
256	T	39.9	Very low	33.6	Very low	129 Å²	129	152.3 Å²	152.3	79%	0.791	80%	0.801	S	S	*	*			trans	-77.2	137	176.5	47.9	0	0	0	0	111.8
257	Q	32.2	Very low	34.5	Very low	193 Å²	193	152.5 Å²	152.5	90%	0.902	80%	0.799	S	S	*	*			trans	-129.4	145.5	141.1	-72.3	-155.4	10.6	0	0	110.7
258	R	39	Very low	35.5	Very low	236 Å²	236	146.2 Å²	146.2	89%	0.891	80%	0.797	S	S	*	*			trans	-107.6	150.7	165.3	-66	176.3	178.6	159.4	-0.9	107.3
259	N	28.3	Very low	36.2	Very low	164 Å²	164	145.2 Å²	145.2	88%	0.877	80%	0.796	S	S	*	*			trans	-134.7	152.6	144.7	-114	-9.2	0	0	0	109.4
260	P	39.4	Very low	37.4	Very low	98 Å²	98	150 Å²	150	64%	0.636	80%	0.8	S	S	*	*			trans	-129.1	160.8	-151.9	40.5	-25.7	0	0	0	116.6
261	S	38.4	Very low	38.6	Very low	113 Å²	113	147.3 Å²	147.3	79%	0.79	79%	0.793	S	S	*	*			trans	66.1	174.1	155.6	79.7	0	0	0	0	116
262	P	44.9	Very low	40.4	Very low	96 Å²	96	145.6 Å²	145.6	62%	0.623	79%	0.785	S	S	*	*			cis	-106.6	171.7	-8.3	40	-29.3	0	0	0	112.6
263	F	33.6	Very low	42.9	Very low	200 Å²	200	146.3 Å²	146.3	88%	0.877	78%	0.777	S	S	*	*			cis	-130.5	153.3	17.5	-77.7	-97.8	0	0	0	113.7
264	S	37.8	Very low	45.8	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	77%	0.766	S	S	*	*			trans	-84.7	160.4	166.9	-56.8	0	0	0	0	110.6
265	T	32.4	Very low	48.8	Very low	109 Å²	109	137.6 Å²	137.6	67%	0.669	73%	0.729	S	S	*	*				178.9	141.8	80.3	-56.2	0	0	0	0	105.8
266	F	39.2	Very low	51.8	Low	191 Å²	191	132.6 Å²	132.6	84%	0.838	71%	0.711	S	S	*	*			cis	-131.7	157.8	32.2	-71.2	-100.4	0	0	0	113.4
267	P	43.8	Very low	54.5	Low	126 Å²	126	126.4 Å²	126.4	82%	0.818	67%	0.673	S	S	*	*			trans	-87.1	133.9	166.9	34.4	-31	0	0	0	112.1
268	G	47.9	Very low	57.5	Low	72 Å²	72	117.4 Å²	117.4	74%	0.742	63%	0.631	S	S	*	*			trans	154.2	-48.6	164.3	0	0	0	0	0	116.2	Q270	G268-Q270 PolarHBondContact O-N 3.31Å
269	L	44.6	Very low	60	Low	156 Å²	156	108.3 Å²	108.3	82%	0.817	61%	0.61	S	S	*	*			trans	-79.5	116	-176.5	-93.1	66.3	0	0	0	111.6
270	Q	53.7	Low	63.2	Low	170 Å²	170	101.6 Å²	101.6	79%	0.794	58%	0.575	S	S	*	*			trans	-63.2	146	157.4	-64.7	-165.7	14	0	0	109.3	G268 Q272	G268-Q270 PolarHBondContact O-N 3.31Å; Q270-Q272 PolarHBondContact O-N 3.16Å
271	P	57.2	Low	65.9	Low	100 Å²	100	103.8 Å²	103.8	65%	0.649	58%	0.576	S	S	*	*			trans	-62.9	107.7	178.9	25.3	-34	0	0	0	110.1	R273	P271-R273 PolarHBondContact O-N 3.36Å; P271-R273 VanDerWaalsContact O-N 3.1Å
272	Q	68.8	Low	68.5	Low	149 Å²	149	99 Å²	99	70%	0.696	54%	0.544	S	S	*	.			trans	-55.1	116.6	-174.5	-72.2	-176.1	-7	0	0	110.5	Q270 M274	Q270-Q272 PolarHBondContact O-N 3.16Å; Q272-M274 PolarHBondContact O-N 3.03Å
273	R	84.1	Confident	70.7	Confident	164 Å²	164	98.2 Å²	98.2	62%	0.619	54%	0.541	S	S	*	.			trans	-78.5	108.3	-180	-61.9	-56.2	-158.6	173.5	8.2	108.3	P271 A282 L290	P271-R273 PolarHBondContact O-N 3.36Å; P271-R273 VanDerWaalsContact O-N 3.1Å; R273-A282 HydrophobicContact CB-CB 4.19Å; R273-A282 VanDerWaalsContact O-CB 3.26Å; R273-A282 WeakPolarHBondContact O-CB 3.46Å; R273-A282 PolarHBondContact O-N 3.15Å; R273-L290 HydrophobicContact CB-CD1 4.26Å; R273-L290 HydrophobicContact CB-CD2 4.26Å
274	M	93.4	Very high	73.3	Confident	124 Å²	124	90 Å²	90	61%	0.611	51%	0.513	S	S	*	.	B	Isolated β-bridge	trans	-90.5	145.7	177.2	-70.2	-169.3	-75.1	0	0	112.5	Q272 V276	Q272-M274 PolarHBondContact O-N 3.03Å; M274-V276 PolarHBondContact O-N 3.01Å
275	C	95.8	Very high	75.7	Confident	2 Å²	2	89.2 Å²	89.2	1%	0.014	51%	0.506	C	S	.	.			trans	-75.3	113.4	177.2	174.3	0	0	0	0	110.5	I277 C278 G279 D280 A282 C292	C275-I277 PolarHBondContact O-N 3.49Å; C275-C278 PolarHBondContact O-N 3.32Å; C275-G279 PolarHBondContact O-N 2.85Å; C275-D280 WeakPolarHBondContact CA-O 3.3Å; C275-D280 WeakPolarHBondContact CB-O 3.36Å; C275-D280 PolarHBondContact N-O 3.35Å; C275-A282 HydrophobicContact CB-CB 4.4Å; C275-C292 HydrophobicContact CB-CB 3.84Å; C275-C292 PolarHBondContact SG-N 2.69Å; C275-C292 VanDerWaalsContact SG-SG 3.66Å
276	V	93.6	Very high	78.4	Confident	81 Å²	81	85.4 Å²	85.4	49%	0.491	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.2	-176.7	-56.9	0	0	0	0	113.7	M274 V289 L290 K334 A338	M274-V276 PolarHBondContact O-N 3.01Å; V276-V289 HydrophobicContact CG2-CG1 3.41Å; V276-V289 VanDerWaalsContact CG2-CG1 3.41Å; V276-L290 PolarHBondContact N-O 3.35Å; V276-K334 WeakPolarHBondContact O-CE 3.19Å; V276-A338 HydrophobicContact CG2-CB 3.92Å
277	I	96.4	Very high	80.9	Confident	0 Å²	0	79 Å²	79	0%	0	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-36.8	176.6	-48.8	-55	0	0	0	112.6	C275 T291 C295 V319 R331 K334 A338 M340	C275-I277 PolarHBondContact O-N 3.49Å; I277-T291 HydrophobicContact CG1-CG2 3.74Å; I277-C295 HydrophobicContact CB-CB 4.4Å; I277-C295 HydrophobicContact CG1-CB 4.36Å; I277-V319 HydrophobicContact CG2-CG1 4.26Å; I277-V319 WeakPolarHBondContact O-CG1 2.99Å; I277-R331 HydrophobicContact CG2-CG 4.39Å; I277-K334 HydrophobicContact CD1-CG 4.5Å; I277-K334 WeakPolarHBondContact CD1-O 3.28Å; I277-K334 HydrophobicContact CG2-CG 4.44Å; I277-K334 VanDerWaalsContact O-CD 3.28Å; I277-K334 WeakPolarHBondContact O-CD 3.3Å; I277-K334 WeakPolarHBondContact O-CE 3.08Å; I277-K334 PolarHBondContact O-NZ 2.78Å; I277-A338 HydrophobicContact CD1-CB 3.49Å; I277-A338 VanDerWaalsContact CD1-CB 3.49Å; I277-M340 HydrophobicContact CD1-SD 4.21Å; I277-M340 HydrophobicContact CG1-SD 4.21Å
278	C	95.4	Very high	82.6	Confident	4 Å²	4	76.4 Å²	76.4	3%	0.027	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151.5	10.8	-166.1	68.6	0	0	0	0	116.8	C275 D280 C292 C295 V319 D320 K321 R324	C275-C278 PolarHBondContact O-N 3.32Å; C278-D280 PolarHBondContact O-N 2.75Å; C278-C292 VanDerWaalsContact SG-SG 3.63Å; C278-C295 VanDerWaalsContact SG-SG 3.62Å; C278-V319 HydrophobicContact CB-CG1 4.14Å; C278-D320 CarbonylContact O-C 3.26Å; C278-D320 VanDerWaalsContact O-C 3.26Å; C278-D320 VanDerWaalsContact O-CA 3.3Å; C278-D320 WeakPolarHBondContact O-CA 3.31Å; C278-K321 PolarHBondContact O-N 2.8Å; C278-R324 HydrophobicContact CB-CB 4.43Å; C278-R324 PolarHBondContact SG-NH1 2.94Å; C278-R324 VanDerWaalsContact SG-NH1 3.36Å
279	G	92.1	Very high	84.6	Confident	44 Å²	44	73.6 Å²	73.6	45%	0.454	42%	0.416	S	S	.	.	S	Bend	trans	71.1	-17.7	178.7	0	0	0	0	0	115.8	C275	C275-G279 PolarHBondContact O-N 2.85Å
280	D	95.1	Very high	86.8	Confident	23 Å²	23	68.5 Å²	68.5	12%	0.123	39%	0.389	C	S	.	.	S	Bend	trans	-60.9	160.4	175.3	-163.7	18.5	0	0	0	112.6	C275 C278 A282 C292 K321 R324	C275-D280 WeakPolarHBondContact CA-O 3.3Å; C275-D280 WeakPolarHBondContact CB-O 3.36Å; C275-D280 PolarHBondContact N-O 3.35Å; C278-D280 PolarHBondContact O-N 2.75Å; D280-A282 PolarHBondContact O-N 3.28Å; D280-C292 HydrophobicContact CB-CB 4.14Å; D280-K321 HydrophobicContact CB-CB 4.13Å; D280-K321 HydrophobicContact CB-CD 4.15Å; D280-K321 HydrophobicContact CB-CG 4.01Å; D280-K321 VanDerWaalsContact OD1-CD 3.23Å; D280-K321 WeakPolarHBondContact OD1-CD 3.24Å; D280-K321 WeakPolarHBondContact OD1-CE 3.46Å; D280-K321 IonicContact OD1-NZ 2.69Å; D280-K321 PolarHBondContact OD1-NZ 2.87Å; D280-R324 IonicContact OD2-CZ 3.63Å; D280-R324 IonicContact OD2-NH1 2.68Å; D280-R324 PolarHBondContact OD2-NH1 3.44Å; D280-R324 IonicContact OD2-NH2 3.58Å; D280-R324 PolarHBondContact OD2-NH2 3.24Å
281	E	95	Very high	88.8	Confident	145 Å²	145	60.4 Å²	60.4	68%	0.678	35%	0.351	S	S	*	.	B	Isolated β-bridge	trans	-61.3	128.7	-176	-170.2	172.3	-162.7	0	0	112	C292	E281-C292 VanDerWaalsContact O-CA 3.3Å; E281-C292 WeakPolarHBondContact O-CA 3.06Å; E281-C292 WeakPolarHBondContact O-CB 3.35Å
282	A	93.8	Very high	90.7	Very high	13 Å²	13	55.8 Å²	55.8	11%	0.107	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-89.3	119.1	-176.7	0	0	0	0	0	111.5	R273 C275 D280 G284 L290 T291	R273-A282 HydrophobicContact CB-CB 4.19Å; R273-A282 VanDerWaalsContact O-CB 3.26Å; R273-A282 WeakPolarHBondContact O-CB 3.46Å; R273-A282 PolarHBondContact O-N 3.15Å; C275-A282 HydrophobicContact CB-CB 4.4Å; D280-A282 PolarHBondContact O-N 3.28Å; A282-G284 PolarHBondContact O-N 3.14Å; A282-G284 VanDerWaalsContact O-N 3.17Å; A282-L290 HydrophobicContact CB-CD1 3.66Å; A282-L290 HydrophobicContact CB-CG 3.73Å; A282-T291 WeakPolarHBondContact CA-O 3.32Å
283	S	91.3	Very high	91.9	Very high	79 Å²	79	50.2 Å²	50.2	55%	0.552	30%	0.303	S	S	*	.			trans	-83.6	21	177.2	59.3	0	0	0	0	113.4	H286 T291 G293	S283-H286 PolarHBondContact O-NE2 3.39Å; S283-H286 PolarHBondContact OG-NE2 2.81Å; S283-H286 VanDerWaalsContact OG-NE2 3.15Å; S283-T291 PolarHBondContact N-O 2.68Å; S283-T291 VanDerWaalsContact N-O 3.1Å; S283-G293 PolarHBondContact OG-N 2.89Å
284	G	87.9	Confident	92.5	Very high	28 Å²	28	44.6 Å²	44.6	29%	0.289	29%	0.289	S	S	.	.	S	Bend	trans	120.5	-174.4	179.2	0	0	0	0	0	114.4	A282 H286 T291	A282-G284 PolarHBondContact O-N 3.14Å; A282-G284 VanDerWaalsContact O-N 3.17Å; G284-H286 PolarHBondContact O-CD2 2.97Å; G284-H286 VanDerWaalsContact O-CD2 3.31Å; G284-T291 PolarHBondContact O-N 2.94Å
285	C	87.6	Confident	92.6	Very high	94 Å²	94	38.7 Å²	38.7	64%	0.635	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	115.5	174.3	-60.8	0	0	0	0	109.9	V289	C285-V289 CarbonylContact C-O 3.59Å; C285-V289 WeakPolarHBondContact CA-O 3.47Å
286	H	90.3	Very high	92.7	Very high	28 Å²	28	42.3 Å²	42.3	13%	0.13	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136	175.4	-49.5	-80.3	0	0	0	108.6	S283 G284 G288 V289 T291 K296	S283-H286 PolarHBondContact O-NE2 3.39Å; S283-H286 PolarHBondContact OG-NE2 2.81Å; S283-H286 VanDerWaalsContact OG-NE2 3.15Å; G284-H286 PolarHBondContact O-CD2 2.97Å; G284-H286 VanDerWaalsContact O-CD2 3.31Å; H286-G288 PolarHBondContact O-N 2.79Å; H286-G288 VanDerWaalsContact O-N 3.16Å; H286-V289 PolarHBondContact N-O 2.85Å; H286-V289 PolarHBondContact O-N 3.13Å; H286-V289 VanDerWaalsContact O-O 3.11Å; H286-T291 PolarHBondContact CD2-O 3.45Å; H286-T291 PolarHBondContact CD2-OG1 3.48Å; H286-K296 HydrophobicContact CB-CB 4.04Å; H286-K296 HydrophobicContact CB-CD 4.19Å; H286-K296 HydrophobicContact CB-CG 3.87Å; H286-K296 PolarHBondContact CE1-NZ 2.97Å; H286-K296 WeakPolarHBondContact ND1-CD 3.45Å; H286-K296 WeakPolarHBondContact ND1-CE 3.4Å; H286-K296 PolarHBondContact ND1-NZ 3.32Å
287	Y	90.4	Very high	92.7	Very high	57 Å²	57	41.9 Å²	41.9	22%	0.224	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	28.7	-179.2	-55.1	-69.5	0	0	0	114.5	K296 F299 K300 M340 M341 L342	Y287-K296 HydrophobicContact CD2-CG 4.37Å; Y287-K296 HydrophobicContact CE2-CB 4.46Å; Y287-K296 HydrophobicContact CE2-CG 3.7Å; Y287-K296 WeakPolarHBondContact CE2-O 3.48Å; Y287-F299 HydrophobicContact CD1-CD1 4.41Å; Y287-F299 HydrophobicContact CD1-CE1 4.49Å; Y287-F299 AromaticContact CD2-CD1 3.78Å; Y287-F299 HydrophobicContact CD2-CD1 3.78Å; Y287-F299 HydrophobicContact CE2-CD1 4.32Å; Y287-F299 AromaticContact CG-CD1 3.82Å; Y287-F299 HydrophobicContact CG-CD1 3.82Å; Y287-F299 HydrophobicContact CG-CE1 4.12Å; Y287-K300 HydrophobicContact CE2-CB 4.46Å; Y287-K300 WeakPolarHBondContact OH-CB 3.06Å; Y287-K300 WeakPolarHBondContact OH-CG 3.15Å; Y287-M340 HydrophobicContact CD2-CE 3.75Å; Y287-M340 HydrophobicContact CG-CE 4.33Å; Y287-M340 WeakPolarHBondContact O-CA 3.4Å; Y287-M341 WeakPolarHBondContact CB-O 3.44Å; Y287-M341 WeakPolarHBondContact CD1-O 3.32Å; Y287-M341 PolarHBondContact O-N 2.92Å; Y287-L342 HydrophobicContact CD1-CD1 3.73Å; Y287-L342 HydrophobicContact CD1-CG 4.17Å; Y287-L342 HydrophobicContact CE1-CD1 3.62Å; Y287-L342 HydrophobicContact CE1-CG 3.86Å; Y287-L342 HydrophobicContact CG-CD1 4.44Å
288	G	81.2	Confident	92.7	Very high	71 Å²	71	43.3 Å²	43.3	73%	0.732	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.6	-18.1	-176.2	0	0	0	0	0	114.8	H286	H286-G288 PolarHBondContact O-N 2.79Å; H286-G288 VanDerWaalsContact O-N 3.16Å
289	V	89.2	Confident	92.7	Very high	14 Å²	14	43.2 Å²	43.2	9%	0.085	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.5	-160.8	-170.9	0	0	0	0	112.7	V276 C285 H286 T291 A338 G339 M340	V276-V289 HydrophobicContact CG2-CG1 3.41Å; V276-V289 VanDerWaalsContact CG2-CG1 3.41Å; C285-V289 CarbonylContact C-O 3.59Å; C285-V289 WeakPolarHBondContact CA-O 3.47Å; H286-V289 PolarHBondContact N-O 2.85Å; H286-V289 PolarHBondContact O-N 3.13Å; H286-V289 VanDerWaalsContact O-O 3.11Å; V289-T291 HydrophobicContact CB-CG2 4.11Å; V289-T291 HydrophobicContact CG1-CG2 3.93Å; V289-T291 PolarHBondContact O-N 3.28Å; V289-T291 PolarHBondContact O-OG1 3.36Å; V289-A338 HydrophobicContact CG1-CB 3.95Å; V289-A338 WeakPolarHBondContact CG2-O 3.46Å; V289-G339 VanDerWaalsContact CG2-C 3.44Å; V289-M340 HydrophobicContact CB-CG 3.77Å; V289-M340 HydrophobicContact CG1-CG 4.39Å; V289-M340 HydrophobicContact CG2-CB 4.25Å; V289-M340 HydrophobicContact CG2-CG 3.49Å; V289-M340 VanDerWaalsContact CG2-CG 3.49Å
290	L	91.6	Very high	92.7	Very high	49 Å²	49	45.2 Å²	45.2	26%	0.257	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	105.6	175.9	-176.5	64	0	0	0	111.1	R273 V276 A282	R273-L290 HydrophobicContact CB-CD1 4.26Å; R273-L290 HydrophobicContact CB-CD2 4.26Å; V276-L290 PolarHBondContact N-O 3.35Å; A282-L290 HydrophobicContact CB-CD1 3.66Å; A282-L290 HydrophobicContact CB-CG 3.73Å
291	T	95	Very high	92.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.3	C	S	.	.			trans	-143.9	153.5	-168.2	50.4	0	0	0	0	114.4	I277 A282 S283 G284 H286 V289 M340	I277-T291 HydrophobicContact CG1-CG2 3.74Å; A282-T291 WeakPolarHBondContact CA-O 3.32Å; S283-T291 PolarHBondContact N-O 2.68Å; S283-T291 VanDerWaalsContact N-O 3.1Å; G284-T291 PolarHBondContact O-N 2.94Å; H286-T291 PolarHBondContact CD2-O 3.45Å; H286-T291 PolarHBondContact CD2-OG1 3.48Å; V289-T291 HydrophobicContact CB-CG2 4.11Å; V289-T291 HydrophobicContact CG1-CG2 3.93Å; V289-T291 PolarHBondContact O-N 3.28Å; V289-T291 PolarHBondContact O-OG1 3.36Å; T291-M340 HydrophobicContact CG2-CE 4.19Å; T291-M340 HydrophobicContact CG2-SD 3.97Å
292	C	96.8	Very high	92.4	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	27%	0.269	C	S	.	.			trans	-74.2	154.9	171.6	73.7	0	0	0	0	111.3	C275 C278 D280 E281 S294 C295 K296 R324	C275-C292 HydrophobicContact CB-CB 3.84Å; C275-C292 PolarHBondContact SG-N 2.69Å; C275-C292 VanDerWaalsContact SG-SG 3.66Å; C278-C292 VanDerWaalsContact SG-SG 3.63Å; D280-C292 HydrophobicContact CB-CB 4.14Å; E281-C292 VanDerWaalsContact O-CA 3.3Å; E281-C292 WeakPolarHBondContact O-CA 3.06Å; E281-C292 WeakPolarHBondContact O-CB 3.35Å; C292-S294 PolarHBondContact O-N 2.73Å; C292-S294 VanDerWaalsContact O-N 3.12Å; C292-S294 PolarHBondContact SG-OG 3.13Å; C292-C295 PolarHBondContact O-N 3.12Å; C292-C295 PolarHBondContact SG-N 3.22Å; C292-C295 VanDerWaalsContact SG-SG 3.6Å; C292-K296 PolarHBondContact O-N 3.08Å; C292-K296 VanDerWaalsContact O-N 3.13Å; C292-R324 PolarHBondContact SG-NH1 3.35Å
293	G	95.2	Very high	92.1	Very high	32 Å²	32	46.7 Å²	46.7	33%	0.33	27%	0.274	S	S	.	.	H	α-helix	trans	-55.2	-32.4	180	0	0	0	0	0	114.4	S283 K296 V297	S283-G293 PolarHBondContact OG-N 2.89Å; G293-K296 WeakPolarHBondContact O-CB 3.5Å; G293-V297 WeakPolarHBondContact O-CG2 3.32Å; G293-V297 PolarHBondContact O-N 3.13Å; G293-V297 VanDerWaalsContact O-N 3.13Å
294	S	95.3	Very high	91.8	Very high	46 Å²	46	47.6 Å²	47.6	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-71.4	-33.8	177.8	87.8	0	0	0	0	113.1	C292 F298 R324 R331	C292-S294 PolarHBondContact O-N 2.73Å; C292-S294 VanDerWaalsContact O-N 3.12Å; C292-S294 PolarHBondContact SG-OG 3.13Å; S294-F298 WeakPolarHBondContact O-CB 3.13Å; S294-F298 PolarHBondContact O-N 3.01Å; S294-R324 PolarHBondContact OG-NH1 2.98Å; S294-R331 VanDerWaalsContact C-NH2 3.32Å; S294-R331 PolarHBondContact O-NH2 2.99Å; S294-R331 PolarHBondContact OG-NH2 3.26Å
295	C	96.9	Very high	91.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-75.1	-34.9	175.7	-70.4	0	0	0	0	111.9	I277 C278 C292 F299 R331	I277-C295 HydrophobicContact CB-CB 4.4Å; I277-C295 HydrophobicContact CG1-CB 4.36Å; C278-C295 VanDerWaalsContact SG-SG 3.62Å; C292-C295 PolarHBondContact O-N 3.12Å; C292-C295 PolarHBondContact SG-N 3.22Å; C292-C295 VanDerWaalsContact SG-SG 3.6Å; C295-F299 VanDerWaalsContact O-CB 3.22Å; C295-F299 WeakPolarHBondContact O-CB 3.44Å; C295-F299 PolarHBondContact O-N 2.91Å; C295-R331 PolarHBondContact SG-NH2 3.45Å
296	K	95.9	Very high	90.3	Very high	79 Å²	79	52 Å²	52	34%	0.343	28%	0.284	S	S	.	.	H	α-helix	trans	-53.2	-57.4	168.2	175.8	-168.4	-168.3	152.6	0	111.6	H286 Y287 C292 G293 F299 K300	H286-K296 HydrophobicContact CB-CB 4.04Å; H286-K296 HydrophobicContact CB-CD 4.19Å; H286-K296 HydrophobicContact CB-CG 3.87Å; H286-K296 PolarHBondContact CE1-NZ 2.97Å; H286-K296 WeakPolarHBondContact ND1-CD 3.45Å; H286-K296 WeakPolarHBondContact ND1-CE 3.4Å; H286-K296 PolarHBondContact ND1-NZ 3.32Å; Y287-K296 HydrophobicContact CD2-CG 4.37Å; Y287-K296 HydrophobicContact CE2-CB 4.46Å; Y287-K296 HydrophobicContact CE2-CG 3.7Å; Y287-K296 WeakPolarHBondContact CE2-O 3.48Å; C292-K296 PolarHBondContact O-N 3.08Å; C292-K296 VanDerWaalsContact O-N 3.13Å; G293-K296 WeakPolarHBondContact O-CB 3.5Å; K296-F299 PolarHBondContact O-N 3.17Å; K296-K300 PolarHBondContact O-N 2.75Å; K296-K300 VanDerWaalsContact O-N 3.08Å
297	V	95.1	Very high	89.4	Confident	71 Å²	71	54.8 Å²	54.8	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-68.9	-38.9	-175.5	176.3	0	0	0	0	111.7	G293 R301	G293-V297 WeakPolarHBondContact O-CG2 3.32Å; G293-V297 PolarHBondContact O-N 3.13Å; G293-V297 VanDerWaalsContact O-N 3.13Å; V297-R301 WeakPolarHBondContact O-CG 3.1Å; V297-R301 PolarHBondContact O-N 3.41Å
298	F	96.1	Very high	88.7	Confident	30 Å²	30	57.5 Å²	57.5	13%	0.132	32%	0.324	C	S	.	.	H	α-helix	trans	-58.8	-50.6	173.3	170.7	-98.9	0	0	0	111.6	S294 K300 R301 A302 Y309 P328 R331 L332	S294-F298 WeakPolarHBondContact O-CB 3.13Å; S294-F298 PolarHBondContact O-N 3.01Å; F298-K300 PolarHBondContact O-N 3.31Å; F298-R301 PolarHBondContact O-N 2.69Å; F298-A302 HydrophobicContact CZ-CB 4.46Å; F298-A302 VanDerWaalsContact O-CB 3.28Å; F298-A302 WeakPolarHBondContact O-CB 3.07Å; F298-A302 PolarHBondContact O-N 2.82Å; F298-Y309 AromaticContact CE2-CE2 3.88Å; F298-Y309 HydrophobicContact CE2-CE2 3.88Å; F298-Y309 HydrophobicContact CZ-CD2 4.35Å; F298-Y309 AromaticContact CZ-CE2 3.85Å; F298-Y309 HydrophobicContact CZ-CE2 3.85Å; F298-P328 HydrophobicContact CE2-CB 3.97Å; F298-P328 HydrophobicContact CZ-CB 4.15Å; F298-P328 WeakPolarHBondContact CZ-O 3.41Å; F298-R331 HydrophobicContact CD1-CG 3.83Å; F298-R331 HydrophobicContact CE1-CB 3.91Å; F298-R331 HydrophobicContact CE1-CG 3.53Å; F298-R331 HydrophobicContact CZ-CB 4.05Å; F298-R331 HydrophobicContact CZ-CG 4.07Å; F298-L332 HydrophobicContact CE1-CB 4Å; F298-L332 HydrophobicContact CE1-CD1 4.46Å; F298-L332 HydrophobicContact CZ-CB 4.02Å
299	F	95.1	Very high	89.1	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.009	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-45.1	-179.6	-175.2	-109.5	0	0	0	112	Y287 C295 K296 R301 A302 V303 L332 C335 Y336 M340 L342	Y287-F299 HydrophobicContact CD1-CD1 4.41Å; Y287-F299 HydrophobicContact CD1-CE1 4.49Å; Y287-F299 AromaticContact CD2-CD1 3.78Å; Y287-F299 HydrophobicContact CD2-CD1 3.78Å; Y287-F299 HydrophobicContact CE2-CD1 4.32Å; Y287-F299 AromaticContact CG-CD1 3.82Å; Y287-F299 HydrophobicContact CG-CD1 3.82Å; Y287-F299 HydrophobicContact CG-CE1 4.12Å; C295-F299 VanDerWaalsContact O-CB 3.22Å; C295-F299 WeakPolarHBondContact O-CB 3.44Å; C295-F299 PolarHBondContact O-N 2.91Å; K296-F299 PolarHBondContact O-N 3.17Å; F299-R301 PolarHBondContact O-N 2.76Å; F299-A302 PolarHBondContact O-N 2.92Å; F299-V303 HydrophobicContact CD1-CG2 4.41Å; F299-V303 HydrophobicContact CD2-CG2 4Å; F299-V303 HydrophobicContact CE1-CG2 4.04Å; F299-V303 HydrophobicContact CE2-CG2 3.59Å; F299-V303 HydrophobicContact CG-CG2 4.39Å; F299-V303 HydrophobicContact CZ-CG2 3.6Å; F299-V303 WeakPolarHBondContact O-CG2 3.23Å; F299-V303 PolarHBondContact O-N 3.18Å; F299-L332 HydrophobicContact CD2-CD1 3.97Å; F299-L332 HydrophobicContact CE2-CD1 4.21Å; F299-C335 HydrophobicContact CD2-CB 3.49Å; F299-C335 VanDerWaalsContact CD2-CB 3.49Å; F299-C335 HydrophobicContact CE2-CB 3.99Å; F299-C335 HydrophobicContact CG-CB 4.33Å; F299-Y336 AromaticContact CE2-CD1 3.76Å; F299-Y336 HydrophobicContact CE2-CD1 3.76Å; F299-Y336 AromaticContact CE2-CE1 3.61Å; F299-Y336 HydrophobicContact CE2-CE1 3.61Å; F299-Y336 HydrophobicContact CZ-CD1 4.14Å; F299-Y336 AromaticContact CZ-CE1 3.91Å; F299-Y336 HydrophobicContact CZ-CE1 3.91Å; F299-M340 HydrophobicContact CB-CE 3.73Å; F299-M340 HydrophobicContact CB-SD 4.3Å; F299-M340 HydrophobicContact CD1-CB 3.9Å; F299-M340 HydrophobicContact CD1-CE 3.84Å; F299-M340 HydrophobicContact CD2-CB 4.07Å; F299-M340 HydrophobicContact CD2-SD 4.44Å; F299-M340 HydrophobicContact CE1-CB 3.61Å; F299-M340 HydrophobicContact CE2-CB 3.8Å; F299-M340 HydrophobicContact CG-CB 4.12Å; F299-M340 HydrophobicContact CG-CE 3.81Å; F299-M340 HydrophobicContact CG-SD 4.18Å; F299-M340 HydrophobicContact CZ-CB 3.57Å; F299-M340 WeakPolarHBondContact CZ-O 3.38Å; F299-L342 HydrophobicContact CD1-CD1 3.79Å; F299-L342 HydrophobicContact CE1-CD1 3.49Å; F299-L342 VanDerWaalsContact CE1-CD1 3.49Å; F299-L342 HydrophobicContact CZ-CD1 4.43Å
300	K	92.9	Very high	89	Confident	87 Å²	87	64.4 Å²	64.4	38%	0.378	34%	0.338	S	S	.	.	H	α-helix	trans	-53.8	-54.5	176	-165.3	-174	-167.6	-80.2	0	111.7	Y287 K296 F298 A302 V303 E304	Y287-K300 HydrophobicContact CE2-CB 4.46Å; Y287-K300 WeakPolarHBondContact OH-CB 3.06Å; Y287-K300 WeakPolarHBondContact OH-CG 3.15Å; K296-K300 PolarHBondContact O-N 2.75Å; K296-K300 VanDerWaalsContact O-N 3.08Å; F298-K300 PolarHBondContact O-N 3.31Å; K300-A302 PolarHBondContact O-N 2.85Å; K300-V303 PolarHBondContact O-N 3.29Å; K300-E304 WeakPolarHBondContact CE-OE1 2.95Å; K300-E304 VanDerWaalsContact CG-CD 3.4Å; K300-E304 HydrophobicContact CG-CG 4.33Å; K300-E304 WeakPolarHBondContact CG-OE1 3.22Å; K300-E304 WeakPolarHBondContact CG-OE2 3.14Å; K300-E304 IonicContact NZ-OE1 2.71Å; K300-E304 PolarHBondContact NZ-OE1 3.23Å; K300-E304 IonicContact NZ-OE2 3.45Å; K300-E304 PolarHBondContact NZ-OE2 2.95Å; K300-E304 WeakPolarHBondContact O-CB 3.37Å; K300-E304 VanDerWaalsContact O-CG 3.31Å; K300-E304 WeakPolarHBondContact O-CG 3.09Å; K300-E304 PolarHBondContact O-N 2.76Å
301	R	92.9	Very high	89.1	Confident	175 Å²	175	63.2 Å²	63.2	66%	0.66	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-38	-177.4	-68.7	178.2	178.3	-173.7	-1.5	112.9	V297 F298 F299 G305 H307	V297-R301 WeakPolarHBondContact O-CG 3.1Å; V297-R301 PolarHBondContact O-N 3.41Å; F298-R301 PolarHBondContact O-N 2.69Å; F299-R301 PolarHBondContact O-N 2.76Å; R301-G305 PolarHBondContact O-N 3.4Å; R301-G305 VanDerWaalsContact O-N 3.14Å; R301-H307 PolarHBondContact O-CE1 2.82Å; R301-H307 PolarHBondContact O-ND1 3.3Å
302	A	90.8	Very high	88.8	Confident	2 Å²	2	68.8 Å²	68.8	2%	0.017	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-46.4	179.2	0	0	0	0	0	111.9	F298 F299 K300 H306 H307 Y309 L332	F298-A302 HydrophobicContact CZ-CB 4.46Å; F298-A302 VanDerWaalsContact O-CB 3.28Å; F298-A302 WeakPolarHBondContact O-CB 3.07Å; F298-A302 PolarHBondContact O-N 2.82Å; F299-A302 PolarHBondContact O-N 2.92Å; K300-A302 PolarHBondContact O-N 2.85Å; A302-H306 PolarHBondContact O-N 3.47Å; A302-H307 PolarHBondContact O-N 2.92Å; A302-H307 VanDerWaalsContact O-N 3.14Å; A302-Y309 HydrophobicContact CB-CE2 3.79Å; A302-L332 HydrophobicContact CB-CD1 3.66Å; A302-L332 HydrophobicContact CB-CD2 4.05Å; A302-L332 HydrophobicContact CB-CG 4.4Å
303	V	86.6	Confident	88.4	Confident	35 Å²	35	70.6 Å²	70.6	21%	0.212	40%	0.399	C	S	.	.	H	α-helix	trans	-72.1	-54.3	-179.4	178.4	0	0	0	0	111.4	F299 K300 G305 H306 Y336 L342	F299-V303 HydrophobicContact CD1-CG2 4.41Å; F299-V303 HydrophobicContact CD2-CG2 4Å; F299-V303 HydrophobicContact CE1-CG2 4.04Å; F299-V303 HydrophobicContact CE2-CG2 3.59Å; F299-V303 HydrophobicContact CG-CG2 4.39Å; F299-V303 HydrophobicContact CZ-CG2 3.6Å; F299-V303 WeakPolarHBondContact O-CG2 3.23Å; F299-V303 PolarHBondContact O-N 3.18Å; K300-V303 PolarHBondContact O-N 3.29Å; V303-G305 VanDerWaalsContact C-N 3.26Å; V303-G305 PolarHBondContact O-N 3.44Å; V303-H306 PolarHBondContact O-N 2.88Å; V303-H306 VanDerWaalsContact O-N 3.13Å; V303-Y336 HydrophobicContact CG2-CE1 4.23Å; V303-L342 HydrophobicContact CB-CD1 4.23Å; V303-L342 HydrophobicContact CG1-CD1 4.28Å; V303-L342 HydrophobicContact CG1-CD2 4.22Å; V303-L342 HydrophobicContact CG2-CD1 4.36Å
304	E	84.8	Confident	88	Confident	97 Å²	97	79.6 Å²	79.6	45%	0.453	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-28.8	-175.4	-67.5	174.4	175.6	0	0	113.3	K300 L342	K300-E304 WeakPolarHBondContact CE-OE1 2.95Å; K300-E304 VanDerWaalsContact CG-CD 3.4Å; K300-E304 HydrophobicContact CG-CG 4.33Å; K300-E304 WeakPolarHBondContact CG-OE1 3.22Å; K300-E304 WeakPolarHBondContact CG-OE2 3.14Å; K300-E304 IonicContact NZ-OE1 2.71Å; K300-E304 PolarHBondContact NZ-OE1 3.23Å; K300-E304 IonicContact NZ-OE2 3.45Å; K300-E304 PolarHBondContact NZ-OE2 2.95Å; K300-E304 WeakPolarHBondContact O-CB 3.37Å; K300-E304 VanDerWaalsContact O-CG 3.31Å; K300-E304 WeakPolarHBondContact O-CG 3.09Å; K300-E304 PolarHBondContact O-N 2.76Å; E304-L342 HydrophobicContact CG-CD2 3.55Å
305	G	76.6	Confident	87.6	Confident	42 Å²	42	81.6 Å²	81.6	43%	0.433	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	10	177	0	0	0	0	0	114.6	R301 V303 H307	R301-G305 PolarHBondContact O-N 3.4Å; R301-G305 VanDerWaalsContact O-N 3.14Å; V303-G305 VanDerWaalsContact C-N 3.26Å; V303-G305 PolarHBondContact O-N 3.44Å; G305-H307 PolarHBondContact O-N 2.88Å; G305-H307 VanDerWaalsContact O-N 3.08Å; G305-H307 PolarHBondContact O-ND1 2.82Å
306	H	66.8	Low	87.2	Confident	172 Å²	172	86.5 Å²	86.5	80%	0.796	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	38.1	178.5	-66.4	-87	0	0	0	114.9	A302 V303 S308	A302-H306 PolarHBondContact O-N 3.47Å; V303-H306 PolarHBondContact O-N 2.88Å; V303-H306 VanDerWaalsContact O-N 3.13Å; H306-S308 PolarHBondContact O-N 2.95Å; H306-S308 VanDerWaalsContact O-N 3.16Å
307	H	72.3	Confident	87.1	Confident	88 Å²	88	85 Å²	85	41%	0.407	46%	0.455	S	S	.	.			trans	-72.8	110.2	-169.6	-69.8	86	0	0	0	112.9	R301 A302 G305 Y309	R301-H307 PolarHBondContact O-CE1 2.82Å; R301-H307 PolarHBondContact O-ND1 3.3Å; A302-H307 PolarHBondContact O-N 2.92Å; A302-H307 VanDerWaalsContact O-N 3.14Å; G305-H307 PolarHBondContact O-N 2.88Å; G305-H307 VanDerWaalsContact O-N 3.08Å; G305-H307 PolarHBondContact O-ND1 2.82Å; H307-Y309 VanDerWaalsContact C-N 3.25Å; H307-Y309 HydrophobicContact CB-CD1 4.14Å; H307-Y309 HydrophobicContact CB-CD2 4.3Å; H307-Y309 HydrophobicContact CB-CE1 3.63Å; H307-Y309 HydrophobicContact CB-CE2 3.83Å; H307-Y309 HydrophobicContact CB-CG 4.44Å; H307-Y309 VanDerWaalsContact CB-CZ 3.44Å; H307-Y309 AromaticContact CG-CZ 3.84Å; H307-Y309 PolarHBondContact O-N 2.71Å
308	S	75.8	Confident	87	Confident	113 Å²	113	86.9 Å²	86.9	79%	0.79	46%	0.461	S	S	*	.			trans	-75.4	64.5	175.1	47.9	0	0	0	0	112.9	H306 L310	H306-S308 PolarHBondContact O-N 2.95Å; H306-S308 VanDerWaalsContact O-N 3.16Å; S308-L310 PolarHBondContact O-N 3.34Å
309	Y	89.7	Confident	86.9	Confident	71 Å²	71	86 Å²	86	28%	0.278	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-64.5	120.1	177.9	-59	-49.2	0	0	0	112.2	F298 A302 H307 P328 A329 L332	F298-Y309 AromaticContact CE2-CE2 3.88Å; F298-Y309 HydrophobicContact CE2-CE2 3.88Å; F298-Y309 HydrophobicContact CZ-CD2 4.35Å; F298-Y309 AromaticContact CZ-CE2 3.85Å; F298-Y309 HydrophobicContact CZ-CE2 3.85Å; A302-Y309 HydrophobicContact CB-CE2 3.79Å; H307-Y309 VanDerWaalsContact C-N 3.25Å; H307-Y309 HydrophobicContact CB-CD1 4.14Å; H307-Y309 HydrophobicContact CB-CD2 4.3Å; H307-Y309 HydrophobicContact CB-CE1 3.63Å; H307-Y309 HydrophobicContact CB-CE2 3.83Å; H307-Y309 HydrophobicContact CB-CG 4.44Å; H307-Y309 VanDerWaalsContact CB-CZ 3.44Å; H307-Y309 AromaticContact CG-CZ 3.84Å; H307-Y309 PolarHBondContact O-N 2.71Å; Y309-P328 HydrophobicContact CD1-CB 3.91Å; Y309-P328 HydrophobicContact CD1-CG 3.84Å; Y309-P328 HydrophobicContact CD2-CB 3.83Å; Y309-P328 HydrophobicContact CE1-CB 4.13Å; Y309-P328 HydrophobicContact CE1-CG 4.34Å; Y309-P328 HydrophobicContact CE2-CB 4.03Å; Y309-P328 HydrophobicContact CG-CB 3.77Å; Y309-P328 HydrophobicContact CG-CG 3.96Å; Y309-A329 WeakPolarHBondContact O-CB 3.36Å; Y309-L332 HydrophobicContact CD2-CB 4.25Å; Y309-L332 HydrophobicContact CD2-CD2 3.87Å; Y309-L332 HydrophobicContact CE2-CD2 4.25Å
310	L	87.8	Confident	87	Confident	159 Å²	159	87.8 Å²	87.8	83%	0.832	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-89.1	154.4	169.9	-60.7	177.2	0	0	0	111.6	S308 A329	S308-L310 PolarHBondContact O-N 3.34Å; L310-A329 WeakPolarHBondContact O-CB 2.99Å
311	C	93.4	Very high	87	Confident	24 Å²	24	89.5 Å²	89.5	16%	0.162	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-100.8	132.3	172.3	-173.6	0	0	0	0	110	G313 N315 C327 A329	C311-G313 PolarHBondContact O-N 2.9Å; C311-G313 PolarHBondContact SG-N 3.08Å; C311-G313 VanDerWaalsContact SG-N 3.4Å; C311-N315 WeakPolarHBondContact CB-OD1 3.48Å; C311-C327 VanDerWaalsContact SG-SG 3.62Å; C311-A329 HydrophobicContact CB-CB 4.12Å
312	A	89.1	Confident	87.1	Confident	118 Å²	118	87.7 Å²	87.7	98%	0.975	48%	0.478	S	S	*	.	S	Bend	trans	-80.9	17.8	172.9	0	0	0	0	0	113.4
313	G	86.7	Confident	87.2	Confident	40 Å²	40	93 Å²	93	41%	0.412	50%	0.497	S	S	.	.	S	Bend	trans	-152.3	-161.5	-176.5	0	0	0	0	0	110.6	C311 N315	C311-G313 PolarHBondContact O-N 2.9Å; C311-G313 PolarHBondContact SG-N 3.08Å; C311-G313 VanDerWaalsContact SG-N 3.4Å; G313-N315 PolarHBondContact O-N 3.14Å
314	R	87	Confident	87.6	Confident	221 Å²	221	93 Å²	93	83%	0.834	49%	0.494	S	S	*	.	S	Bend	trans	-80.5	29	-171	-62.7	177.7	178.4	156.6	-1.5	114.3	D316	R314-D316 PolarHBondContact N-OD1 3.01Å; R314-D316 PolarHBondContact O-N 3.36Å; R314-D316 VanDerWaalsContact O-N 3.13Å
315	N	86.4	Confident	88	Confident	88 Å²	88	97.2 Å²	97.2	47%	0.471	51%	0.51	S	S	.	.	S	Bend	trans	56.3	19.1	-174.9	-71.7	-69.8	0	0	0	115.1	C311 G313 C330 R333	C311-N315 WeakPolarHBondContact CB-OD1 3.48Å; G313-N315 PolarHBondContact O-N 3.14Å; N315-C330 PolarHBondContact O-SG 2.95Å; N315-R333 PolarHBondContact O-NE 2.89Å; N315-R333 PolarHBondContact O-NH2 3.08Å
316	D	89.9	Confident	88.8	Confident	103 Å²	103	101.2 Å²	101.2	55%	0.551	52%	0.522	S	S	*	.			trans	-112.7	1.6	-170	60	-15.9	0	0	0	114.2	R314 I318	R314-D316 PolarHBondContact N-OD1 3.01Å; R314-D316 PolarHBondContact O-N 3.36Å; R314-D316 VanDerWaalsContact O-N 3.13Å; D316-I318 PolarHBondContact O-N 3.44Å
317	C	93.8	Very high	90.2	Very high	47 Å²	47	93.6 Å²	93.6	32%	0.318	49%	0.488	S	S	.	.			trans	-54.6	132.4	-170.3	-52.5	0	0	0	0	114.1	V319 C327 C330	C317-V319 PolarHBondContact O-N 3.07Å; C317-C327 HydrophobicContact CB-CB 3.86Å; C317-C330 HydrophobicContact CB-CB 3.99Å; C317-C330 PolarHBondContact N-SG 3.36Å; C317-C330 VanDerWaalsContact N-SG 3.43Å
318	I	91.8	Very high	91.3	Very high	110 Å²	110	91.6 Å²	91.6	56%	0.564	48%	0.482	S	S	*	.			trans	-67.9	123.7	-177.7	-56.9	168	0	0	0	111.1	D316 R323	D316-I318 PolarHBondContact O-N 3.44Å; I318-R323 WeakPolarHBondContact O-CB 3.45Å
319	V	95.4	Very high	92.2	Very high	13 Å²	13	86.6 Å²	86.6	8%	0.079	45%	0.448	C	S	.	.			trans	-105.4	105.7	-179.7	-175.3	0	0	0	0	110.2	I277 C278 C317 R324 C330 R331 K334	I277-V319 HydrophobicContact CG2-CG1 4.26Å; I277-V319 WeakPolarHBondContact O-CG1 2.99Å; C278-V319 HydrophobicContact CB-CG1 4.14Å; C317-V319 PolarHBondContact O-N 3.07Å; V319-R324 HydrophobicContact CG1-CB 3.91Å; V319-C330 HydrophobicContact CG2-CB 4.23Å; V319-R331 HydrophobicContact CG1-CB 4.27Å; V319-R331 HydrophobicContact CG1-CG 4.06Å; V319-R331 HydrophobicContact CG2-CB 4.38Å; V319-K334 HydrophobicContact CB-CD 3.99Å; V319-K334 HydrophobicContact CG2-CD 4.36Å; V319-K334 PolarHBondContact O-NZ 3.38Å
320	D	95.8	Very high	92.4	Very high	39 Å²	39	83.2 Å²	83.2	21%	0.209	44%	0.435	C	S	.	.			trans	-131.4	-177.2	173.7	65.4	43.9	0	0	0	111.9	C278 I322 R323 R324	C278-D320 CarbonylContact O-C 3.26Å; C278-D320 VanDerWaalsContact O-C 3.26Å; C278-D320 VanDerWaalsContact O-CA 3.3Å; C278-D320 WeakPolarHBondContact O-CA 3.31Å; D320-I322 PolarHBondContact O-N 2.93Å; D320-I322 VanDerWaalsContact O-N 3.11Å; D320-I322 WeakPolarHBondContact OD1-CA 3.34Å; D320-I322 PolarHBondContact OD1-N 2.85Å; D320-R323 PolarHBondContact OD1-N 3.22Å; D320-R323 IonicContact OD2-CZ 2.76Å; D320-R323 IonicContact OD2-NE 3.61Å; D320-R323 PolarHBondContact OD2-NE 3.46Å; D320-R323 IonicContact OD2-NH2 2.71Å; D320-R323 PolarHBondContact OD2-NH2 3.36Å; D320-R324 WeakPolarHBondContact O-CB 3.45Å; D320-R324 WeakPolarHBondContact O-CD 3.18Å; D320-R324 WeakPolarHBondContact O-CG 3.4Å; D320-R324 PolarHBondContact O-N 3Å
321	K	94.3	Very high	92.8	Very high	122 Å²	122	76.5 Å²	76.5	53%	0.53	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-32.1	-177.2	-176.3	170	-178	146.9	0	113.7	C278 D280 R324	C278-K321 PolarHBondContact O-N 2.8Å; D280-K321 HydrophobicContact CB-CB 4.13Å; D280-K321 HydrophobicContact CB-CD 4.15Å; D280-K321 HydrophobicContact CB-CG 4.01Å; D280-K321 VanDerWaalsContact OD1-CD 3.23Å; D280-K321 WeakPolarHBondContact OD1-CD 3.24Å; D280-K321 WeakPolarHBondContact OD1-CE 3.46Å; D280-K321 IonicContact OD1-NZ 2.69Å; D280-K321 PolarHBondContact OD1-NZ 2.87Å; K321-R324 PolarHBondContact O-NE 3.11Å
322	I	94.6	Very high	92.9	Very high	138 Å²	138	76.2 Å²	76.2	71%	0.708	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-57.1	-177.4	-53.3	175.2	0	0	0	109.4	D320 R324	D320-I322 PolarHBondContact O-N 2.93Å; D320-I322 VanDerWaalsContact O-N 3.11Å; D320-I322 WeakPolarHBondContact OD1-CA 3.34Å; D320-I322 PolarHBondContact OD1-N 2.85Å; I322-R324 VanDerWaalsContact C-N 3.32Å; I322-R324 PolarHBondContact O-N 3.47Å
323	R	93.1	Very high	93.1	Very high	113 Å²	113	74.7 Å²	74.7	43%	0.426	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-76.5	-8.8	-171	-68.4	-177.5	-73.7	-170.5	-5.1	115.1	I318 D320 K325 N326	I318-R323 WeakPolarHBondContact O-CB 3.45Å; D320-R323 PolarHBondContact OD1-N 3.22Å; D320-R323 IonicContact OD2-CZ 2.76Å; D320-R323 IonicContact OD2-NE 3.61Å; D320-R323 PolarHBondContact OD2-NE 3.46Å; D320-R323 IonicContact OD2-NH2 2.71Å; D320-R323 PolarHBondContact OD2-NH2 3.36Å; R323-K325 PolarHBondContact O-N 3.3Å; R323-N326 WeakPolarHBondContact CA-OD1 3.11Å; R323-N326 WeakPolarHBondContact O-CB 3.29Å; R323-N326 PolarHBondContact O-N 2.86Å; R323-N326 PolarHBondContact O-OD1 3.07Å
324	R	94	Very high	93.4	Very high	36 Å²	36	76 Å²	76	14%	0.136	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-61.3	-0.7	174.1	65.1	-172.8	174.1	176.9	-2.3	116.1	C278 D280 C292 S294 V319 D320 K321 I322 R331	C278-R324 HydrophobicContact CB-CB 4.43Å; C278-R324 PolarHBondContact SG-NH1 2.94Å; C278-R324 VanDerWaalsContact SG-NH1 3.36Å; D280-R324 IonicContact OD2-CZ 3.63Å; D280-R324 IonicContact OD2-NH1 2.68Å; D280-R324 PolarHBondContact OD2-NH1 3.44Å; D280-R324 IonicContact OD2-NH2 3.58Å; D280-R324 PolarHBondContact OD2-NH2 3.24Å; C292-R324 PolarHBondContact SG-NH1 3.35Å; S294-R324 PolarHBondContact OG-NH1 2.98Å; V319-R324 HydrophobicContact CG1-CB 3.91Å; D320-R324 WeakPolarHBondContact O-CB 3.45Å; D320-R324 WeakPolarHBondContact O-CD 3.18Å; D320-R324 WeakPolarHBondContact O-CG 3.4Å; D320-R324 PolarHBondContact O-N 3Å; K321-R324 PolarHBondContact O-NE 3.11Å; I322-R324 VanDerWaalsContact C-N 3.32Å; I322-R324 PolarHBondContact O-N 3.47Å; R324-R331 VanDerWaalsContact O-CD 3.3Å; R324-R331 WeakPolarHBondContact O-CD 3.49Å; R324-R331 PolarHBondContact O-NH1 3.4Å
325	K	93.5	Very high	93.8	Very high	185 Å²	185	65.5 Å²	65.5	80%	0.804	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-94.3	-27	167.1	-69.5	-174.4	178.1	-178.3	0	112.6	R323 C327	R323-K325 PolarHBondContact O-N 3.3Å; K325-C327 PolarHBondContact O-N 3.13Å
326	N	94.3	Very high	94	Very high	126 Å²	126	65.2 Å²	65.2	67%	0.674	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-29.8	-166.6	-56.1	36.3	0	0	0	113.2	R323	R323-N326 WeakPolarHBondContact CA-OD1 3.11Å; R323-N326 WeakPolarHBondContact O-CB 3.29Å; R323-N326 PolarHBondContact O-N 2.86Å; R323-N326 PolarHBondContact O-OD1 3.07Å
327	C	96	Very high	93.8	Very high	12 Å²	12	65.8 Å²	65.8	8%	0.081	31%	0.311	C	S	.	.			trans	-139.4	99	175.6	-170.6	0	0	0	0	111.3	C311 C317 K325 A329 C330 R331	C311-C327 VanDerWaalsContact SG-SG 3.62Å; C317-C327 HydrophobicContact CB-CB 3.86Å; K325-C327 PolarHBondContact O-N 3.13Å; C327-A329 VanDerWaalsContact C-N 3.29Å; C327-A329 PolarHBondContact O-N 3.29Å; C327-C330 HydrophobicContact CB-CB 4.17Å; C327-C330 PolarHBondContact SG-N 3.14Å; C327-C330 VanDerWaalsContact SG-N 3.42Å; C327-R331 WeakPolarHBondContact O-CB 3.34Å; C327-R331 PolarHBondContact O-N 3.07Å
328	P	94.4	Very high	93.5	Very high	45 Å²	45	65.3 Å²	65.3	29%	0.292	31%	0.311	S	S	.	.	H	α-helix	trans	-66.6	-30.9	176.3	27.4	-33.7	0	0	0	112	F298 Y309 R331 L332	F298-P328 HydrophobicContact CE2-CB 3.97Å; F298-P328 HydrophobicContact CZ-CB 4.15Å; F298-P328 WeakPolarHBondContact CZ-O 3.41Å; Y309-P328 HydrophobicContact CD1-CB 3.91Å; Y309-P328 HydrophobicContact CD1-CG 3.84Å; Y309-P328 HydrophobicContact CD2-CB 3.83Å; Y309-P328 HydrophobicContact CE1-CB 4.13Å; Y309-P328 HydrophobicContact CE1-CG 4.34Å; Y309-P328 HydrophobicContact CE2-CB 4.03Å; Y309-P328 HydrophobicContact CG-CB 3.77Å; Y309-P328 HydrophobicContact CG-CG 3.96Å; P328-R331 PolarHBondContact O-N 3.44Å; P328-L332 WeakPolarHBondContact O-CB 3.42Å; P328-L332 PolarHBondContact O-N 3.01Å
329	A	94.3	Very high	93	Very high	9 Å²	9	61.6 Å²	61.6	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-55.9	175.9	0	0	0	0	0	112.4	Y309 L310 C311 C327 R331 L332 R333	Y309-A329 WeakPolarHBondContact O-CB 3.36Å; L310-A329 WeakPolarHBondContact O-CB 2.99Å; C311-A329 HydrophobicContact CB-CB 4.12Å; C327-A329 VanDerWaalsContact C-N 3.29Å; C327-A329 PolarHBondContact O-N 3.29Å; A329-R331 VanDerWaalsContact C-N 3.26Å; A329-R331 PolarHBondContact O-N 2.96Å; A329-L332 PolarHBondContact O-N 3.13Å; A329-R333 WeakPolarHBondContact O-CB 3.39Å; A329-R333 PolarHBondContact O-N 3.34Å
330	C	95	Very high	92.8	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-32.4	178.1	-67.6	0	0	0	0	112.3	N315 C317 V319 C327 K334	N315-C330 PolarHBondContact O-SG 2.95Å; C317-C330 HydrophobicContact CB-CB 3.99Å; C317-C330 PolarHBondContact N-SG 3.36Å; C317-C330 VanDerWaalsContact N-SG 3.43Å; V319-C330 HydrophobicContact CG2-CB 4.23Å; C327-C330 HydrophobicContact CB-CB 4.17Å; C327-C330 PolarHBondContact SG-N 3.14Å; C327-C330 VanDerWaalsContact SG-N 3.42Å; C330-K334 WeakPolarHBondContact O-CB 3.18Å; C330-K334 PolarHBondContact O-N 2.85Å
331	R	96.8	Very high	92.4	Very high	18 Å²	18	64.5 Å²	64.5	7%	0.068	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-46	173.7	-172.6	-178.6	-175.2	170.5	-3.4	112.3	I277 S294 C295 F298 V319 R324 C327 P328 A329 K334 C335	I277-R331 HydrophobicContact CG2-CG 4.39Å; S294-R331 VanDerWaalsContact C-NH2 3.32Å; S294-R331 PolarHBondContact O-NH2 2.99Å; S294-R331 PolarHBondContact OG-NH2 3.26Å; C295-R331 PolarHBondContact SG-NH2 3.45Å; F298-R331 HydrophobicContact CD1-CG 3.83Å; F298-R331 HydrophobicContact CE1-CB 3.91Å; F298-R331 HydrophobicContact CE1-CG 3.53Å; F298-R331 HydrophobicContact CZ-CB 4.05Å; F298-R331 HydrophobicContact CZ-CG 4.07Å; V319-R331 HydrophobicContact CG1-CB 4.27Å; V319-R331 HydrophobicContact CG1-CG 4.06Å; V319-R331 HydrophobicContact CG2-CB 4.38Å; R324-R331 VanDerWaalsContact O-CD 3.3Å; R324-R331 WeakPolarHBondContact O-CD 3.49Å; R324-R331 PolarHBondContact O-NH1 3.4Å; C327-R331 WeakPolarHBondContact O-CB 3.34Å; C327-R331 PolarHBondContact O-N 3.07Å; P328-R331 PolarHBondContact O-N 3.44Å; A329-R331 VanDerWaalsContact C-N 3.26Å; A329-R331 PolarHBondContact O-N 2.96Å; R331-K334 PolarHBondContact O-N 2.72Å; R331-C335 PolarHBondContact O-N 3.15Å; R331-C335 PolarHBondContact O-SG 3.04Å
332	L	94.8	Very high	91.8	Very high	17 Å²	17	61.7 Å²	61.7	9%	0.089	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-44.3	178	-178.4	59.1	0	0	0	111	F298 F299 A302 Y309 P328 A329 K334 C335 Y336	F298-L332 HydrophobicContact CE1-CB 4Å; F298-L332 HydrophobicContact CE1-CD1 4.46Å; F298-L332 HydrophobicContact CZ-CB 4.02Å; F299-L332 HydrophobicContact CD2-CD1 3.97Å; F299-L332 HydrophobicContact CE2-CD1 4.21Å; A302-L332 HydrophobicContact CB-CD1 3.66Å; A302-L332 HydrophobicContact CB-CD2 4.05Å; A302-L332 HydrophobicContact CB-CG 4.4Å; Y309-L332 HydrophobicContact CD2-CB 4.25Å; Y309-L332 HydrophobicContact CD2-CD2 3.87Å; Y309-L332 HydrophobicContact CE2-CD2 4.25Å; P328-L332 WeakPolarHBondContact O-CB 3.42Å; P328-L332 PolarHBondContact O-N 3.01Å; A329-L332 PolarHBondContact O-N 3.13Å; L332-K334 VanDerWaalsContact C-N 3.27Å; L332-K334 PolarHBondContact O-N 3.4Å; L332-C335 WeakPolarHBondContact O-CB 3.29Å; L332-C335 PolarHBondContact O-N 3.25Å; L332-C335 VanDerWaalsContact O-N 3.07Å; L332-Y336 HydrophobicContact CD1-CD2 4.21Å; L332-Y336 HydrophobicContact CD1-CE2 3.71Å; L332-Y336 HydrophobicContact CD2-CE2 4.03Å; L332-Y336 HydrophobicContact CG-CD2 4.02Å; L332-Y336 HydrophobicContact CG-CE2 3.58Å; L332-Y336 WeakPolarHBondContact O-CD2 3.37Å; L332-Y336 PolarHBondContact O-N 2.86Å
333	R	93.1	Very high	90.5	Very high	86 Å²	86	58.5 Å²	58.5	33%	0.325	30%	0.303	S	S	.	.	H	α-helix	trans	-52.8	-45.1	171.5	-170.8	-179.6	58	58.1	-3.9	111.3	N315 A329 Y336 Q337	N315-R333 PolarHBondContact O-NE 2.89Å; N315-R333 PolarHBondContact O-NH2 3.08Å; A329-R333 WeakPolarHBondContact O-CB 3.39Å; A329-R333 PolarHBondContact O-N 3.34Å; R333-Y336 PolarHBondContact O-N 2.77Å; R333-Q337 VanDerWaalsContact NH1-CD 3.3Å; R333-Q337 WeakPolarHBondContact O-CB 3.09Å; R333-Q337 VanDerWaalsContact O-CG 3.28Å; R333-Q337 WeakPolarHBondContact O-CG 3.42Å; R333-Q337 PolarHBondContact O-N 2.74Å
334	K	94.1	Very high	88.3	Confident	68 Å²	68	56.6 Å²	56.6	30%	0.296	32%	0.319	S	S	.	.	H	α-helix	trans	-70.4	-32.2	177.3	-165.2	173.3	178	-169.7	0	113.4	V276 I277 V319 C330 R331 L332 A338	V276-K334 WeakPolarHBondContact O-CE 3.19Å; I277-K334 HydrophobicContact CD1-CG 4.5Å; I277-K334 WeakPolarHBondContact CD1-O 3.28Å; I277-K334 HydrophobicContact CG2-CG 4.44Å; I277-K334 VanDerWaalsContact O-CD 3.28Å; I277-K334 WeakPolarHBondContact O-CD 3.3Å; I277-K334 WeakPolarHBondContact O-CE 3.08Å; I277-K334 PolarHBondContact O-NZ 2.78Å; V319-K334 HydrophobicContact CB-CD 3.99Å; V319-K334 HydrophobicContact CG2-CD 4.36Å; V319-K334 PolarHBondContact O-NZ 3.38Å; C330-K334 WeakPolarHBondContact O-CB 3.18Å; C330-K334 PolarHBondContact O-N 2.85Å; R331-K334 PolarHBondContact O-N 2.72Å; L332-K334 VanDerWaalsContact C-N 3.27Å; L332-K334 PolarHBondContact O-N 3.4Å; K334-A338 WeakPolarHBondContact O-CB 3.15Å; K334-A338 PolarHBondContact O-N 3.18Å; K334-A338 VanDerWaalsContact O-N 3.14Å
335	C	93.6	Very high	86	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-48.6	170.8	-68.6	0	0	0	0	111.8	F299 R331 L332 A338 M340	F299-C335 HydrophobicContact CD2-CB 3.49Å; F299-C335 VanDerWaalsContact CD2-CB 3.49Å; F299-C335 HydrophobicContact CE2-CB 3.99Å; F299-C335 HydrophobicContact CG-CB 4.33Å; R331-C335 PolarHBondContact O-N 3.15Å; R331-C335 PolarHBondContact O-SG 3.04Å; L332-C335 WeakPolarHBondContact O-CB 3.29Å; L332-C335 PolarHBondContact O-N 3.25Å; L332-C335 VanDerWaalsContact O-N 3.07Å; C335-A338 PolarHBondContact O-N 3.37Å; C335-M340 HydrophobicContact CB-CB 4.38Å; C335-M340 HydrophobicContact CB-CG 4.34Å; C335-M340 HydrophobicContact CB-SD 3.65Å; C335-M340 VanDerWaalsContact O-CB 3.29Å; C335-M340 WeakPolarHBondContact O-CB 3.36Å; C335-M340 WeakPolarHBondContact O-CG 3.3Å; C335-M340 PolarHBondContact O-N 3.22Å; C335-M340 VanDerWaalsContact O-N 3.13Å
336	Y	90.9	Very high	83.9	Confident	82 Å²	82	67.4 Å²	67.4	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-48.9	175.7	-69.6	-52.9	0	0	0	111.8	F299 V303 L332 R333 A338 G339 F364	F299-Y336 AromaticContact CE2-CD1 3.76Å; F299-Y336 HydrophobicContact CE2-CD1 3.76Å; F299-Y336 AromaticContact CE2-CE1 3.61Å; F299-Y336 HydrophobicContact CE2-CE1 3.61Å; F299-Y336 HydrophobicContact CZ-CD1 4.14Å; F299-Y336 AromaticContact CZ-CE1 3.91Å; F299-Y336 HydrophobicContact CZ-CE1 3.91Å; V303-Y336 HydrophobicContact CG2-CE1 4.23Å; L332-Y336 HydrophobicContact CD1-CD2 4.21Å; L332-Y336 HydrophobicContact CD1-CE2 3.71Å; L332-Y336 HydrophobicContact CD2-CE2 4.03Å; L332-Y336 HydrophobicContact CG-CD2 4.02Å; L332-Y336 HydrophobicContact CG-CE2 3.58Å; L332-Y336 WeakPolarHBondContact O-CD2 3.37Å; L332-Y336 PolarHBondContact O-N 2.86Å; R333-Y336 PolarHBondContact O-N 2.77Å; Y336-A338 PolarHBondContact O-N 2.68Å; Y336-A338 VanDerWaalsContact O-N 3.08Å; Y336-G339 PolarHBondContact O-N 2.99Å; Y336-F364 HydrophobicContact CD1-CE2 4.48Å; Y336-F364 HydrophobicContact CD1-CZ 4.21Å; Y336-F364 HydrophobicContact CG-CZ 4.26Å; Y336-F364 WeakPolarHBondContact O-CD2 3.28Å; Y336-F364 WeakPolarHBondContact O-CE2 3.36Å
337	Q	86.9	Confident	81.4	Confident	116 Å²	116	68.4 Å²	68.4	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-58.6	-23.3	178.5	-76.4	176	-23.2	0	0	114.6	R333 G339	R333-Q337 VanDerWaalsContact NH1-CD 3.3Å; R333-Q337 WeakPolarHBondContact O-CB 3.09Å; R333-Q337 VanDerWaalsContact O-CG 3.28Å; R333-Q337 WeakPolarHBondContact O-CG 3.42Å; R333-Q337 PolarHBondContact O-N 2.74Å; Q337-G339 VanDerWaalsContact C-N 3.35Å
338	A	86	Confident	78.7	Confident	37 Å²	37	77.5 Å²	77.5	31%	0.306	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.4	174.8	0	0	0	0	0	113.9	V276 I277 V289 K334 C335 Y336	V276-A338 HydrophobicContact CG2-CB 3.92Å; I277-A338 HydrophobicContact CD1-CB 3.49Å; I277-A338 VanDerWaalsContact CD1-CB 3.49Å; V289-A338 HydrophobicContact CG1-CB 3.95Å; V289-A338 WeakPolarHBondContact CG2-O 3.46Å; K334-A338 WeakPolarHBondContact O-CB 3.15Å; K334-A338 PolarHBondContact O-N 3.18Å; K334-A338 VanDerWaalsContact O-N 3.14Å; C335-A338 PolarHBondContact O-N 3.37Å; Y336-A338 PolarHBondContact O-N 2.68Å; Y336-A338 VanDerWaalsContact O-N 3.08Å
339	G	82.8	Confident	76	Confident	31 Å²	31	86.1 Å²	86.1	32%	0.32	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	19.6	179.6	0	0	0	0	0	115.5	V289 Y336 Q337	V289-G339 VanDerWaalsContact CG2-C 3.44Å; Y336-G339 PolarHBondContact O-N 2.99Å; Q337-G339 VanDerWaalsContact C-N 3.35Å
340	M	91.7	Very high	73.2	Confident	3 Å²	3	93.4 Å²	93.4	2%	0.015	46%	0.46	C	S	.	.			trans	-71.6	132.1	178.4	-63.2	-173.4	75.9	0	0	111.5	I277 Y287 V289 T291 F299 C335	I277-M340 HydrophobicContact CD1-SD 4.21Å; I277-M340 HydrophobicContact CG1-SD 4.21Å; Y287-M340 HydrophobicContact CD2-CE 3.75Å; Y287-M340 HydrophobicContact CG-CE 4.33Å; Y287-M340 WeakPolarHBondContact O-CA 3.4Å; V289-M340 HydrophobicContact CB-CG 3.77Å; V289-M340 HydrophobicContact CG1-CG 4.39Å; V289-M340 HydrophobicContact CG2-CB 4.25Å; V289-M340 HydrophobicContact CG2-CG 3.49Å; V289-M340 VanDerWaalsContact CG2-CG 3.49Å; T291-M340 HydrophobicContact CG2-CE 4.19Å; T291-M340 HydrophobicContact CG2-SD 3.97Å; F299-M340 HydrophobicContact CB-CE 3.73Å; F299-M340 HydrophobicContact CB-SD 4.3Å; F299-M340 HydrophobicContact CD1-CB 3.9Å; F299-M340 HydrophobicContact CD1-CE 3.84Å; F299-M340 HydrophobicContact CD2-CB 4.07Å; F299-M340 HydrophobicContact CD2-SD 4.44Å; F299-M340 HydrophobicContact CE1-CB 3.61Å; F299-M340 HydrophobicContact CE2-CB 3.8Å; F299-M340 HydrophobicContact CG-CB 4.12Å; F299-M340 HydrophobicContact CG-CE 3.81Å; F299-M340 HydrophobicContact CG-SD 4.18Å; F299-M340 HydrophobicContact CZ-CB 3.57Å; F299-M340 WeakPolarHBondContact CZ-O 3.38Å; C335-M340 HydrophobicContact CB-CB 4.38Å; C335-M340 HydrophobicContact CB-CG 4.34Å; C335-M340 HydrophobicContact CB-SD 3.65Å; C335-M340 VanDerWaalsContact O-CB 3.29Å; C335-M340 WeakPolarHBondContact O-CB 3.36Å; C335-M340 WeakPolarHBondContact O-CG 3.3Å; C335-M340 PolarHBondContact O-N 3.22Å; C335-M340 VanDerWaalsContact O-N 3.13Å
341	M	85.6	Confident	70.2	Confident	110 Å²	110	97.6 Å²	97.6	54%	0.542	50%	0.504	S	S	.	.			trans	-148.1	144.9	178	54.2	167.6	61.6	0	0	113.9	Y287	Y287-M341 WeakPolarHBondContact CB-O 3.44Å; Y287-M341 WeakPolarHBondContact CD1-O 3.32Å; Y287-M341 PolarHBondContact O-N 2.92Å
342	L	82.3	Confident	67.3	Low	63 Å²	63	101 Å²	101	33%	0.33	54%	0.535	S	S	.	.	S	Bend	trans	-86	126.6	168.6	-91.9	67.4	0	0	0	109.6	Y287 F299 V303 E304	Y287-L342 HydrophobicContact CD1-CD1 3.73Å; Y287-L342 HydrophobicContact CD1-CG 4.17Å; Y287-L342 HydrophobicContact CE1-CD1 3.62Å; Y287-L342 HydrophobicContact CE1-CG 3.86Å; Y287-L342 HydrophobicContact CG-CD1 4.44Å; F299-L342 HydrophobicContact CD1-CD1 3.79Å; F299-L342 HydrophobicContact CE1-CD1 3.49Å; F299-L342 VanDerWaalsContact CE1-CD1 3.49Å; F299-L342 HydrophobicContact CZ-CD1 4.43Å; V303-L342 HydrophobicContact CB-CD1 4.23Å; V303-L342 HydrophobicContact CG1-CD1 4.28Å; V303-L342 HydrophobicContact CG1-CD2 4.22Å; V303-L342 HydrophobicContact CG2-CD1 4.36Å; E304-L342 HydrophobicContact CG-CD2 3.55Å
343	G	67.5	Low	64.6	Low	71 Å²	71	106.5 Å²	106.5	73%	0.732	56%	0.564	S	S	*	*			trans	144.1	-21.6	171.7	0	0	0	0	0	116.5	R345	G343-R345 PolarHBondContact O-N 3.02Å; G343-R345 VanDerWaalsContact O-N 3.1Å
344	G	46.8	Very low	61.7	Low	74 Å²	74	112.9 Å²	112.9	76%	0.763	59%	0.594	S	S	*	*			trans	-65.9	105.5	-170.8	0	0	0	0	0	115.7	K346	G344-K346 PolarHBondContact O-N 3.33Å
345	R	46.3	Very low	58.9	Low	245 Å²	245	113.1 Å²	113.1	93%	0.925	61%	0.609	S	S	*	*			trans	-78.2	103.9	170.7	-79.9	-168.4	-90.4	-157.4	-3	111.9	G343	G343-R345 PolarHBondContact O-N 3.02Å; G343-R345 VanDerWaalsContact O-N 3.1Å
346	K	49.1	Very low	56.2	Low	203 Å²	203	120.7 Å²	120.7	88%	0.883	65%	0.649	S	S	*	*			trans	52.1	76	157.6	-63.4	-178	178.3	175.7	0	118	G344 K348	G344-K346 PolarHBondContact O-N 3.33Å; K346-K348 PolarHBondContact O-N 3.36Å
347	L	41.2	Very low	53.9	Low	147 Å²	147	120.8 Å²	120.8	77%	0.77	67%	0.674	S	S	*	*			trans	-79.2	112.4	157	179.9	60.5	0	0	0	110.4	F350	L347-F350 HydrophobicContact CD2-CD2 4.13Å; L347-F350 HydrophobicContact CD2-CE2 4.37Å
348	K	38.7	Very low	51.3	Low	202 Å²	202	123.1 Å²	123.1	88%	0.878	69%	0.689	S	S	*	*			trans	-127.6	52.4	177.8	-156.6	-170.4	-178.3	-173.3	0	113.4	K346	K346-K348 PolarHBondContact O-N 3.36Å
349	R	39.7	Very low	48.9	Very low	226 Å²	226	125.8 Å²	125.8	85%	0.853	71%	0.711	S	S	*	*			trans	-158.2	100.8	165.5	-108.5	175.3	-177.5	171.5	0.4	110.7
350	F	35	Very low	46.5	Very low	163 Å²	163	130.6 Å²	130.6	72%	0.715	74%	0.737	S	S	*	*			trans	-149.7	75.7	159.5	-106	-74.1	0	0	0	109.7	L347 L353	L347-F350 HydrophobicContact CD2-CD2 4.13Å; L347-F350 HydrophobicContact CD2-CE2 4.37Å; F350-L353 HydrophobicContact CD1-CB 4.28Å; F350-L353 HydrophobicContact CE1-CB 4.13Å
351	G	32.3	Very low	43.7	Very low	88 Å²	88	135.5 Å²	135.5	91%	0.907	77%	0.772	S	S	*	*	S	Bend	trans	-112.2	18.9	170.9	0	0	0	0	0	112.6
352	A	35.4	Very low	41.2	Very low	88 Å²	88	138.5 Å²	138.5	73%	0.727	79%	0.789	S	S	*	*			trans	-149.7	46.1	-166	0	0	0	0	0	113.1
353	L	36.7	Very low	38.8	Very low	133 Å²	133	142.5 Å²	142.5	70%	0.696	81%	0.808	S	S	*	*			trans	-144	92.9	162.3	-143.3	89.7	0	0	0	109.6	F350	F350-L353 HydrophobicContact CD1-CB 4.28Å; F350-L353 HydrophobicContact CE1-CB 4.13Å
354	K	32.7	Very low	36.9	Very low	220 Å²	220	144.7 Å²	144.7	96%	0.957	80%	0.797	S	S	*	*			trans	-132.4	13.9	177.1	-145.2	-173.1	-179.2	-169.4	0	112.6
355	A	36.1	Very low	36	Very low	73 Å²	73	149.8 Å²	149.8	60%	0.603	80%	0.802	S	S	*	*	S	Bend	trans	-126	164.6	170.4	0	0	0	0	0	108
356	L	37.3	Very low	35.2	Very low	160 Å²	160	143 Å²	143	84%	0.838	79%	0.792	S	S	*	*			trans	64.5	70.2	-174.7	-48.3	-180	0	0	0	113.4	L358	L356-L358 PolarHBondContact O-N 2.72Å
357	G	41.8	Very low	34.3	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	78%	0.782	S	S	*	*			trans	-79.8	94.3	173.1	0	0	0	0	0	112.2
358	L	32.8	Very low	33.8	Very low	165 Å²	165	140 Å²	140	86%	0.864	78%	0.781	S	S	*	*			trans	-125.9	150.1	171.3	-72.6	171.5	0	0	0	110.8	L356	L356-L358 PolarHBondContact O-N 2.72Å
359	A	34.2	Very low	33.2	Very low	93 Å²	93	134.4 Å²	134.4	77%	0.769	77%	0.772	S	S	*	*			trans	-86.8	138.3	-169.2	0	0	0	0	0	112.9	S361	A359-S361 PolarHBondContact O-N 2.73Å
360	P	33.6	Very low	32.8	Very low	133 Å²	133	132.2 Å²	132.2	86%	0.864	77%	0.773	S	S	*	*			trans	-81.7	107.8	178.3	31.9	-33	0	0	0	111.7
361	S	31.8	Very low	32.5	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	78%	0.781	S	S	*	*			trans	-133	149.9	162.8	-75.8	0	0	0	0	108.3	A359	A359-S361 PolarHBondContact O-N 2.73Å
362	L	33.8	Very low	32.4	Very low	172 Å²	172	129.5 Å²	129.5	90%	0.901	77%	0.771	S	S	*	*			trans	69.1	120.8	-166.3	-46	176.3	0	0	0	113.4
363	M	32.4	Very low	32.2	Very low	148 Å²	148	133.3 Å²	133.3	73%	0.729	78%	0.78	S	S	*	*			trans	162.2	78.8	152	-84.8	-100.2	170.2	0	0	109.3
364	F	26.5	Very low	31.9	Very low	116 Å²	116	130.1 Å²	130.1	51%	0.509	78%	0.779	S	S	.	*			trans	-157	98.7	164.1	-154.2	-84.2	0	0	0	114	Y336	Y336-F364 HydrophobicContact CD1-CE2 4.48Å; Y336-F364 HydrophobicContact CD1-CZ 4.21Å; Y336-F364 HydrophobicContact CG-CZ 4.26Å; Y336-F364 WeakPolarHBondContact O-CD2 3.28Å; Y336-F364 WeakPolarHBondContact O-CE2 3.36Å
365	Q	29.3	Very low	31.8	Very low	182 Å²	182	129.8 Å²	129.8	85%	0.85	78%	0.78	S	S	*	*			trans	166.6	141	150.9	-96.9	175.9	56.5	0	0	107.7
366	S	28.7	Very low	31.6	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	79%	0.787	S	S	*	*			cis	-156.3	169.9	-20.6	-153.6	0	0	0	0	111.4
367	H	31.2	Very low	31.1	Very low	146 Å²	146	130.4 Å²	130.4	68%	0.676	79%	0.786	S	S	*	*			trans	-65.7	166	168.3	-82.4	-139.5	0	0	0	111.7
368	L	29.4	Very low	30.5	Very low	141 Å²	141	132.5 Å²	132.5	74%	0.738	78%	0.783	S	S	*	*			cis	-162.8	142.1	-0.6	-126	167.5	0	0	0	110
369	A	27.3	Very low	30	Very low	84 Å²	84	130.4 Å²	130.4	69%	0.694	78%	0.781	S	S	*	*			trans	-162.9	132.2	150.5	0	0	0	0	0	109.9
370	M	30.8	Very low	30.1	Very low	180 Å²	180	134.5 Å²	134.5	89%	0.887	79%	0.787	S	S	*	*			trans	-154.5	139.4	175.6	-85.7	-71.9	96.6	0	0	111
371	S	27.7	Very low	29.7	Very low	126 Å²	126	133 Å²	133	88%	0.881	78%	0.78	S	S	*	*			trans	-161.6	154.9	163.6	-169.3	0	0	0	0	110.1
372	G	30.7	Very low	29.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	78%	0.78	S	S	*	*			trans	83.6	78.4	153.1	0	0	0	0	0	118.8
373	D	30.6	Very low	29.6	Very low	168 Å²	168	128.1 Å²	128.1	90%	0.898	76%	0.756	S	S	*	*			trans	2.8	108.9	150.5	-57.9	-44.5	0	0	0	120.7
374	G	31.2	Very low	30	Very low	66 Å²	66	125.9 Å²	125.9	68%	0.68	75%	0.752	S	S	*	*				67.1	102.7	97.3	0	0	0	0	0	120.7
375	Q	30.3	Very low	30.5	Very low	212 Å²	212	124.1 Å²	124.1	99%	0.991	76%	0.755	S	S	*	*				-153.4	164.9	126	-115.3	163.1	90.8	0	0	110.8
376	A	31.7	Very low	31.2	Very low	89 Å²	89	120.4 Å²	120.4	74%	0.736	74%	0.739	S	S	*	*			trans	-113	146.4	-166.1	0	0	0	0	0	113
377	L	27.5	Very low	31.9	Very low	157 Å²	157	120.6 Å²	120.6	82%	0.822	73%	0.729	S	S	*	*				-174	145.1	125.2	-97.5	161.8	0	0	0	111.9
378	T	28	Very low	32.5	Very low	128 Å²	128	118.9 Å²	118.9	79%	0.785	72%	0.721	S	S	*	*			trans	30.5	105.4	156.3	54	0	0	0	0	121
379	S	24.4	Very low	33.5	Very low	120 Å²	120	117.2 Å²	117.2	84%	0.839	71%	0.712	S	S	*	*				-168.5	171.7	116.3	-160.6	0	0	0	0	111.9
380	M	34.3	Very low	34.5	Very low	179 Å²	179	117.6 Å²	117.6	88%	0.882	70%	0.7	S	S	*	*			trans	-103.1	123.4	-179.4	-70.9	-82.3	96.1	0	0	112.5
381	S	25.1	Very low	35.7	Very low	103 Å²	103	113.3 Å²	113.3	72%	0.72	68%	0.68	S	S	*	*			trans	-168.1	145.1	139	-170.8	0	0	0	0	109.9
382	C	30.6	Very low	37	Very low	111 Å²	111	107.8 Å²	107.8	75%	0.75	64%	0.642	S	S	*	*			trans	-148.7	98.8	176.4	-177.5	0	0	0	0	110.5
383	V	34.2	Very low	38.5	Very low	64 Å²	64	109.7 Å²	109.7	39%	0.388	63%	0.632	S	S	.	*			trans	-142	63.2	176.5	-154.3	0	0	0	0	112.1	S385 I386 H387	V383-S385 PolarHBondContact O-N 3.24Å; V383-I386 HydrophobicContact CB-CB 4.39Å; V383-I386 HydrophobicContact CG1-CB 3.62Å; V383-I386 HydrophobicContact CG1-CD1 3.79Å; V383-I386 HydrophobicContact CG1-CG1 3.65Å; V383-I386 PolarHBondContact O-N 3.32Å; V383-I386 VanDerWaalsContact O-N 3.14Å; V383-H387 WeakPolarHBondContact O-CB 3.4Å; V383-H387 PolarHBondContact O-N 2.99Å
384	P	40.3	Very low	40.8	Very low	100 Å²	100	105.8 Å²	105.8	65%	0.649	61%	0.609	S	S	*	*	H	α-helix	trans	-57.3	-43.2	-165	-25.1	34.9	0	0	0	114.5	H387 E388	P384-H387 PolarHBondContact O-N 3.47Å; P384-E388 PolarHBondContact O-N 3.42Å
385	S	37.5	Very low	43.5	Very low	80 Å²	80	103.7 Å²	103.7	56%	0.559	58%	0.581	S	S	*	*	H	α-helix	trans	-80.8	-14	-176.4	-162	0	0	0	0	114.5	V383	V383-S385 PolarHBondContact O-N 3.24Å
386	I	43.4	Very low	46.4	Very low	103 Å²	103	94.4 Å²	94.4	53%	0.528	54%	0.538	S	S	.	.	H	α-helix	trans	-88	-40.4	165.9	-59.2	-171.4	0	0	0	108.8	V383 E388 L389 Q390	V383-I386 HydrophobicContact CB-CB 4.39Å; V383-I386 HydrophobicContact CG1-CB 3.62Å; V383-I386 HydrophobicContact CG1-CD1 3.79Å; V383-I386 HydrophobicContact CG1-CG1 3.65Å; V383-I386 PolarHBondContact O-N 3.32Å; V383-I386 VanDerWaalsContact O-N 3.14Å; I386-E388 VanDerWaalsContact C-N 3.31Å; I386-E388 PolarHBondContact O-N 3.25Å; I386-L389 PolarHBondContact O-N 3.31Å; I386-L389 VanDerWaalsContact O-N 3.14Å; I386-Q390 HydrophobicContact CG2-CB 4.29Å; I386-Q390 WeakPolarHBondContact O-CB 3.45Å; I386-Q390 PolarHBondContact O-N 3.25Å
387	H	44.2	Very low	49.2	Very low	108 Å²	108	93.3 Å²	93.3	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-56.4	-40	-178.1	-123.4	-76.2	0	0	0	113.5	V383 P384 L391	V383-H387 WeakPolarHBondContact O-CB 3.4Å; V383-H387 PolarHBondContact O-N 2.99Å; P384-H387 PolarHBondContact O-N 3.47Å; H387-L391 WeakPolarHBondContact O-CB 3.46Å; H387-L391 PolarHBondContact O-N 2.84Å
388	E	44.5	Very low	52.3	Low	109 Å²	109	89 Å²	89	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-72.2	-40.3	178	-156.6	-171	153.5	0	0	112.4	P384 I386 L391 S392 R562	P384-E388 PolarHBondContact O-N 3.42Å; I386-E388 VanDerWaalsContact C-N 3.31Å; I386-E388 PolarHBondContact O-N 3.25Å; E388-L391 PolarHBondContact O-N 2.92Å; E388-S392 PolarHBondContact O-N 3.42Å; E388-S392 PolarHBondContact O-OG 3.32Å; E388-R562 IonicContact OE1-CZ 3.35Å; E388-R562 IonicContact OE1-NE 3.13Å; E388-R562 IonicContact OE1-NH2 2.73Å; E388-R562 PolarHBondContact OE1-NH2 2.87Å
389	L	48.8	Very low	55.5	Low	106 Å²	106	82.9 Å²	82.9	56%	0.555	46%	0.46	S	S	*	.	H	α-helix	trans	-68.4	-38.9	177.5	-155	78.5	0	0	0	111.5	I386 S392 Q393	I386-L389 PolarHBondContact O-N 3.31Å; I386-L389 VanDerWaalsContact O-N 3.14Å; L389-S392 WeakPolarHBondContact CA-OG 3.46Å; L389-S392 PolarHBondContact O-N 3.2Å; L389-S392 PolarHBondContact O-OG 3.29Å; L389-Q393 WeakPolarHBondContact O-CB 3.45Å; L389-Q393 PolarHBondContact O-N 3.35Å
390	Q	49.2	Very low	58.8	Low	92 Å²	92	81 Å²	81	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-68.1	-35.6	174.6	-175.6	177.4	1.9	0	0	111.4	I386 Q393 Q394	I386-Q390 HydrophobicContact CG2-CB 4.29Å; I386-Q390 WeakPolarHBondContact O-CB 3.45Å; I386-Q390 PolarHBondContact O-N 3.25Å; Q390-Q393 PolarHBondContact O-N 2.83Å; Q390-Q394 WeakPolarHBondContact O-CB 3.48Å; Q390-Q394 WeakPolarHBondContact O-CG 3.35Å; Q390-Q394 PolarHBondContact O-N 2.75Å
391	L	54.8	Low	61.6	Low	90 Å²	90	79 Å²	79	47%	0.471	43%	0.43	S	S	.	.	H	α-helix	trans	-70	-39.2	173.1	-173.5	66.6	0	0	0	111.4	H387 E388 Q394 I395	H387-L391 WeakPolarHBondContact O-CB 3.46Å; H387-L391 PolarHBondContact O-N 2.84Å; E388-L391 PolarHBondContact O-N 2.92Å; L391-Q394 WeakPolarHBondContact O-CB 3.46Å; L391-Q394 PolarHBondContact O-N 3.31Å; L391-I395 WeakPolarHBondContact O-CG1 3.41Å; L391-I395 PolarHBondContact O-N 2.95Å
392	S	56.8	Low	64.9	Low	11 Å²	11	75.7 Å²	75.7	8%	0.077	40%	0.404	C	S	.	.	H	α-helix	trans	-65.2	-41.6	171.5	51.6	0	0	0	0	112.4	E388 L389 Q394 I395 I396 E559	E388-S392 PolarHBondContact O-N 3.42Å; E388-S392 PolarHBondContact O-OG 3.32Å; L389-S392 WeakPolarHBondContact CA-OG 3.46Å; L389-S392 PolarHBondContact O-N 3.2Å; L389-S392 PolarHBondContact O-OG 3.29Å; S392-Q394 VanDerWaalsContact C-N 3.3Å; S392-Q394 PolarHBondContact O-N 2.9Å; S392-I395 PolarHBondContact O-N 3.29Å; S392-I396 PolarHBondContact O-N 2.97Å; S392-E559 WeakPolarHBondContact CA-OE2 3.39Å; S392-E559 WeakPolarHBondContact CB-OE2 3.28Å
393	Q	62	Low	67.9	Low	108 Å²	108	72.2 Å²	72.2	51%	0.505	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-37.5	173.4	-166.4	67.9	61	0	0	111.1	L389 Q390 I396 N397	L389-Q393 WeakPolarHBondContact O-CB 3.45Å; L389-Q393 PolarHBondContact O-N 3.35Å; Q390-Q393 PolarHBondContact O-N 2.83Å; Q393-I396 PolarHBondContact O-N 3.19Å; Q393-N397 PolarHBondContact NE2-OD1 3.26Å; Q393-N397 VanDerWaalsContact O-CB 3.24Å; Q393-N397 WeakPolarHBondContact O-CB 3.24Å; Q393-N397 PolarHBondContact O-N 3.32Å; Q393-N397 PolarHBondContact O-OD1 2.81Å
394	Q	78.1	Confident	70.3	Confident	86 Å²	86	71.3 Å²	71.3	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-41.7	172.5	-78.7	163.9	-6.3	0	0	111.7	Q390 L391 S392 I398	Q390-Q394 WeakPolarHBondContact O-CB 3.48Å; Q390-Q394 WeakPolarHBondContact O-CG 3.35Å; Q390-Q394 PolarHBondContact O-N 2.75Å; L391-Q394 WeakPolarHBondContact O-CB 3.46Å; L391-Q394 PolarHBondContact O-N 3.31Å; S392-Q394 VanDerWaalsContact C-N 3.3Å; S392-Q394 PolarHBondContact O-N 2.9Å; Q394-I398 VanDerWaalsContact O-CB 3.29Å; Q394-I398 WeakPolarHBondContact O-CB 3.07Å; Q394-I398 WeakPolarHBondContact O-CD1 3.22Å; Q394-I398 WeakPolarHBondContact O-CG1 3.3Å; Q394-I398 PolarHBondContact O-N 2.95Å
395	I	88.7	Confident	72.4	Confident	22 Å²	22	73.3 Å²	73.3	11%	0.113	37%	0.373	C	S	.	.	H	α-helix	trans	-68.2	-43.9	177.7	-64.5	163	0	0	0	111.2	L391 S392 I398 L399 Y556 E559	L391-I395 WeakPolarHBondContact O-CG1 3.41Å; L391-I395 PolarHBondContact O-N 2.95Å; S392-I395 PolarHBondContact O-N 3.29Å; I395-I398 PolarHBondContact O-N 3.35Å; I395-L399 HydrophobicContact CG2-CD1 4.09Å; I395-L399 HydrophobicContact CG2-CG 4.31Å; I395-L399 WeakPolarHBondContact O-CB 3.46Å; I395-L399 VanDerWaalsContact O-CG 3.28Å; I395-L399 WeakPolarHBondContact O-CG 3.48Å; I395-L399 PolarHBondContact O-N 3.28Å; I395-Y556 HydrophobicContact CG2-CD1 4.48Å; I395-Y556 HydrophobicContact CG2-CE1 3.97Å; I395-E559 HydrophobicContact CB-CG 4.25Å; I395-E559 HydrophobicContact CD1-CG 4.09Å; I395-E559 HydrophobicContact CG2-CG 3.87Å
396	I	90.4	Very high	74.6	Confident	17 Å²	17	75.1 Å²	75.1	9%	0.087	38%	0.376	C	S	.	.	H	α-helix	trans	-59.7	-50.7	174.1	-63.9	-60.7	0	0	0	110.7	S392 Q393 I398 L399 E400 E524 C528	S392-I396 PolarHBondContact O-N 2.97Å; Q393-I396 PolarHBondContact O-N 3.19Å; I396-I398 VanDerWaalsContact C-N 3.29Å; I396-I398 PolarHBondContact O-N 2.94Å; I396-L399 WeakPolarHBondContact O-CB 3.39Å; I396-L399 PolarHBondContact O-N 2.79Å; I396-L399 VanDerWaalsContact O-N 3.08Å; I396-E400 WeakPolarHBondContact O-CG 3.39Å; I396-E400 PolarHBondContact O-N 2.98Å; I396-E524 HydrophobicContact CD1-CB 4.29Å; I396-E524 HydrophobicContact CG2-CB 4.39Å; I396-E524 HydrophobicContact CG2-CG 4.1Å; I396-C528 WeakPolarHBondContact CD1-SG 3.39Å
397	N	90.7	Very high	76.8	Confident	65 Å²	65	71.3 Å²	71.3	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-37.5	178.3	-68.6	23.2	0	0	0	111.6	Q393 N401	Q393-N397 PolarHBondContact NE2-OD1 3.26Å; Q393-N397 VanDerWaalsContact O-CB 3.24Å; Q393-N397 WeakPolarHBondContact O-CB 3.24Å; Q393-N397 PolarHBondContact O-N 3.32Å; Q393-N397 PolarHBondContact O-OD1 2.81Å; N397-N401 WeakPolarHBondContact O-CB 3.28Å; N397-N401 PolarHBondContact O-N 2.85Å; N397-N401 PolarHBondContact O-ND2 3.45Å
398	I	93.4	Very high	79	Confident	67 Å²	67	72.4 Å²	72.4	34%	0.344	36%	0.358	S	S	.	.	H	α-helix	trans	-64.1	-48.4	173.7	-73.5	162.2	0	0	0	109.8	Q394 I395 I396 E400 N401 I402 P445	Q394-I398 VanDerWaalsContact O-CB 3.29Å; Q394-I398 WeakPolarHBondContact O-CB 3.07Å; Q394-I398 WeakPolarHBondContact O-CD1 3.22Å; Q394-I398 WeakPolarHBondContact O-CG1 3.3Å; Q394-I398 PolarHBondContact O-N 2.95Å; I395-I398 PolarHBondContact O-N 3.35Å; I396-I398 VanDerWaalsContact C-N 3.29Å; I396-I398 PolarHBondContact O-N 2.94Å; I398-E400 VanDerWaalsContact C-N 3.28Å; I398-E400 PolarHBondContact O-N 2.88Å; I398-N401 PolarHBondContact O-N 3.46Å; I398-N401 VanDerWaalsContact O-N 3.13Å; I398-I402 HydrophobicContact CG2-CG2 4.18Å; I398-I402 WeakPolarHBondContact O-CG1 3.3Å; I398-I402 WeakPolarHBondContact O-CG2 3.43Å; I398-I402 PolarHBondContact O-N 3.14Å; I398-P445 HydrophobicContact CD1-CG 4.27Å; I398-P445 HydrophobicContact CG2-CG 4Å
399	L	95.1	Very high	81	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.3	-40.1	178.1	-72.3	173.1	0	0	0	112	I395 I396 I402 E403 L444 L527 A531 Y556	I395-L399 HydrophobicContact CG2-CD1 4.09Å; I395-L399 HydrophobicContact CG2-CG 4.31Å; I395-L399 WeakPolarHBondContact O-CB 3.46Å; I395-L399 VanDerWaalsContact O-CG 3.28Å; I395-L399 WeakPolarHBondContact O-CG 3.48Å; I395-L399 PolarHBondContact O-N 3.28Å; I396-L399 WeakPolarHBondContact O-CB 3.39Å; I396-L399 PolarHBondContact O-N 2.79Å; I396-L399 VanDerWaalsContact O-N 3.08Å; L399-I402 HydrophobicContact CD2-CD1 4.35Å; L399-E403 WeakPolarHBondContact O-CG 3.43Å; L399-L444 HydrophobicContact CD2-CD2 3.36Å; L399-L527 HydrophobicContact CB-CB 4.07Å; L399-L527 HydrophobicContact CB-CD1 4.32Å; L399-L527 HydrophobicContact CB-CD2 4.43Å; L399-L527 HydrophobicContact CD1-CB 4.25Å; L399-A531 HydrophobicContact CD2-CB 4.08Å; L399-Y556 HydrophobicContact CD1-CD1 4.38Å; L399-Y556 HydrophobicContact CD1-CE1 4.23Å; L399-Y556 HydrophobicContact CD2-CE1 4.13Å
400	E	93.1	Very high	82.7	Confident	79 Å²	79	64.3 Å²	64.3	37%	0.369	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-47.4	173.2	-70.4	178.2	143	0	0	112.5	I396 I398 I402 E403 L527	I396-E400 WeakPolarHBondContact O-CG 3.39Å; I396-E400 PolarHBondContact O-N 2.98Å; I398-E400 VanDerWaalsContact C-N 3.28Å; I398-E400 PolarHBondContact O-N 2.88Å; E400-I402 VanDerWaalsContact C-N 3.35Å; E400-I402 PolarHBondContact O-N 3.48Å; E400-E403 PolarHBondContact O-N 3.21Å; E400-L527 HydrophobicContact CB-CD1 4.34Å; E400-L527 HydrophobicContact CG-CD1 3.43Å; E400-L527 VanDerWaalsContact CG-CD1 3.43Å
401	N	92.9	Very high	84.4	Confident	137 Å²	137	61.7 Å²	61.7	73%	0.733	32%	0.315	S	S	*	.	H	α-helix	trans	-73.9	-19.3	-175.7	-79.2	-76.8	0	0	0	114.3	N397 I398	N397-N401 WeakPolarHBondContact O-CB 3.28Å; N397-N401 PolarHBondContact O-N 2.85Å; N397-N401 PolarHBondContact O-ND2 3.45Å; I398-N401 PolarHBondContact O-N 3.46Å; I398-N401 VanDerWaalsContact O-N 3.13Å
402	I	94.5	Very high	85.7	Confident	34 Å²	34	60.4 Å²	60.4	17%	0.174	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.3	176	69	171.5	0	0	0	113.6	I398 L399 E400 W440 L444	I398-I402 HydrophobicContact CG2-CG2 4.18Å; I398-I402 WeakPolarHBondContact O-CG1 3.3Å; I398-I402 WeakPolarHBondContact O-CG2 3.43Å; I398-I402 PolarHBondContact O-N 3.14Å; L399-I402 HydrophobicContact CD2-CD1 4.35Å; E400-I402 VanDerWaalsContact C-N 3.35Å; E400-I402 PolarHBondContact O-N 3.48Å; I402-W440 HydrophobicContact CD1-CG 4.49Å; I402-L444 HydrophobicContact CD1-CD2 3.67Å; I402-L444 HydrophobicContact CD1-CG 4.08Å
403	E	92.5	Very high	86.5	Confident	38 Å²	38	64.5 Å²	64.5	18%	0.178	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-58.8	137.7	-179.4	-81.8	-87.4	93.3	0	0	111.3	L399 E400 R523 L527 K530	L399-E403 WeakPolarHBondContact O-CG 3.43Å; E400-E403 PolarHBondContact O-N 3.21Å; E403-R523 VanDerWaalsContact CG-NH2 3.32Å; E403-R523 IonicContact OE2-CZ 2.72Å; E403-R523 IonicContact OE2-NH1 3.73Å; E403-R523 PolarHBondContact OE2-NH1 3.11Å; E403-R523 IonicContact OE2-NH2 3.89Å; E403-R523 PolarHBondContact OE2-NH2 3.31Å; E403-L527 VanDerWaalsContact CD-CD2 3.41Å; E403-L527 HydrophobicContact CG-CD2 3.45Å; E403-L527 VanDerWaalsContact CG-CD2 3.45Å; E403-K530 IonicContact OE1-NZ 2.64Å; E403-K530 PolarHBondContact OE1-NZ 3.49Å; E403-K530 IonicContact OE2-NZ 2.96Å
404	P	85.9	Confident	87.1	Confident	45 Å²	45	67 Å²	67	29%	0.292	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-67.6	143.8	-174.8	29.1	-35.6	0	0	0	111.3	W436	P404-W436 HydrophobicContact CB-CB 3.89Å; P404-W436 HydrophobicContact CB-CD2 3.74Å; P404-W436 HydrophobicContact CB-CE3 3.52Å; P404-W436 HydrophobicContact CB-CG 3.92Å; P404-W436 HydrophobicContact CB-CZ3 4.22Å
405	E	82.9	Confident	86.9	Confident	142 Å²	142	67.5 Å²	67.5	66%	0.664	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-59.8	161.7	170	-69.8	165.2	-145.8	0	0	111.2	V407 W436	E405-V407 WeakPolarHBondContact O-CG2 3.25Å; E405-V407 PolarHBondContact O-N 3.14Å; E405-V407 VanDerWaalsContact O-N 3.09Å; E405-W436 HydrophobicContact CB-CH2 3.9Å; E405-W436 HydrophobicContact CB-CZ2 3.94Å; E405-W436 HydrophobicContact CG-CH2 3.95Å; E405-W436 HydrophobicContact CG-CZ2 4.42Å
406	I	85.8	Confident	86.1	Confident	119 Å²	119	70.8 Å²	70.8	61%	0.61	37%	0.371	S	S	*	.			trans	-63.5	113.9	-175.4	-61.5	178.4	0	0	0	110.2	Y408 P488	I406-Y408 HydrophobicContact CB-CE2 4.36Å; I406-Y408 HydrophobicContact CG2-CD2 4.42Å; I406-Y408 HydrophobicContact CG2-CE2 3.9Å; I406-Y408 WeakPolarHBondContact O-CD2 3.36Å; I406-P488 HydrophobicContact CG2-CG 3.25Å
407	V	89.3	Confident	85.1	Confident	23 Å²	23	75.3 Å²	75.3	14%	0.139	39%	0.392	C	S	.	.			trans	-89	120	-179.3	-172	0	0	0	0	110.7	E405 L429 K432 Q433 W436 A487	E405-V407 WeakPolarHBondContact O-CG2 3.25Å; E405-V407 PolarHBondContact O-N 3.14Å; E405-V407 VanDerWaalsContact O-N 3.09Å; V407-L429 HydrophobicContact CB-CD1 4.41Å; V407-L429 HydrophobicContact CG1-CD1 3.84Å; V407-K432 HydrophobicContact CG1-CB 3.53Å; V407-K432 HydrophobicContact CG1-CD 4.09Å; V407-K432 HydrophobicContact CG1-CG 4.46Å; V407-Q433 HydrophobicContact CB-CG 4.21Å; V407-Q433 HydrophobicContact CG1-CG 4.14Å; V407-Q433 HydrophobicContact CG2-CG 4.25Å; V407-W436 HydrophobicContact CG2-CG 4.27Å; V407-A487 WeakPolarHBondContact O-CB 3.44Å
408	Y	89.4	Confident	84.7	Confident	131 Å²	131	74.9 Å²	74.9	51%	0.514	39%	0.392	S	S	.	.			trans	-89.9	135.9	175.7	-69.2	-96.9	0	0	0	111.4	I406 K432 P488 D489	I406-Y408 HydrophobicContact CB-CE2 4.36Å; I406-Y408 HydrophobicContact CG2-CD2 4.42Å; I406-Y408 HydrophobicContact CG2-CE2 3.9Å; I406-Y408 WeakPolarHBondContact O-CD2 3.36Å; Y408-K432 WeakPolarHBondContact O-CD 3.38Å; Y408-K432 PolarHBondContact O-NZ 2.91Å; Y408-P488 HydrophobicContact CD1-CB 4.27Å; Y408-P488 HydrophobicContact CD1-CG 4.17Å; Y408-P488 HydrophobicContact CE1-CB 3.78Å; Y408-P488 HydrophobicContact CE1-CG 3.81Å; Y408-D489 WeakPolarHBondContact CB-OD2 3.4Å; Y408-D489 HydrophobicContact CD1-CB 4.46Å
409	S	87.7	Confident	84.3	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.396	C	S	.	.			trans	-74.1	-31.8	178.7	64.6	0	0	0	0	112.5	Y411 R428 K432 D489 L490	S409-Y411 VanDerWaalsContact C-N 3.34Å; S409-Y411 VanDerWaalsContact OG-CB 3.24Å; S409-Y411 WeakPolarHBondContact OG-CB 3.33Å; S409-Y411 PolarHBondContact OG-N 2.96Å; S409-R428 PolarHBondContact O-NE 3.16Å; S409-R428 VanDerWaalsContact O-NE 3.08Å; S409-R428 PolarHBondContact O-NH2 3.36Å; S409-K432 PolarHBondContact O-NZ 3.09Å; S409-D489 WeakPolarHBondContact CB-OD1 3.38Å; S409-D489 PolarHBondContact N-OD1 2.9Å; S409-D489 PolarHBondContact N-OD2 3.29Å; S409-D489 PolarHBondContact OG-OD1 3.36Å; S409-D489 PolarHBondContact OG-OD2 3.17Å; S409-L490 WeakPolarHBondContact OG-CB 3.41Å
410	G	84.5	Confident	83.9	Confident	44 Å²	44	77.4 Å²	77.4	45%	0.454	41%	0.408	S	S	.	.			trans	73.3	24.3	-163.8	0	0	0	0	0	112.9	R428 D489	G410-R428 PolarHBondContact O-NH2 2.94Å; G410-D489 WeakPolarHBondContact CA-OD2 3.25Å; G410-D489 PolarHBondContact N-OD2 2.89Å
411	Y	84.4	Confident	83.7	Confident	37 Å²	37	75.8 Å²	75.8	15%	0.145	40%	0.401	C	S	.	.			trans	-69.7	132.9	177.3	-175.5	-110.6	0	0	0	110.6	S409 N413 L422 L490	S409-Y411 VanDerWaalsContact C-N 3.34Å; S409-Y411 VanDerWaalsContact OG-CB 3.24Å; S409-Y411 WeakPolarHBondContact OG-CB 3.33Å; S409-Y411 PolarHBondContact OG-N 2.96Å; Y411-N413 WeakPolarHBondContact CE1-OD1 3.4Å; Y411-L422 HydrophobicContact CE2-CD1 4.24Å; Y411-L490 HydrophobicContact CD1-CD1 3.6Å; Y411-L490 HydrophobicContact CD2-CD1 4.06Å; Y411-L490 HydrophobicContact CE1-CD1 3.92Å; Y411-L490 HydrophobicContact CE2-CD1 4.34Å; Y411-L490 HydrophobicContact CG-CB 4.47Å; Y411-L490 HydrophobicContact CG-CD1 3.67Å
412	D	81.1	Confident	83.6	Confident	64 Å²	64	70 Å²	70	34%	0.342	37%	0.37	S	S	.	.			trans	-106.9	105.9	-178.3	-178.4	3.9	0	0	0	109.4	L414 Q415	D412-L414 PolarHBondContact O-N 2.92Å; D412-L414 VanDerWaalsContact O-N 3.16Å; D412-L414 VanDerWaalsContact OD1-CB 3.29Å; D412-L414 WeakPolarHBondContact OD1-CB 3.45Å; D412-L414 PolarHBondContact OD1-N 3.14Å; D412-Q415 HydrophobicContact CB-CG 4.04Å; D412-Q415 PolarHBondContact O-N 3.41Å; D412-Q415 WeakPolarHBondContact OD2-CG 3.36Å; D412-Q415 PolarHBondContact OD2-NE2 3.11Å
413	N	73.8	Confident	83.5	Confident	97 Å²	97	68.8 Å²	68.8	52%	0.519	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-0.5	-179	-66.5	-91.9	0	0	0	112.8	Y411 D489	Y411-N413 WeakPolarHBondContact CE1-OD1 3.4Å; N413-D489 PolarHBondContact ND2-O 3.48Å; N413-D489 VanDerWaalsContact ND2-O 3.17Å
414	L	75.3	Confident	83.5	Confident	161 Å²	161	68.3 Å²	68.3	84%	0.843	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.9	174.2	-52.9	177.9	0	0	0	113	D412	D412-L414 PolarHBondContact O-N 2.92Å; D412-L414 VanDerWaalsContact O-N 3.16Å; D412-L414 VanDerWaalsContact OD1-CB 3.29Å; D412-L414 WeakPolarHBondContact OD1-CB 3.45Å; D412-L414 PolarHBondContact OD1-N 3.14Å
415	Q	72.8	Confident	83.9	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.444	35%	0.353	S	S	.	.	S	Bend	trans	-79.7	151.8	177.5	-71.9	179.5	31.9	0	0	111.6	D412	D412-Q415 HydrophobicContact CB-CG 4.04Å; D412-Q415 PolarHBondContact O-N 3.41Å; D412-Q415 WeakPolarHBondContact OD2-CG 3.36Å; D412-Q415 PolarHBondContact OD2-NE2 3.11Å
416	P	71.7	Confident	84.4	Confident	92 Å²	92	60.9 Å²	60.9	60%	0.597	33%	0.326	S	S	*	.			trans	-59.5	142.8	178.2	24.7	-34.6	0	0	0	111.5	V418	P416-V418 HydrophobicContact CB-CG2 4.01Å; P416-V418 HydrophobicContact CG-CG2 4.05Å; P416-V418 PolarHBondContact O-N 3.35Å
417	E	70	Confident	84.9	Confident	112 Å²	112	55.8 Å²	55.8	52%	0.523	30%	0.3	S	S	.	.			trans	-69.1	68.1	179.9	-62.9	-164	133.8	0	0	112.1	R499	E417-R499 IonicContact OE2-CZ 2.79Å; E417-R499 IonicContact OE2-NH1 3.99Å; E417-R499 PolarHBondContact OE2-NH1 3.34Å
418	V	82.8	Confident	85.1	Confident	56 Å²	56	59.5 Å²	59.5	34%	0.339	31%	0.311	S	S	.	.			trans	-100.9	125.9	178.7	-162.4	0	0	0	0	110.1	P416 H420 L421	P416-V418 HydrophobicContact CB-CG2 4.01Å; P416-V418 HydrophobicContact CG-CG2 4.05Å; P416-V418 PolarHBondContact O-N 3.35Å; V418-H420 VanDerWaalsContact C-N 3.29Å; V418-H420 VanDerWaalsContact CG1-CE1 3.41Å; V418-H420 WeakPolarHBondContact CG1-CE1 3.48Å; V418-H420 PolarHBondContact O-N 3.16Å; V418-L421 HydrophobicContact CB-CD1 4.08Å; V418-L421 HydrophobicContact CB-CG 4.26Å; V418-L421 HydrophobicContact CG2-CD1 4.2Å; V418-L421 PolarHBondContact O-N 3.4Å
419	P	84.2	Confident	85.4	Confident	66 Å²	66	53.5 Å²	53.5	43%	0.429	29%	0.288	S	S	.	.	H	α-helix	trans	-50.8	-36.8	-170.4	-34.4	37.3	0	0	0	116.8	L423 P501	P419-L423 WeakPolarHBondContact O-CG 3.47Å; P419-L423 PolarHBondContact O-N 3Å; P419-P501 HydrophobicContact CB-CB 4.36Å; P419-P501 HydrophobicContact CB-CG 3.95Å
420	H	87.2	Confident	85.8	Confident	54 Å²	54	54.7 Å²	54.7	25%	0.25	30%	0.296	C	S	.	.	H	α-helix	trans	-72.8	-28.1	-178.9	65.5	-98.1	0	0	0	113.4	V418 L422 L423 N424 M609 V611	V418-H420 VanDerWaalsContact C-N 3.29Å; V418-H420 VanDerWaalsContact CG1-CE1 3.41Å; V418-H420 WeakPolarHBondContact CG1-CE1 3.48Å; V418-H420 PolarHBondContact O-N 3.16Å; H420-L422 VanDerWaalsContact C-N 3.35Å; H420-L422 PolarHBondContact O-N 3.08Å; H420-L423 PolarHBondContact O-N 3Å; H420-N424 WeakPolarHBondContact O-CB 3.48Å; H420-N424 PolarHBondContact O-N 2.57Å; H420-N424 PolarHBondContact O-OD1 2.79Å; H420-M609 WeakPolarHBondContact CB-O 3.48Å; H420-V611 HydrophobicContact CB-CG2 4.11Å
421	L	89.5	Confident	86.2	Confident	45 Å²	45	54.9 Å²	54.9	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-36.9	177.8	-62.1	177.5	0	0	0	111.7	V418 S425	V418-L421 HydrophobicContact CB-CD1 4.08Å; V418-L421 HydrophobicContact CB-CG 4.26Å; V418-L421 HydrophobicContact CG2-CD1 4.2Å; V418-L421 PolarHBondContact O-N 3.4Å; L421-S425 WeakPolarHBondContact O-CB 3.4Å; L421-S425 PolarHBondContact O-N 3.48Å; L421-S425 PolarHBondContact O-OG 2.98Å
422	L	90.3	Very high	86.7	Confident	15 Å²	15	56.5 Å²	56.5	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-65.4	-45.6	171.5	177.5	59	0	0	0	111.1	Y411 H420 S425 L426 L490 L492	Y411-L422 HydrophobicContact CE2-CD1 4.24Å; H420-L422 VanDerWaalsContact C-N 3.35Å; H420-L422 PolarHBondContact O-N 3.08Å; L422-S425 PolarHBondContact O-N 3.07Å; L422-L426 HydrophobicContact CD1-CD1 4.06Å; L422-L426 HydrophobicContact CD1-CG 4.22Å; L422-L426 HydrophobicContact CG-CD1 3.95Å; L422-L426 WeakPolarHBondContact O-CB 3.49Å; L422-L426 VanDerWaalsContact O-CG 3.29Å; L422-L426 WeakPolarHBondContact O-CG 3.48Å; L422-L426 PolarHBondContact O-N 3.25Å; L422-L490 HydrophobicContact CD1-CD1 3.83Å; L422-L492 HydrophobicContact CD1-CD1 4.46Å; L422-L492 HydrophobicContact CD1-CD2 4.3Å; L422-L492 HydrophobicContact CD2-CD1 4.34Å
423	L	93.3	Very high	87.4	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-42.9	177.9	-68	174.4	0	0	0	112.3	P419 H420 S425 L426 N427 P501 I502 F598 T602 M609 V611	P419-L423 WeakPolarHBondContact O-CG 3.47Å; P419-L423 PolarHBondContact O-N 3Å; H420-L423 PolarHBondContact O-N 3Å; L423-S425 VanDerWaalsContact C-N 3.32Å; L423-S425 PolarHBondContact O-N 3.44Å; L423-L426 PolarHBondContact O-N 3.36Å; L423-N427 WeakPolarHBondContact O-CB 3.43Å; L423-N427 PolarHBondContact O-N 3.22Å; L423-P501 HydrophobicContact CD1-CG 3.93Å; L423-P501 HydrophobicContact CD2-CG 4.12Å; L423-P501 HydrophobicContact CG-CG 3.94Å; L423-I502 HydrophobicContact CD2-CG2 3.94Å; L423-F598 HydrophobicContact CD2-CE1 3.91Å; L423-F598 HydrophobicContact CD2-CZ 4.14Å; L423-T602 HydrophobicContact CD1-CG2 4.28Å; L423-M609 HydrophobicContact CD1-CE 4.03Å; L423-V611 HydrophobicContact CB-CG1 3.98Å; L423-V611 HydrophobicContact CB-CG2 3.9Å; L423-V611 HydrophobicContact CD1-CG2 3.71Å; L423-V611 HydrophobicContact CG-CG2 4.46Å
424	N	92.7	Very high	88.5	Confident	29 Å²	29	49.9 Å²	49.9	16%	0.155	26%	0.257	C	S	.	.	H	α-helix	trans	-62.6	-40.7	175.6	-67.6	-2.9	0	0	0	111.4	H420 N427 R428 V611 E612	H420-N424 WeakPolarHBondContact O-CB 3.48Å; H420-N424 PolarHBondContact O-N 2.57Å; H420-N424 PolarHBondContact O-OD1 2.79Å; N424-N427 PolarHBondContact O-N 2.65Å; N424-R428 VanDerWaalsContact O-CB 3.3Å; N424-R428 WeakPolarHBondContact O-CB 3.4Å; N424-R428 PolarHBondContact O-N 3.37Å; N424-V611 WeakPolarHBondContact OD1-CA 3.39Å; N424-E612 PolarHBondContact OD1-N 3.37Å
425	S	92.8	Very high	89.4	Confident	12 Å²	12	46.4 Å²	46.4	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-35	177.7	-60.4	0	0	0	0	112.7	L421 L422 L423 L429	L421-S425 WeakPolarHBondContact O-CB 3.4Å; L421-S425 PolarHBondContact O-N 3.48Å; L421-S425 PolarHBondContact O-OG 2.98Å; L422-S425 PolarHBondContact O-N 3.07Å; L423-S425 VanDerWaalsContact C-N 3.32Å; L423-S425 PolarHBondContact O-N 3.44Å; S425-L429 WeakPolarHBondContact O-CB 3.34Å; S425-L429 PolarHBondContact O-N 3.44Å
426	L	94.5	Very high	90.4	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.094	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-46.5	172	-73.6	166.2	0	0	0	111.6	L422 L423 R428 L429 C430 F486 L490 I502	L422-L426 HydrophobicContact CD1-CD1 4.06Å; L422-L426 HydrophobicContact CD1-CG 4.22Å; L422-L426 HydrophobicContact CG-CD1 3.95Å; L422-L426 WeakPolarHBondContact O-CB 3.49Å; L422-L426 VanDerWaalsContact O-CG 3.29Å; L422-L426 WeakPolarHBondContact O-CG 3.48Å; L422-L426 PolarHBondContact O-N 3.25Å; L423-L426 PolarHBondContact O-N 3.36Å; L426-R428 VanDerWaalsContact C-N 3.34Å; L426-R428 PolarHBondContact O-N 3.11Å; L426-L429 CarbonylContact O-C 3.23Å; L426-L429 WeakPolarHBondContact O-CA 3.05Å; L426-L429 WeakPolarHBondContact O-CB 3.2Å; L426-L429 PolarHBondContact O-N 3.21Å; L426-L429 VanDerWaalsContact O-N 3.09Å; L426-C430 WeakPolarHBondContact O-CB 3.17Å; L426-C430 PolarHBondContact O-N 2.78Å; L426-C430 PolarHBondContact O-SG 3.39Å; L426-C430 VanDerWaalsContact O-SG 3.38Å; L426-F486 HydrophobicContact CD2-CD1 3.47Å; L426-F486 VanDerWaalsContact CD2-CD1 3.47Å; L426-F486 HydrophobicContact CD2-CE1 3.78Å; L426-F486 HydrophobicContact CD2-CG 4.04Å; L426-L490 HydrophobicContact CD2-CD2 3.7Å; L426-L490 HydrophobicContact CG-CD2 4.22Å; L426-I502 HydrophobicContact CD1-CD1 3.59Å
427	N	94.9	Very high	91.6	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-43.6	176.6	-75.4	-3.9	0	0	0	111.6	L423 N424 L429 C430 E431 V611 E612 F613 M617	L423-N427 WeakPolarHBondContact O-CB 3.43Å; L423-N427 PolarHBondContact O-N 3.22Å; N424-N427 PolarHBondContact O-N 2.65Å; N427-L429 VanDerWaalsContact C-N 3.32Å; N427-L429 PolarHBondContact O-N 3.09Å; N427-C430 WeakPolarHBondContact O-CB 3.38Å; N427-C430 PolarHBondContact O-N 2.93Å; N427-E431 PolarHBondContact O-N 2.82Å; N427-V611 WeakPolarHBondContact ND2-CG1 3.35Å; N427-E612 PolarHBondContact ND2-O 3.29Å; N427-F613 WeakPolarHBondContact ND2-CD1 3.46Å; N427-F613 VanDerWaalsContact ND2-CE1 3.34Å; N427-F613 WeakPolarHBondContact ND2-CE1 3.46Å; N427-F613 WeakPolarHBondContact ND2-CZ 3.46Å; N427-M617 HydrophobicContact CB-CE 4.35Å; N427-M617 HydrophobicContact CB-SD 4.01Å; N427-M617 WeakPolarHBondContact OD1-CE 3.48Å
428	R	94.4	Very high	92.8	Very high	100 Å²	100	37.1 Å²	37.1	38%	0.377	19%	0.188	S	C	.	.	H	α-helix	trans	-66.2	-30.7	174.6	-168.1	179.5	66.2	-160	-3.9	112.9	S409 G410 N424 L426 K432	S409-R428 PolarHBondContact O-NE 3.16Å; S409-R428 VanDerWaalsContact O-NE 3.08Å; S409-R428 PolarHBondContact O-NH2 3.36Å; G410-R428 PolarHBondContact O-NH2 2.94Å; N424-R428 VanDerWaalsContact O-CB 3.3Å; N424-R428 WeakPolarHBondContact O-CB 3.4Å; N424-R428 PolarHBondContact O-N 3.37Å; L426-R428 VanDerWaalsContact C-N 3.34Å; L426-R428 PolarHBondContact O-N 3.11Å; R428-K432 VanDerWaalsContact O-CG 3.3Å; R428-K432 WeakPolarHBondContact O-CG 3.24Å; R428-K432 PolarHBondContact O-N 3.43Å
429	L	95.3	Very high	93.4	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-71.6	-40.7	170.5	179	62.9	0	0	0	111.4	V407 S425 L426 N427 K432 Q433 F486 A487 L490	V407-L429 HydrophobicContact CB-CD1 4.41Å; V407-L429 HydrophobicContact CG1-CD1 3.84Å; S425-L429 WeakPolarHBondContact O-CB 3.34Å; S425-L429 PolarHBondContact O-N 3.44Å; L426-L429 CarbonylContact O-C 3.23Å; L426-L429 WeakPolarHBondContact O-CA 3.05Å; L426-L429 WeakPolarHBondContact O-CB 3.2Å; L426-L429 PolarHBondContact O-N 3.21Å; L426-L429 VanDerWaalsContact O-N 3.09Å; N427-L429 VanDerWaalsContact C-N 3.32Å; N427-L429 PolarHBondContact O-N 3.09Å; L429-K432 PolarHBondContact O-N 3.04Å; L429-Q433 HydrophobicContact CD1-CG 4.3Å; L429-Q433 WeakPolarHBondContact O-CB 3.5Å; L429-Q433 WeakPolarHBondContact O-CG 3.49Å; L429-Q433 PolarHBondContact O-N 3.34Å; L429-F486 HydrophobicContact CD2-CB 3.92Å; L429-A487 HydrophobicContact CD1-CB 4.01Å; L429-A487 HydrophobicContact CD2-CB 3.98Å; L429-L490 HydrophobicContact CD2-CD2 4.37Å
430	C	95.6	Very high	94.1	Very high	25 Å²	25	37 Å²	37	17%	0.169	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-47.2	176.9	-76.5	0	0	0	0	111.7	L426 N427 K432 Q433 L434 M467 M617	L426-C430 WeakPolarHBondContact O-CB 3.17Å; L426-C430 PolarHBondContact O-N 2.78Å; L426-C430 PolarHBondContact O-SG 3.39Å; L426-C430 VanDerWaalsContact O-SG 3.38Å; N427-C430 WeakPolarHBondContact O-CB 3.38Å; N427-C430 PolarHBondContact O-N 2.93Å; C430-K432 PolarHBondContact O-N 2.89Å; C430-Q433 CarbonylContact O-C 3.2Å; C430-Q433 PolarHBondContact O-N 3.04Å; C430-L434 VanDerWaalsContact O-CB 3.3Å; C430-L434 WeakPolarHBondContact O-CB 3.26Å; C430-L434 PolarHBondContact O-N 3.33Å; C430-M467 HydrophobicContact CB-CE 4.26Å; C430-M467 HydrophobicContact CB-SD 4.13Å; C430-M467 WeakPolarHBondContact O-CE 3.46Å; C430-M617 HydrophobicContact CB-CE 4.06Å; C430-M617 HydrophobicContact CB-SD 3.73Å
431	E	94.5	Very high	94.5	Very high	49 Å²	49	34.5 Å²	34.5	23%	0.229	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-48.1	175.6	-178.4	179.2	-117.2	0	0	112.1	N427 Q433 L434 L435 P614 M616	N427-E431 PolarHBondContact O-N 2.82Å; E431-Q433 VanDerWaalsContact C-N 3.29Å; E431-Q433 PolarHBondContact O-N 3.39Å; E431-L434 WeakPolarHBondContact O-CB 3.17Å; E431-L434 PolarHBondContact O-N 3.31Å; E431-L435 PolarHBondContact O-N 2.89Å; E431-P614 HydrophobicContact CB-CB 3.92Å; E431-P614 HydrophobicContact CB-CG 4.09Å; E431-P614 HydrophobicContact CG-CB 4.09Å; E431-P614 WeakPolarHBondContact OE1-CB 3.33Å; E431-P614 VanDerWaalsContact OE2-CB 3.31Å; E431-P614 WeakPolarHBondContact OE2-CB 3.45Å; E431-M616 HydrophobicContact CG-CB 4.41Å; E431-M616 PolarHBondContact OE1-N 3.36Å
432	K	94.8	Very high	94.8	Very high	70 Å²	70	36.6 Å²	36.6	30%	0.304	17%	0.171	S	C	.	.	H	α-helix	trans	-56.8	-43.4	176	-67.5	173.1	-171.2	-179.3	0	111.5	V407 Y408 S409 R428 L429 C430 W436	V407-K432 HydrophobicContact CG1-CB 3.53Å; V407-K432 HydrophobicContact CG1-CD 4.09Å; V407-K432 HydrophobicContact CG1-CG 4.46Å; Y408-K432 WeakPolarHBondContact O-CD 3.38Å; Y408-K432 PolarHBondContact O-NZ 2.91Å; S409-K432 PolarHBondContact O-NZ 3.09Å; R428-K432 VanDerWaalsContact O-CG 3.3Å; R428-K432 WeakPolarHBondContact O-CG 3.24Å; R428-K432 PolarHBondContact O-N 3.43Å; L429-K432 PolarHBondContact O-N 3.04Å; C430-K432 PolarHBondContact O-N 2.89Å; K432-W436 VanDerWaalsContact O-CD1 3.26Å; K432-W436 PolarHBondContact O-N 3.06Å
433	Q	95.8	Very high	95.1	Very high	21 Å²	21	38.1 Å²	38.1	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-69.5	-30.8	177	-71.3	-175.3	23.8	0	0	112.6	V407 L429 C430 E431 W436 I437 M467	V407-Q433 HydrophobicContact CB-CG 4.21Å; V407-Q433 HydrophobicContact CG1-CG 4.14Å; V407-Q433 HydrophobicContact CG2-CG 4.25Å; L429-Q433 HydrophobicContact CD1-CG 4.3Å; L429-Q433 WeakPolarHBondContact O-CB 3.5Å; L429-Q433 WeakPolarHBondContact O-CG 3.49Å; L429-Q433 PolarHBondContact O-N 3.34Å; C430-Q433 CarbonylContact O-C 3.2Å; C430-Q433 PolarHBondContact O-N 3.04Å; E431-Q433 VanDerWaalsContact C-N 3.29Å; E431-Q433 PolarHBondContact O-N 3.39Å; Q433-W436 PolarHBondContact O-N 3.37Å; Q433-I437 WeakPolarHBondContact O-CG1 3.49Å; Q433-I437 PolarHBondContact O-N 3.44Å; Q433-M467 HydrophobicContact CB-CE 3.97Å; Q433-M467 HydrophobicContact CB-CG 4.45Å
434	L	95.4	Very high	95.2	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-67.9	-42.6	177.1	-176.1	57.4	0	0	0	111.7	C430 E431 W436 I437 V438 W463 M467 M616 V620	C430-L434 VanDerWaalsContact O-CB 3.3Å; C430-L434 WeakPolarHBondContact O-CB 3.26Å; C430-L434 PolarHBondContact O-N 3.33Å; E431-L434 WeakPolarHBondContact O-CB 3.17Å; E431-L434 PolarHBondContact O-N 3.31Å; L434-W436 VanDerWaalsContact C-N 3.29Å; L434-W436 PolarHBondContact O-N 3.07Å; L434-I437 PolarHBondContact O-N 3.2Å; L434-I437 VanDerWaalsContact O-N 3.16Å; L434-V438 WeakPolarHBondContact O-CG2 3.42Å; L434-V438 PolarHBondContact O-N 3.35Å; L434-W463 HydrophobicContact CD1-CB 3.87Å; L434-W463 HydrophobicContact CD1-CE3 4.29Å; L434-W463 HydrophobicContact CD1-CG 4.5Å; L434-W463 HydrophobicContact CD2-CE3 4.44Å; L434-M467 HydrophobicContact CB-CE 3.8Å; L434-M616 HydrophobicContact CD2-CG 3.85Å; L434-M616 HydrophobicContact CD2-SD 4.29Å; L434-M616 HydrophobicContact CG-CG 4.37Å; L434-M616 HydrophobicContact CG-SD 4.17Å; L434-V620 HydrophobicContact CD2-CB 4.27Å; L434-V620 HydrophobicContact CD2-CG1 4.41Å; L434-V620 HydrophobicContact CD2-CG2 4.09Å
435	L	94.6	Very high	95.3	Very high	88 Å²	88	38.7 Å²	38.7	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-56.1	-44	170.5	-70.1	168.2	0	0	0	111.6	E431 V438 K439 M616	E431-L435 PolarHBondContact O-N 2.89Å; L435-V438 PolarHBondContact O-N 2.75Å; L435-K439 PolarHBondContact O-N 3.25Å; L435-K439 VanDerWaalsContact O-N 3.07Å; L435-M616 HydrophobicContact CD2-CE 3.52Å; L435-M616 HydrophobicContact CD2-SD 3.72Å; L435-M616 HydrophobicContact CG-SD 4.23Å
436	W	95.1	Very high	95.4	Very high	58 Å²	58	39.5 Å²	39.5	22%	0.22	20%	0.198	C	C	.	.	H	α-helix	trans	-68.1	-36.7	175.5	-82.6	107.1	0	0	0	113.1	P404 E405 V407 K432 Q433 L434 K439 W440	P404-W436 HydrophobicContact CB-CB 3.89Å; P404-W436 HydrophobicContact CB-CD2 3.74Å; P404-W436 HydrophobicContact CB-CE3 3.52Å; P404-W436 HydrophobicContact CB-CG 3.92Å; P404-W436 HydrophobicContact CB-CZ3 4.22Å; E405-W436 HydrophobicContact CB-CH2 3.9Å; E405-W436 HydrophobicContact CB-CZ2 3.94Å; E405-W436 HydrophobicContact CG-CH2 3.95Å; E405-W436 HydrophobicContact CG-CZ2 4.42Å; V407-W436 HydrophobicContact CG2-CG 4.27Å; K432-W436 VanDerWaalsContact O-CD1 3.26Å; K432-W436 PolarHBondContact O-N 3.06Å; Q433-W436 PolarHBondContact O-N 3.37Å; L434-W436 VanDerWaalsContact C-N 3.29Å; L434-W436 PolarHBondContact O-N 3.07Å; W436-K439 HydrophobicContact CE3-CD 3.85Å; W436-K439 HydrophobicContact CH2-CD 4.49Å; W436-K439 HydrophobicContact CZ3-CD 3.77Å; W436-K439 PolarHBondContact O-N 3.38Å; W436-W440 WeakPolarHBondContact O-CB 3.48Å; W436-W440 PolarHBondContact O-N 3.45Å
437	I	96.4	Very high	95.5	Very high	13 Å²	13	38.6 Å²	38.6	7%	0.067	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-43.6	172.2	-73.4	163.9	0	0	0	110.5	Q433 L434 K439 W440 S441 I459 L466 M467	Q433-I437 WeakPolarHBondContact O-CG1 3.49Å; Q433-I437 PolarHBondContact O-N 3.44Å; L434-I437 PolarHBondContact O-N 3.2Å; L434-I437 VanDerWaalsContact O-N 3.16Å; I437-K439 PolarHBondContact O-N 3.44Å; I437-W440 PolarHBondContact O-N 3.14Å; I437-S441 WeakPolarHBondContact O-CB 3.32Å; I437-S441 PolarHBondContact O-N 3.1Å; I437-S441 PolarHBondContact O-OG 2.85Å; I437-S441 VanDerWaalsContact O-OG 3.1Å; I437-I459 HydrophobicContact CG2-CG2 4.22Å; I437-L466 HydrophobicContact CD1-CB 3.99Å; I437-L466 HydrophobicContact CG1-CB 4.42Å; I437-L466 HydrophobicContact CG2-CD1 3.81Å; I437-M467 HydrophobicContact CD1-CE 3.99Å; I437-M467 HydrophobicContact CD1-CG 3.79Å
438	V	95.9	Very high	95.5	Very high	33 Å²	33	46.2 Å²	46.2	20%	0.2	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-42.9	176.1	173.1	0	0	0	0	111.6	L434 L435 K442 I459	L434-V438 WeakPolarHBondContact O-CG2 3.42Å; L434-V438 PolarHBondContact O-N 3.35Å; L435-V438 PolarHBondContact O-N 2.75Å; V438-K442 HydrophobicContact CG1-CD 4.07Å; V438-K442 WeakPolarHBondContact O-CB 3.46Å; V438-K442 WeakPolarHBondContact O-CD 3.21Å; V438-K442 VanDerWaalsContact O-CG 3.24Å; V438-K442 WeakPolarHBondContact O-CG 3.31Å; V438-K442 PolarHBondContact O-N 3.2Å; V438-I459 HydrophobicContact CG2-CD1 4.49Å; V438-I459 HydrophobicContact CG2-CG2 4.07Å
439	K	94.9	Very high	95.5	Very high	114 Å²	114	47.5 Å²	47.5	50%	0.496	24%	0.236	S	C	.	.	H	α-helix	trans	-66.9	-43.3	177	-178.8	179.2	168.9	-170.2	0	112.3	L435 W436 I437 S443	L435-K439 PolarHBondContact O-N 3.25Å; L435-K439 VanDerWaalsContact O-N 3.07Å; W436-K439 HydrophobicContact CE3-CD 3.85Å; W436-K439 HydrophobicContact CH2-CD 4.49Å; W436-K439 HydrophobicContact CZ3-CD 3.77Å; W436-K439 PolarHBondContact O-N 3.38Å; I437-K439 PolarHBondContact O-N 3.44Å; K439-S443 PolarHBondContact O-N 3.49Å; K439-S443 PolarHBondContact O-OG 3.5Å
440	W	97.4	Very high	95.5	Very high	6 Å²	6	47.5 Å²	47.5	2%	0.023	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-51.2	178.7	173.4	84.7	0	0	0	111.5	I402 W436 I437 K442 S443 L444 L466 K530 L534	I402-W440 HydrophobicContact CD1-CG 4.49Å; W436-W440 WeakPolarHBondContact O-CB 3.48Å; W436-W440 PolarHBondContact O-N 3.45Å; I437-W440 PolarHBondContact O-N 3.14Å; W440-K442 VanDerWaalsContact C-N 3.33Å; W440-K442 PolarHBondContact O-N 2.73Å; W440-S443 CarbonylContact O-C 3.58Å; W440-S443 WeakPolarHBondContact O-CA 3.22Å; W440-S443 WeakPolarHBondContact O-CB 3.47Å; W440-S443 PolarHBondContact O-N 3.42Å; W440-L444 HydrophobicContact CE3-CD1 4.23Å; W440-L444 HydrophobicContact CH2-CD1 3.85Å; W440-L444 HydrophobicContact CZ2-CD1 4.17Å; W440-L444 HydrophobicContact CZ2-CD2 4.1Å; W440-L444 HydrophobicContact CZ2-CG 4.5Å; W440-L444 HydrophobicContact CZ3-CD1 3.89Å; W440-L444 PolarHBondContact O-N 3.49Å; W440-L466 HydrophobicContact CH2-CD2 3.98Å; W440-L466 HydrophobicContact CZ3-CD1 3.86Å; W440-L466 HydrophobicContact CZ3-CD2 3.95Å; W440-K530 HydrophobicContact CH2-CD 4.33Å; W440-K530 HydrophobicContact CH2-CG 3.81Å; W440-K530 HydrophobicContact CZ2-CB 4.35Å; W440-K530 HydrophobicContact CZ2-CD 3.78Å; W440-K530 HydrophobicContact CZ2-CG 3.68Å; W440-L534 HydrophobicContact CZ3-CB 4.29Å; W440-L534 HydrophobicContact CZ3-CD2 4.14Å
441	S	97.4	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-42.6	178.2	-63	0	0	0	0	111.8	I437 S443 L444 F447 L534	I437-S441 WeakPolarHBondContact O-CB 3.32Å; I437-S441 PolarHBondContact O-N 3.1Å; I437-S441 PolarHBondContact O-OG 2.85Å; I437-S441 VanDerWaalsContact O-OG 3.1Å; S441-S443 PolarHBondContact O-N 2.84Å; S441-L444 PolarHBondContact O-N 2.88Å; S441-L444 VanDerWaalsContact O-N 3.15Å; S441-F447 VanDerWaalsContact C-CD1 3.49Å; S441-F447 VanDerWaalsContact O-CB 3.3Å; S441-F447 WeakPolarHBondContact O-CB 3.42Å; S441-F447 WeakPolarHBondContact O-CD1 3.27Å; S441-F447 VanDerWaalsContact O-CG 3.24Å; S441-F447 WeakPolarHBondContact O-CG 3.44Å; S441-L534 WeakPolarHBondContact OG-CD2 3.38Å
442	K	95.7	Very high	95.6	Very high	90 Å²	90	51.9 Å²	51.9	39%	0.391	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-7	173	-74.4	174	-179.7	173.9	0	114.4	V438 W440 R448	V438-K442 HydrophobicContact CG1-CD 4.07Å; V438-K442 WeakPolarHBondContact O-CB 3.46Å; V438-K442 WeakPolarHBondContact O-CD 3.21Å; V438-K442 VanDerWaalsContact O-CG 3.24Å; V438-K442 WeakPolarHBondContact O-CG 3.31Å; V438-K442 PolarHBondContact O-N 3.2Å; W440-K442 VanDerWaalsContact C-N 3.33Å; W440-K442 PolarHBondContact O-N 2.73Å; K442-R448 VanDerWaalsContact O-CZ 3.27Å; K442-R448 PolarHBondContact O-NE 3.06Å; K442-R448 PolarHBondContact O-NH2 3.46Å
443	S	95.7	Very high	95.6	Very high	47 Å²	47	52.4 Å²	52.4	33%	0.329	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-6.3	178.9	-52.3	0	0	0	0	113.1	K439 W440 S441	K439-S443 PolarHBondContact O-N 3.49Å; K439-S443 PolarHBondContact O-OG 3.5Å; W440-S443 CarbonylContact O-C 3.58Å; W440-S443 WeakPolarHBondContact O-CA 3.22Å; W440-S443 WeakPolarHBondContact O-CB 3.47Å; W440-S443 PolarHBondContact O-N 3.42Å; S441-S443 PolarHBondContact O-N 2.84Å
444	L	96.5	Very high	95.6	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	26%	0.259	C	S	.	.	S	Bend	trans	-71.1	132.8	175.6	-73.4	170.5	0	0	0	111.9	L399 I402 W440 S441 G446 F447 A531 L534 M552 Y556	L399-L444 HydrophobicContact CD2-CD2 3.36Å; I402-L444 HydrophobicContact CD1-CD2 3.67Å; I402-L444 HydrophobicContact CD1-CG 4.08Å; W440-L444 HydrophobicContact CE3-CD1 4.23Å; W440-L444 HydrophobicContact CH2-CD1 3.85Å; W440-L444 HydrophobicContact CZ2-CD1 4.17Å; W440-L444 HydrophobicContact CZ2-CD2 4.1Å; W440-L444 HydrophobicContact CZ2-CG 4.5Å; W440-L444 HydrophobicContact CZ3-CD1 3.89Å; W440-L444 PolarHBondContact O-N 3.49Å; S441-L444 PolarHBondContact O-N 2.88Å; S441-L444 VanDerWaalsContact O-N 3.15Å; L444-G446 PolarHBondContact O-N 2.7Å; L444-F447 HydrophobicContact CB-CB 4.07Å; L444-F447 PolarHBondContact O-N 2.99Å; L444-A531 HydrophobicContact CD2-CB 4.26Å; L444-L534 HydrophobicContact CD1-CD2 3.31Å; L444-M552 HydrophobicContact CB-CE 4.09Å; L444-M552 HydrophobicContact CD1-CE 4.25Å; L444-Y556 HydrophobicContact CD2-CE1 4.45Å
445	P	94.6	Very high	95.6	Very high	43 Å²	43	52.6 Å²	52.6	28%	0.279	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	131.7	165.3	-29.8	34.7	0	0	0	112.7	I398 F447 Y556	I398-P445 HydrophobicContact CD1-CG 4.27Å; I398-P445 HydrophobicContact CG2-CG 4Å; P445-F447 VanDerWaalsContact C-N 3.31Å; P445-F447 PolarHBondContact O-N 3.43Å; P445-Y556 WeakPolarHBondContact CB-OH 3.29Å; P445-Y556 WeakPolarHBondContact CD-OH 3.34Å; P445-Y556 PolarHBondContact O-OH 2.86Å
446	G	93.3	Very high	95.6	Very high	28 Å²	28	52.6 Å²	52.6	29%	0.289	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-28.1	-178.9	0	0	0	0	0	115.9	L444 R448 N449	L444-G446 PolarHBondContact O-N 2.7Å; G446-R448 VanDerWaalsContact C-N 3.34Å; G446-R448 PolarHBondContact O-N 2.98Å; G446-N449 VanDerWaalsContact O-CB 3.3Å; G446-N449 WeakPolarHBondContact O-CB 3.32Å; G446-N449 PolarHBondContact O-N 3.31Å
447	F	97.3	Very high	95.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62.2	-37.8	-169.5	-171.5	-102.7	0	0	0	114	S441 L444 P445 N449 L450 Q455 L458 I459 L534 M552	S441-F447 VanDerWaalsContact C-CD1 3.49Å; S441-F447 VanDerWaalsContact O-CB 3.3Å; S441-F447 WeakPolarHBondContact O-CB 3.42Å; S441-F447 WeakPolarHBondContact O-CD1 3.27Å; S441-F447 VanDerWaalsContact O-CG 3.24Å; S441-F447 WeakPolarHBondContact O-CG 3.44Å; L444-F447 HydrophobicContact CB-CB 4.07Å; L444-F447 PolarHBondContact O-N 2.99Å; P445-F447 VanDerWaalsContact C-N 3.31Å; P445-F447 PolarHBondContact O-N 3.43Å; F447-N449 PolarHBondContact O-N 3.45Å; F447-L450 HydrophobicContact CD2-CD1 4.05Å; F447-L450 HydrophobicContact CE2-CD1 4.37Å; F447-L450 WeakPolarHBondContact O-CB 3.46Å; F447-L450 WeakPolarHBondContact O-CG 3.39Å; F447-L450 PolarHBondContact O-N 3.33Å; F447-Q455 HydrophobicContact CD1-CB 4.48Å; F447-Q455 HydrophobicContact CD1-CG 4.08Å; F447-Q455 HydrophobicContact CE1-CB 3.6Å; F447-Q455 HydrophobicContact CE1-CG 3.68Å; F447-Q455 HydrophobicContact CE2-CB 4.37Å; F447-Q455 HydrophobicContact CE2-CG 4.43Å; F447-Q455 HydrophobicContact CZ-CB 3.54Å; F447-Q455 HydrophobicContact CZ-CG 3.89Å; F447-Q455 WeakPolarHBondContact CZ-O 3.42Å; F447-Q455 WeakPolarHBondContact O-CG 3.45Å; F447-L458 HydrophobicContact CE2-CB 4.42Å; F447-L458 HydrophobicContact CE2-CD1 4.35Å; F447-I459 HydrophobicContact CE1-CD1 4.03Å; F447-I459 HydrophobicContact CZ-CD1 3.74Å; F447-I459 HydrophobicContact CZ-CG1 3.89Å; F447-L534 HydrophobicContact CD2-CD2 3.85Å; F447-L534 HydrophobicContact CE2-CD1 4.33Å; F447-L534 HydrophobicContact CE2-CD2 3.81Å; F447-L534 HydrophobicContact CE2-CG 4.33Å; F447-M552 HydrophobicContact CB-CE 3.71Å; F447-M552 HydrophobicContact CB-SD 4.18Å; F447-M552 HydrophobicContact CD2-CE 3.99Å; F447-M552 HydrophobicContact CD2-SD 4.31Å; F447-M552 HydrophobicContact CG-CE 4.36Å
448	R	95	Very high	95.5	Very high	173 Å²	173	50.5 Å²	50.5	65%	0.653	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-68.2	-13.6	177.9	-63.1	-171	-172.4	-171.7	3.8	114	K442 G446 L450	K442-R448 VanDerWaalsContact O-CZ 3.27Å; K442-R448 PolarHBondContact O-NE 3.06Å; K442-R448 PolarHBondContact O-NH2 3.46Å; G446-R448 VanDerWaalsContact C-N 3.34Å; G446-R448 PolarHBondContact O-N 2.98Å; R448-L450 VanDerWaalsContact C-N 3.31Å
449	N	93.4	Very high	95.5	Very high	126 Å²	126	49.3 Å²	49.3	67%	0.674	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-82.9	-12.4	179.3	-56.5	2	0	0	0	111.9	G446 F447	G446-N449 VanDerWaalsContact O-CB 3.3Å; G446-N449 WeakPolarHBondContact O-CB 3.32Å; G446-N449 PolarHBondContact O-N 3.31Å; F447-N449 PolarHBondContact O-N 3.45Å
450	L	96.6	Very high	95.4	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.232	C	C	.	.	S	Bend	trans	-78.3	149	175.5	-51.5	179.3	0	0	0	110.5	F447 R448 D454 Q455 L458 A548 F549 M552	F447-L450 HydrophobicContact CD2-CD1 4.05Å; F447-L450 HydrophobicContact CE2-CD1 4.37Å; F447-L450 WeakPolarHBondContact O-CB 3.46Å; F447-L450 WeakPolarHBondContact O-CG 3.39Å; F447-L450 PolarHBondContact O-N 3.33Å; R448-L450 VanDerWaalsContact C-N 3.31Å; L450-D454 HydrophobicContact CB-CB 4.42Å; L450-Q455 HydrophobicContact CB-CG 3.95Å; L450-Q455 PolarHBondContact O-NE2 3.5Å; L450-L458 HydrophobicContact CD1-CD1 3.56Å; L450-A548 HydrophobicContact CD2-CB 3.87Å; L450-F549 HydrophobicContact CD2-CB 4.06Å; L450-M552 HydrophobicContact CD1-SD 4.13Å
451	H	96.6	Very high	95.1	Very high	69 Å²	69	45.8 Å²	45.8	32%	0.319	23%	0.233	S	C	.	.			trans	-54.1	141.4	172.2	-174.6	-59.7	0	0	0	110.6	N453 D454 Q455 K544 S545	H451-N453 VanDerWaalsContact C-N 3.35Å; H451-N453 PolarHBondContact CE1-OD1 3.25Å; H451-N453 PolarHBondContact ND1-N 3Å; H451-N453 VanDerWaalsContact ND1-N 3.14Å; H451-N453 PolarHBondContact ND1-OD1 2.85Å; H451-N453 PolarHBondContact O-N 3.25Å; H451-D454 HydrophobicContact CB-CB 4.45Å; H451-D454 WeakPolarHBondContact O-CA 3.34Å; H451-D454 VanDerWaalsContact O-CB 3.32Å; H451-D454 WeakPolarHBondContact O-CB 3.33Å; H451-D454 PolarHBondContact O-N 2.76Å; H451-Q455 PolarHBondContact O-N 3.24Å; H451-K544 HydrophobicContact CB-CB 4.04Å; H451-K544 HydrophobicContact CB-CD 4.39Å; H451-K544 VanDerWaalsContact CD2-CD 3.4Å; H451-K544 WeakPolarHBondContact CD2-CD 3.44Å; H451-K544 PolarHBondContact CE1-NZ 2.88Å; H451-K544 WeakPolarHBondContact NE2-CD 3.38Å; H451-K544 PolarHBondContact NE2-NZ 3.43Å; H451-S545 WeakPolarHBondContact CB-OG 3.37Å; H451-S545 PolarHBondContact N-OG 3.26Å
452	I	95.4	Very high	95	Very high	97 Å²	97	45.9 Å²	45.9	50%	0.497	23%	0.234	S	C	.	.	H	α-helix	trans	-56.4	-42.5	-174.4	-172.8	60.1	0	0	0	113.6	D454 Q455 M456	I452-D454 VanDerWaalsContact C-N 3.28Å; I452-D454 PolarHBondContact O-N 3.42Å; I452-Q455 WeakPolarHBondContact O-CB 3.46Å; I452-Q455 PolarHBondContact O-N 2.67Å; I452-M456 WeakPolarHBondContact O-CG 3.49Å; I452-M456 PolarHBondContact O-N 3.06Å
453	N	94.3	Very high	94.9	Very high	81 Å²	81	41.8 Å²	41.8	43%	0.433	22%	0.216	S	C	.	.	H	α-helix	trans	-55	-39.1	170	-60.2	34.9	0	0	0	113.2	H451 M456 T457 K544	H451-N453 VanDerWaalsContact C-N 3.35Å; H451-N453 PolarHBondContact CE1-OD1 3.25Å; H451-N453 PolarHBondContact ND1-N 3Å; H451-N453 VanDerWaalsContact ND1-N 3.14Å; H451-N453 PolarHBondContact ND1-OD1 2.85Å; H451-N453 PolarHBondContact O-N 3.25Å; N453-M456 PolarHBondContact O-N 2.91Å; N453-T457 VanDerWaalsContact O-CB 3.29Å; N453-T457 WeakPolarHBondContact O-CB 3.47Å; N453-T457 PolarHBondContact O-N 2.77Å; N453-T457 PolarHBondContact O-OG1 3Å; N453-K544 PolarHBondContact ND2-NZ 3.45Å
454	D	95.6	Very high	94.8	Very high	6 Å²	6	40 Å²	40	3%	0.032	20%	0.203	C	C	.	.	H	α-helix	trans	-71.7	-41	-179.9	-58.4	-6	0	0	0	110.2	L450 H451 I452 M456 T457 L458 L543 K544 S545	L450-D454 HydrophobicContact CB-CB 4.42Å; H451-D454 HydrophobicContact CB-CB 4.45Å; H451-D454 WeakPolarHBondContact O-CA 3.34Å; H451-D454 VanDerWaalsContact O-CB 3.32Å; H451-D454 WeakPolarHBondContact O-CB 3.33Å; H451-D454 PolarHBondContact O-N 2.76Å; I452-D454 VanDerWaalsContact C-N 3.28Å; I452-D454 PolarHBondContact O-N 3.42Å; D454-M456 VanDerWaalsContact C-N 3.34Å; D454-M456 PolarHBondContact O-N 2.75Å; D454-T457 PolarHBondContact O-N 3.21Å; D454-L458 WeakPolarHBondContact O-CB 3.21Å; D454-L458 VanDerWaalsContact O-CG 3.27Å; D454-L458 WeakPolarHBondContact O-CG 3.41Å; D454-L458 PolarHBondContact O-N 2.82Å; D454-L543 HydrophobicContact CB-CD2 4.1Å; D454-K544 PolarHBondContact OD1-N 3.24Å; D454-K544 PolarHBondContact OD2-N 3.34Å; D454-S545 WeakPolarHBondContact OD2-CB 3.3Å; D454-S545 PolarHBondContact OD2-N 2.76Å
455	Q	96.7	Very high	94.7	Very high	20 Å²	20	40.2 Å²	40.2	9%	0.093	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-48.8	172.1	-65.4	-178.8	37.6	0	0	111.1	F447 L450 H451 I452 I459	F447-Q455 HydrophobicContact CD1-CB 4.48Å; F447-Q455 HydrophobicContact CD1-CG 4.08Å; F447-Q455 HydrophobicContact CE1-CB 3.6Å; F447-Q455 HydrophobicContact CE1-CG 3.68Å; F447-Q455 HydrophobicContact CE2-CB 4.37Å; F447-Q455 HydrophobicContact CE2-CG 4.43Å; F447-Q455 HydrophobicContact CZ-CB 3.54Å; F447-Q455 HydrophobicContact CZ-CG 3.89Å; F447-Q455 WeakPolarHBondContact CZ-O 3.42Å; F447-Q455 WeakPolarHBondContact O-CG 3.45Å; L450-Q455 HydrophobicContact CB-CG 3.95Å; L450-Q455 PolarHBondContact O-NE2 3.5Å; H451-Q455 PolarHBondContact O-N 3.24Å; I452-Q455 WeakPolarHBondContact O-CB 3.46Å; I452-Q455 PolarHBondContact O-N 2.67Å; Q455-I459 WeakPolarHBondContact O-CG1 3.37Å; Q455-I459 PolarHBondContact O-N 2.71Å; Q455-I459 VanDerWaalsContact O-N 3.1Å
456	M	94.1	Very high	94.9	Very high	88 Å²	88	38.1 Å²	38.1	43%	0.433	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-45	176.6	-67	-60.6	-65.9	0	0	111.7	I452 N453 D454 L458 I459 Q460	I452-M456 WeakPolarHBondContact O-CG 3.49Å; I452-M456 PolarHBondContact O-N 3.06Å; N453-M456 PolarHBondContact O-N 2.91Å; D454-M456 VanDerWaalsContact C-N 3.34Å; D454-M456 PolarHBondContact O-N 2.75Å; M456-L458 PolarHBondContact O-N 3.09Å; M456-I459 PolarHBondContact O-N 2.71Å; M456-Q460 VanDerWaalsContact O-CB 3.29Å; M456-Q460 WeakPolarHBondContact O-CB 3.5Å; M456-Q460 VanDerWaalsContact O-CG 3.26Å; M456-Q460 WeakPolarHBondContact O-CG 3.27Å; M456-Q460 PolarHBondContact O-N 3.01Å
457	T	93.6	Very high	95	Very high	26 Å²	26	37.3 Å²	37.3	16%	0.16	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-40.8	-179.8	-58.1	0	0	0	0	112.2	N453 D454 Q460 Y461 P539	N453-T457 VanDerWaalsContact O-CB 3.29Å; N453-T457 WeakPolarHBondContact O-CB 3.47Å; N453-T457 PolarHBondContact O-N 2.77Å; N453-T457 PolarHBondContact O-OG1 3Å; D454-T457 PolarHBondContact O-N 3.21Å; T457-Q460 PolarHBondContact O-N 2.92Å; T457-Y461 HydrophobicContact CG2-CD2 3.67Å; T457-Y461 HydrophobicContact CG2-CE2 3.34Å; T457-Y461 PolarHBondContact O-N 2.97Å; T457-P539 HydrophobicContact CG2-CG 4.32Å
458	L	95.4	Very high	95	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-43.9	177.2	-72.6	168.6	0	0	0	111.9	F447 L450 D454 M456 Q460 S462 L534 L535 V538 L543 F549	F447-L458 HydrophobicContact CE2-CB 4.42Å; F447-L458 HydrophobicContact CE2-CD1 4.35Å; L450-L458 HydrophobicContact CD1-CD1 3.56Å; D454-L458 WeakPolarHBondContact O-CB 3.21Å; D454-L458 VanDerWaalsContact O-CG 3.27Å; D454-L458 WeakPolarHBondContact O-CG 3.41Å; D454-L458 PolarHBondContact O-N 2.82Å; M456-L458 PolarHBondContact O-N 3.09Å; L458-Q460 VanDerWaalsContact C-N 3.35Å; L458-S462 WeakPolarHBondContact O-CB 3.44Å; L458-S462 PolarHBondContact O-N 2.94Å; L458-S462 PolarHBondContact O-OG 2.82Å; L458-L534 HydrophobicContact CB-CD1 4.21Å; L458-L535 HydrophobicContact CD1-CD2 4.18Å; L458-V538 HydrophobicContact CD2-CG1 4.29Å; L458-L543 HydrophobicContact CD1-CD1 4.26Å; L458-L543 HydrophobicContact CD2-CD1 4.16Å; L458-L543 HydrophobicContact CG-CD1 4.37Å; L458-F549 HydrophobicContact CD1-CD2 3.91Å; L458-F549 HydrophobicContact CD1-CE2 4.2Å; L458-F549 HydrophobicContact CD2-CD2 4.16Å; L458-F549 HydrophobicContact CD2-CE2 3.67Å
459	I	95.5	Very high	95.2	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.046	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-46.7	173.7	-70.6	164.4	0	0	0	110	I437 V438 F447 Q455 M456 S462 W463 L534	I437-I459 HydrophobicContact CG2-CG2 4.22Å; V438-I459 HydrophobicContact CG2-CD1 4.49Å; V438-I459 HydrophobicContact CG2-CG2 4.07Å; F447-I459 HydrophobicContact CE1-CD1 4.03Å; F447-I459 HydrophobicContact CZ-CD1 3.74Å; F447-I459 HydrophobicContact CZ-CG1 3.89Å; Q455-I459 WeakPolarHBondContact O-CG1 3.37Å; Q455-I459 PolarHBondContact O-N 2.71Å; Q455-I459 VanDerWaalsContact O-N 3.1Å; M456-I459 PolarHBondContact O-N 2.71Å; I459-S462 PolarHBondContact O-N 3.35Å; I459-S462 PolarHBondContact O-OG 3.45Å; I459-W463 PolarHBondContact O-N 2.9Å; I459-L534 HydrophobicContact CG1-CD1 4.31Å
460	Q	92.9	Very high	95.4	Very high	32 Å²	32	24.1 Å²	24.1	15%	0.15	12%	0.123	C	C	.	.	H	α-helix	trans	-55.1	-59.5	176.7	-79.9	173.4	-13.9	0	0	110.9	M456 T457 L458 S462 V620 S623 Q624	M456-Q460 VanDerWaalsContact O-CB 3.29Å; M456-Q460 WeakPolarHBondContact O-CB 3.5Å; M456-Q460 VanDerWaalsContact O-CG 3.26Å; M456-Q460 WeakPolarHBondContact O-CG 3.27Å; M456-Q460 PolarHBondContact O-N 3.01Å; T457-Q460 PolarHBondContact O-N 2.92Å; L458-Q460 VanDerWaalsContact C-N 3.35Å; Q460-S462 VanDerWaalsContact C-N 3.29Å; Q460-S462 PolarHBondContact O-N 2.85Å; Q460-V620 HydrophobicContact CG-CG2 4.48Å; Q460-S623 PolarHBondContact NE2-OG 3.4Å; Q460-Q624 VanDerWaalsContact C-CD 3.41Å; Q460-Q624 VanDerWaalsContact C-OE1 3.25Å; Q460-Q624 HydrophobicContact CB-CG 3.93Å; Q460-Q624 HydrophobicContact CG-CG 4.49Å; Q460-Q624 PolarHBondContact O-NE2 3.03Å; Q460-Q624 PolarHBondContact O-OE1 3.34Å
461	Y	92.3	Very high	95.4	Very high	14 Å²	14	24.2 Å²	24.2	6%	0.055	12%	0.123	C	C	.	.	H	α-helix	trans	-71.8	-14.5	-176.3	-62.2	-35.2	0	0	0	115.3	T457 N465 T537 P539 Q624 K627 V633	T457-Y461 HydrophobicContact CG2-CD2 3.67Å; T457-Y461 HydrophobicContact CG2-CE2 3.34Å; T457-Y461 PolarHBondContact O-N 2.97Å; Y461-N465 PolarHBondContact O-ND2 3.31Å; Y461-T537 HydrophobicContact CG-CG2 4.39Å; Y461-P539 HydrophobicContact CE2-CB 4.04Å; Y461-P539 HydrophobicContact CE2-CG 4.49Å; Y461-Q624 HydrophobicContact CD1-CG 4.1Å; Y461-Q624 HydrophobicContact CE1-CG 4.14Å; Y461-K627 VanDerWaalsContact OH-CD 3.32Å; Y461-K627 WeakPolarHBondContact OH-CD 3.46Å; Y461-V633 HydrophobicContact CD1-CG1 4.33Å; Y461-V633 HydrophobicContact CD1-CG2 4.13Å; Y461-V633 HydrophobicContact CD2-CG1 4.14Å; Y461-V633 HydrophobicContact CE1-CG2 3.63Å; Y461-V633 HydrophobicContact CE2-CG1 4.36Å; Y461-V633 HydrophobicContact CE2-CG2 4.12Å; Y461-V633 HydrophobicContact CG-CG1 4.14Å
462	S	93.9	Very high	95.5	Very high	1 Å²	1	21 Å²	21	1%	0.007	11%	0.108	C	C	.	.	H	α-helix	trans	-102.4	-20.2	-177.6	67.4	0	0	0	0	115.5	L458 I459 Q460 M464 N465 L466 L534	L458-S462 WeakPolarHBondContact O-CB 3.44Å; L458-S462 PolarHBondContact O-N 2.94Å; L458-S462 PolarHBondContact O-OG 2.82Å; I459-S462 PolarHBondContact O-N 3.35Å; I459-S462 PolarHBondContact O-OG 3.45Å; Q460-S462 VanDerWaalsContact C-N 3.29Å; Q460-S462 PolarHBondContact O-N 2.85Å; S462-M464 PolarHBondContact O-N 3.32Å; S462-M464 VanDerWaalsContact O-N 3.15Å; S462-N465 WeakPolarHBondContact O-CA 3.49Å; S462-N465 WeakPolarHBondContact O-CB 3.34Å; S462-N465 PolarHBondContact O-N 2.89Å; S462-L466 PolarHBondContact O-N 3.46Å; S462-L534 VanDerWaalsContact OG-CD1 3.26Å; S462-L534 WeakPolarHBondContact OG-CD1 3.37Å
463	W	94.1	Very high	95.6	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.019	9%	0.089	C	C	.	.	H	α-helix	trans	-44.4	-53.4	-170.5	74.6	-54.2	0	0	0	114.8	L434 I459 N465 L466 M467 M617 V620 I621	L434-W463 HydrophobicContact CD1-CB 3.87Å; L434-W463 HydrophobicContact CD1-CE3 4.29Å; L434-W463 HydrophobicContact CD1-CG 4.5Å; L434-W463 HydrophobicContact CD2-CE3 4.44Å; I459-W463 PolarHBondContact O-N 2.9Å; W463-N465 VanDerWaalsContact C-N 3.34Å; W463-N465 PolarHBondContact O-N 3.39Å; W463-L466 PolarHBondContact O-N 2.97Å; W463-M467 HydrophobicContact CE3-CE 3.6Å; W463-M467 HydrophobicContact CE3-SD 3.86Å; W463-M467 HydrophobicContact CZ3-CE 4.13Å; W463-M467 HydrophobicContact CZ3-SD 4.17Å; W463-M467 WeakPolarHBondContact O-CG 3.25Å; W463-M467 PolarHBondContact O-N 3.24Å; W463-M617 HydrophobicContact CH2-CE 4.05Å; W463-M617 HydrophobicContact CH2-CG 4.19Å; W463-M617 HydrophobicContact CZ3-CE 4.33Å; W463-M617 HydrophobicContact CZ3-CG 4.24Å; W463-V620 HydrophobicContact CD2-CG1 4.06Å; W463-V620 HydrophobicContact CG-CG1 4.23Å; W463-I621 HydrophobicContact CH2-CD1 4.47Å; W463-I621 HydrophobicContact CH2-CG1 4.2Å; W463-I621 HydrophobicContact CZ2-CG1 4.11Å
464	M	94.1	Very high	95.6	Very high	10 Å²	10	16 Å²	16	5%	0.049	8%	0.077	C	C	.	.	H	α-helix	trans	-67.9	-33.9	-178.4	-166.5	66.1	76.2	0	0	112.1	S462 M467 V468 V592 V595 N596 C599	S462-M464 PolarHBondContact O-N 3.32Å; S462-M464 VanDerWaalsContact O-N 3.15Å; M464-M467 PolarHBondContact O-N 3Å; M464-V468 HydrophobicContact CG-CG2 4.28Å; M464-V468 VanDerWaalsContact O-CB 3.28Å; M464-V468 WeakPolarHBondContact O-CB 3.33Å; M464-V468 VanDerWaalsContact O-CG2 3.26Å; M464-V468 WeakPolarHBondContact O-CG2 3.39Å; M464-V468 PolarHBondContact O-N 2.88Å; M464-V468 HydrophobicContact SD-CG2 4.34Å; M464-V592 HydrophobicContact CB-CG1 3.87Å; M464-V592 HydrophobicContact CG-CG1 3.84Å; M464-V595 HydrophobicContact CE-CG1 4.03Å; M464-V595 HydrophobicContact CG-CB 4.28Å; M464-V595 HydrophobicContact CG-CG1 3.96Å; M464-V595 HydrophobicContact SD-CB 4.46Å; M464-V595 HydrophobicContact SD-CG1 3.53Å; M464-V595 VanDerWaalsContact SD-CG1 3.53Å; M464-N596 VanDerWaalsContact CB-OD1 3.23Å; M464-N596 WeakPolarHBondContact CB-OD1 3.44Å; M464-N596 WeakPolarHBondContact CG-OD1 3.35Å; M464-C599 HydrophobicContact CE-CB 4.22Å
465	N	95	Very high	95.7	Very high	9 Å²	9	15.8 Å²	15.8	5%	0.048	8%	0.076	C	C	.	.	H	α-helix	trans	-63.4	-44.6	172.9	-56.2	-93.8	0	0	0	110.1	Y461 S462 W463 F469 I533 H589 V592	Y461-N465 PolarHBondContact O-ND2 3.31Å; S462-N465 WeakPolarHBondContact O-CA 3.49Å; S462-N465 WeakPolarHBondContact O-CB 3.34Å; S462-N465 PolarHBondContact O-N 2.89Å; W463-N465 VanDerWaalsContact C-N 3.34Å; W463-N465 PolarHBondContact O-N 3.39Å; N465-F469 WeakPolarHBondContact O-CB 3.26Å; N465-F469 PolarHBondContact O-N 2.68Å; N465-I533 HydrophobicContact CB-CG2 3.43Å; N465-I533 VanDerWaalsContact CB-CG2 3.43Å; N465-H589 PolarHBondContact OD1-ND1 3.47Å; N465-V592 HydrophobicContact CB-CG1 4.41Å; N465-V592 HydrophobicContact CB-CG2 4.34Å; N465-V592 WeakPolarHBondContact OD1-CG1 3.27Å
466	L	97.1	Very high	95.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.9	-39.5	178.4	-67.5	170.5	0	0	0	112.7	I437 W440 S462 W463 S470 K530 I533 L534	I437-L466 HydrophobicContact CD1-CB 3.99Å; I437-L466 HydrophobicContact CG1-CB 4.42Å; I437-L466 HydrophobicContact CG2-CD1 3.81Å; W440-L466 HydrophobicContact CH2-CD2 3.98Å; W440-L466 HydrophobicContact CZ3-CD1 3.86Å; W440-L466 HydrophobicContact CZ3-CD2 3.95Å; S462-L466 PolarHBondContact O-N 3.46Å; W463-L466 PolarHBondContact O-N 2.97Å; L466-S470 VanDerWaalsContact O-CB 3.26Å; L466-S470 WeakPolarHBondContact O-CB 3.19Å; L466-S470 PolarHBondContact O-N 3.4Å; L466-S470 PolarHBondContact O-OG 3.16Å; L466-K530 HydrophobicContact CD2-CG 3.9Å; L466-K530 WeakPolarHBondContact CD2-O 3.34Å; L466-I533 HydrophobicContact CD2-CB 4.04Å; L466-I533 HydrophobicContact CD2-CG2 3.76Å; L466-I533 HydrophobicContact CG-CG2 4.08Å; L466-L534 HydrophobicContact CD1-CB 4.47Å; L466-L534 HydrophobicContact CD1-CD1 4.36Å
467	M	96.1	Very high	95.7	Very high	10 Å²	10	18.2 Å²	18.2	5%	0.049	9%	0.086	C	C	.	.	H	α-helix	trans	-64.4	-51	175	-72.9	-178.5	-175.9	0	0	111.4	C430 Q433 L434 I437 W463 M464 F469 S470 L471	C430-M467 HydrophobicContact CB-CE 4.26Å; C430-M467 HydrophobicContact CB-SD 4.13Å; C430-M467 WeakPolarHBondContact O-CE 3.46Å; Q433-M467 HydrophobicContact CB-CE 3.97Å; Q433-M467 HydrophobicContact CB-CG 4.45Å; L434-M467 HydrophobicContact CB-CE 3.8Å; I437-M467 HydrophobicContact CD1-CE 3.99Å; I437-M467 HydrophobicContact CD1-CG 3.79Å; W463-M467 HydrophobicContact CE3-CE 3.6Å; W463-M467 HydrophobicContact CE3-SD 3.86Å; W463-M467 HydrophobicContact CZ3-CE 4.13Å; W463-M467 HydrophobicContact CZ3-SD 4.17Å; W463-M467 WeakPolarHBondContact O-CG 3.25Å; W463-M467 PolarHBondContact O-N 3.24Å; M464-M467 PolarHBondContact O-N 3Å; M467-F469 PolarHBondContact O-N 2.81Å; M467-S470 PolarHBondContact O-N 3.34Å; M467-L471 VanDerWaalsContact O-CB 3.28Å; M467-L471 WeakPolarHBondContact O-CB 3.24Å; M467-L471 PolarHBondContact O-N 3.44Å
468	V	97.5	Very high	95.5	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.03	10%	0.102	C	C	.	.	H	α-helix	trans	-65.8	-37.5	-179.3	170.4	0	0	0	0	111.6	M464 L471 G472 I509 I512 M588 V592 V595	M464-V468 HydrophobicContact CG-CG2 4.28Å; M464-V468 VanDerWaalsContact O-CB 3.28Å; M464-V468 WeakPolarHBondContact O-CB 3.33Å; M464-V468 VanDerWaalsContact O-CG2 3.26Å; M464-V468 WeakPolarHBondContact O-CG2 3.39Å; M464-V468 PolarHBondContact O-N 2.88Å; M464-V468 HydrophobicContact SD-CG2 4.34Å; V468-L471 PolarHBondContact O-N 3.36Å; V468-G472 PolarHBondContact O-N 3.46Å; V468-I509 HydrophobicContact CG1-CG1 4.2Å; V468-I512 HydrophobicContact CG1-CD1 3.35Å; V468-M588 HydrophobicContact CG1-CE 4.18Å; V468-V592 HydrophobicContact CB-CG2 4.08Å; V468-V592 HydrophobicContact CG1-CG2 4.11Å; V468-V592 HydrophobicContact CG2-CG2 4.38Å; V468-V595 HydrophobicContact CG2-CG2 4.4Å
469	F	98.3	Very high	95.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-45.1	172.7	-166.3	-114.5	0	0	0	112.2	N465 M467 L471 G472 W473 F516 F526 M529 K530 I533 M588	N465-F469 WeakPolarHBondContact O-CB 3.26Å; N465-F469 PolarHBondContact O-N 2.68Å; M467-F469 PolarHBondContact O-N 2.81Å; F469-L471 VanDerWaalsContact C-N 3.35Å; F469-G472 PolarHBondContact O-N 3.28Å; F469-W473 PolarHBondContact O-N 3.22Å; F469-F516 HydrophobicContact CD2-CE1 4.4Å; F469-F516 AromaticContact CD2-CZ 3.73Å; F469-F516 HydrophobicContact CD2-CZ 3.73Å; F469-F516 HydrophobicContact CE1-CZ 4.47Å; F469-F516 AromaticContact CE2-CE1 3.66Å; F469-F516 HydrophobicContact CE2-CE1 3.66Å; F469-F516 AromaticContact CE2-CZ 3.37Å; F469-F516 HydrophobicContact CE2-CZ 3.37Å; F469-F516 HydrophobicContact CG-CZ 4.45Å; F469-F516 HydrophobicContact CZ-CE1 4.05Å; F469-F516 AromaticContact CZ-CZ 3.76Å; F469-F516 HydrophobicContact CZ-CZ 3.76Å; F469-F526 AromaticContact CD1-CD2 3.88Å; F469-F526 HydrophobicContact CD1-CD2 3.88Å; F469-F526 AromaticContact CD1-CE2 3.31Å; F469-F526 HydrophobicContact CD1-CE2 3.31Å; F469-F526 HydrophobicContact CD1-CZ 4.03Å; F469-F526 AromaticContact CE1-CD2 3.24Å; F469-F526 HydrophobicContact CE1-CD2 3.24Å; F469-F526 AromaticContact CE1-CE2 3.2Å; F469-F526 HydrophobicContact CE1-CE2 3.2Å; F469-F526 HydrophobicContact CE1-CG 4.14Å; F469-F526 HydrophobicContact CE1-CZ 4.09Å; F469-F526 WeakPolarHBondContact CE1-O 3.24Å; F469-F526 HydrophobicContact CG-CE2 4.21Å; F469-F526 AromaticContact CZ-CD2 3.73Å; F469-F526 HydrophobicContact CZ-CD2 3.73Å; F469-F526 HydrophobicContact CZ-CE2 4.06Å; F469-M529 HydrophobicContact CE1-CB 3.99Å; F469-M529 HydrophobicContact CE2-CB 4.4Å; F469-M529 HydrophobicContact CE2-CE 4.02Å; F469-M529 HydrophobicContact CZ-CB 3.49Å; F469-M529 VanDerWaalsContact CZ-CB 3.49Å; F469-M529 HydrophobicContact CZ-CE 3.98Å; F469-M529 HydrophobicContact CZ-CG 4.49Å; F469-M529 HydrophobicContact CZ-SD 4.33Å; F469-K530 HydrophobicContact CD1-CB 3.92Å; F469-K530 HydrophobicContact CD1-CG 4.21Å; F469-K530 HydrophobicContact CE1-CB 3.8Å; F469-I533 HydrophobicContact CB-CD1 3.88Å; F469-I533 HydrophobicContact CD1-CD1 3.68Å; F469-I533 HydrophobicContact CD2-CD1 3.37Å; F469-I533 HydrophobicContact CE1-CD1 3.99Å; F469-I533 HydrophobicContact CE2-CD1 3.67Å; F469-I533 HydrophobicContact CG-CD1 3.37Å; F469-I533 HydrophobicContact CZ-CD1 4Å; F469-M588 HydrophobicContact CB-CE 3.81Å; F469-M588 HydrophobicContact CD2-CE 3.79Å; F469-M588 HydrophobicContact CD2-SD 3.59Å; F469-M588 VanDerWaalsContact CD2-SD 3.59Å; F469-M588 HydrophobicContact CE2-SD 4.22Å; F469-M588 HydrophobicContact CG-CE 4.31Å
470	S	97.8	Very high	95	Very high	17 Å²	17	27.1 Å²	27.1	12%	0.119	14%	0.137	C	C	.	.	H	α-helix	trans	-69.6	-32.6	178.9	-55.5	0	0	0	0	112.3	L466 M467 W473 R474	L466-S470 VanDerWaalsContact O-CB 3.26Å; L466-S470 WeakPolarHBondContact O-CB 3.19Å; L466-S470 PolarHBondContact O-N 3.4Å; L466-S470 PolarHBondContact O-OG 3.16Å; M467-S470 PolarHBondContact O-N 3.34Å; S470-W473 PolarHBondContact O-N 3.01Å; S470-R474 WeakPolarHBondContact O-CG 3.36Å; S470-R474 PolarHBondContact O-N 2.93Å; S470-R474 PolarHBondContact O-NH1 3.48Å
471	L	97.6	Very high	94.7	Very high	9 Å²	9	28.6 Å²	28.6	5%	0.047	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-46.1	171.3	169.7	56.7	0	0	0	111.4	M467 V468 F469 W473 S475 Y485 F486 I509	M467-L471 VanDerWaalsContact O-CB 3.28Å; M467-L471 WeakPolarHBondContact O-CB 3.24Å; M467-L471 PolarHBondContact O-N 3.44Å; V468-L471 PolarHBondContact O-N 3.36Å; F469-L471 VanDerWaalsContact C-N 3.35Å; L471-W473 VanDerWaalsContact C-N 3.27Å; L471-W473 PolarHBondContact O-N 3.45Å; L471-S475 WeakPolarHBondContact O-CB 3.44Å; L471-S475 PolarHBondContact O-N 3.46Å; L471-S475 PolarHBondContact O-OG 2.64Å; L471-Y485 VanDerWaalsContact CD1-O 3.25Å; L471-Y485 WeakPolarHBondContact CD1-O 3.38Å; L471-F486 HydrophobicContact CD1-CB 4.45Å; L471-F486 HydrophobicContact CD1-CD1 4.04Å; L471-F486 HydrophobicContact CD1-CD2 4.35Å; L471-F486 HydrophobicContact CD1-CE1 4.38Å; L471-F486 HydrophobicContact CD1-CG 4.03Å; L471-F486 HydrophobicContact CD2-CD1 3.9Å; L471-F486 HydrophobicContact CD2-CE1 3.61Å; L471-F486 HydrophobicContact CD2-CZ 4.13Å; L471-I509 HydrophobicContact CD2-CD1 4.2Å; L471-I509 HydrophobicContact CD2-CG2 3.76Å; L471-I509 HydrophobicContact CG-CG2 4.04Å
472	G	97.8	Very high	94.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.2	-40.2	172.7	0	0	0	0	0	112.2	V468 F469 S475 F476 P513	V468-G472 PolarHBondContact O-N 3.46Å; F469-G472 PolarHBondContact O-N 3.28Å; G472-S475 PolarHBondContact O-N 3.46Å; G472-F476 WeakPolarHBondContact O-CB 3.1Å; G472-F476 PolarHBondContact O-N 3.02Å; G472-P513 WeakPolarHBondContact O-CB 3.28Å
473	W	97.6	Very high	94.4	Very high	22 Å²	22	36.6 Å²	36.6	8%	0.083	19%	0.185	C	C	.	.	H	α-helix	trans	-71.2	-44.8	-178.2	-178.2	-99.6	0	0	0	112.6	F469 S470 L471 S475 F476 Q477 F516 V521 R523 F526	F469-W473 PolarHBondContact O-N 3.22Å; S470-W473 PolarHBondContact O-N 3.01Å; L471-W473 VanDerWaalsContact C-N 3.27Å; L471-W473 PolarHBondContact O-N 3.45Å; W473-S475 VanDerWaalsContact C-N 3.3Å; W473-S475 PolarHBondContact O-N 2.88Å; W473-F476 HydrophobicContact CD2-CD1 4.49Å; W473-F476 AromaticContact CE3-CD1 3.82Å; W473-F476 HydrophobicContact CE3-CD1 3.82Å; W473-F476 HydrophobicContact CE3-CE1 4.27Å; W473-F476 HydrophobicContact CH2-CD1 4.28Å; W473-F476 HydrophobicContact CH2-CE1 4.01Å; W473-F476 AromaticContact CZ3-CD1 3.7Å; W473-F476 HydrophobicContact CZ3-CD1 3.7Å; W473-F476 AromaticContact CZ3-CE1 3.67Å; W473-F476 HydrophobicContact CZ3-CE1 3.67Å; W473-F476 PolarHBondContact O-N 3.13Å; W473-Q477 HydrophobicContact CD2-CG 4.14Å; W473-Q477 HydrophobicContact CG-CG 4.42Å; W473-Q477 HydrophobicContact CZ2-CG 3.89Å; W473-Q477 WeakPolarHBondContact O-CB 3.26Å; W473-Q477 VanDerWaalsContact O-CG 3.25Å; W473-Q477 WeakPolarHBondContact O-CG 3.29Å; W473-Q477 PolarHBondContact O-N 3.38Å; W473-F516 HydrophobicContact CB-CE2 3.95Å; W473-F516 HydrophobicContact CE3-CD2 4.11Å; W473-F516 HydrophobicContact CE3-CE2 4.18Å; W473-V521 HydrophobicContact CZ3-CB 4.24Å; W473-V521 HydrophobicContact CZ3-CG1 4.1Å; W473-R523 HydrophobicContact CZ2-CB 4.4Å; W473-F526 HydrophobicContact CB-CD2 3.69Å; W473-F526 HydrophobicContact CB-CE2 3.25Å; W473-F526 HydrophobicContact CB-CG 4.5Å; W473-F526 HydrophobicContact CB-CZ 3.74Å; W473-F526 HydrophobicContact CD2-CB 4.04Å; W473-F526 HydrophobicContact CD2-CD1 4.03Å; W473-F526 AromaticContact CD2-CD2 3.52Å; W473-F526 HydrophobicContact CD2-CD2 3.52Å; W473-F526 HydrophobicContact CD2-CE1 4.44Å; W473-F526 AromaticContact CD2-CE2 3.98Å; W473-F526 HydrophobicContact CD2-CE2 3.98Å; W473-F526 AromaticContact CD2-CG 3.55Å; W473-F526 HydrophobicContact CD2-CG 3.55Å; W473-F526 HydrophobicContact CD2-CZ 4.4Å; W473-F526 HydrophobicContact CE3-CB 3.67Å; W473-F526 AromaticContact CE3-CD2 3.48Å; W473-F526 HydrophobicContact CE3-CD2 3.48Å; W473-F526 VanDerWaalsContact CE3-CD2 3.48Å; W473-F526 HydrophobicContact CE3-CE2 4.3Å; W473-F526 AromaticContact CE3-CG 3.61Å; W473-F526 HydrophobicContact CE3-CG 3.61Å; W473-F526 HydrophobicContact CG-CD1 4.17Å; W473-F526 AromaticContact CG-CD2 3.61Å; W473-F526 HydrophobicContact CG-CD2 3.61Å; W473-F526 HydrophobicContact CG-CE1 4.09Å; W473-F526 AromaticContact CG-CE2 3.52Å; W473-F526 HydrophobicContact CG-CE2 3.52Å; W473-F526 AromaticContact CG-CG 3.95Å; W473-F526 HydrophobicContact CG-CG 3.95Å; W473-F526 AromaticContact CG-CZ 3.76Å; W473-F526 HydrophobicContact CG-CZ 3.76Å; W473-F526 HydrophobicContact CH2-CB 4.04Å; W473-F526 HydrophobicContact CZ2-CB 4.38Å; W473-F526 HydrophobicContact CZ3-CB 3.67Å; W473-F526 HydrophobicContact CZ3-CD2 4.36Å; W473-F526 HydrophobicContact CZ3-CG 4.13Å
474	R	95.7	Very high	94.4	Very high	52 Å²	52	36.4 Å²	36.4	20%	0.196	18%	0.184	C	C	.	.	H	α-helix	trans	-57.7	-45	171.3	-68.7	-173.7	-57.9	-91.4	11.4	111.2	S470 F476 Q477 N478 Y485 F486	S470-R474 WeakPolarHBondContact O-CG 3.36Å; S470-R474 PolarHBondContact O-N 2.93Å; S470-R474 PolarHBondContact O-NH1 3.48Å; R474-F476 PolarHBondContact O-N 2.96Å; R474-Q477 PolarHBondContact O-N 3.1Å; R474-N478 VanDerWaalsContact O-CB 3.25Å; R474-N478 WeakPolarHBondContact O-CB 3.38Å; R474-N478 PolarHBondContact O-N 3.05Å; R474-N478 PolarHBondContact O-OD1 3.23Å; R474-N478 VanDerWaalsContact O-OD1 3.07Å; R474-Y485 HydrophobicContact CB-CD1 3.72Å; R474-Y485 HydrophobicContact CB-CE1 4.48Å; R474-Y485 HydrophobicContact CB-CG 4.34Å; R474-Y485 HydrophobicContact CG-CD1 4.36Å; R474-Y485 PolarHBondContact NE-O 3.39Å; R474-F486 PolarHBondContact NE-O 3.13Å; R474-F486 PolarHBondContact NH2-O 2.85Å
475	S	96.6	Very high	94.5	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-45.4	-179.8	-54.1	0	0	0	0	111.5	L471 G472 W473 Q477 V479 Y485	L471-S475 WeakPolarHBondContact O-CB 3.44Å; L471-S475 PolarHBondContact O-N 3.46Å; L471-S475 PolarHBondContact O-OG 2.64Å; G472-S475 PolarHBondContact O-N 3.46Å; W473-S475 VanDerWaalsContact C-N 3.3Å; W473-S475 PolarHBondContact O-N 2.88Å; S475-Q477 PolarHBondContact O-N 3.39Å; S475-V479 VanDerWaalsContact O-CG2 3.24Å; S475-V479 WeakPolarHBondContact O-CG2 3.43Å; S475-V479 PolarHBondContact O-N 2.8Å; S475-V479 VanDerWaalsContact O-N 3.09Å; S475-Y485 PolarHBondContact OG-N 3.23Å
476	F	96.7	Very high	94.5	Very high	52 Å²	52	38 Å²	38	23%	0.228	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-36.1	174.8	167.5	-122.9	0	0	0	113.9	G472 W473 R474 P513 F516 A517	G472-F476 WeakPolarHBondContact O-CB 3.1Å; G472-F476 PolarHBondContact O-N 3.02Å; W473-F476 HydrophobicContact CD2-CD1 4.49Å; W473-F476 AromaticContact CE3-CD1 3.82Å; W473-F476 HydrophobicContact CE3-CD1 3.82Å; W473-F476 HydrophobicContact CE3-CE1 4.27Å; W473-F476 HydrophobicContact CH2-CD1 4.28Å; W473-F476 HydrophobicContact CH2-CE1 4.01Å; W473-F476 AromaticContact CZ3-CD1 3.7Å; W473-F476 HydrophobicContact CZ3-CD1 3.7Å; W473-F476 AromaticContact CZ3-CE1 3.67Å; W473-F476 HydrophobicContact CZ3-CE1 3.67Å; W473-F476 PolarHBondContact O-N 3.13Å; R474-F476 PolarHBondContact O-N 2.96Å; F476-P513 HydrophobicContact CB-CB 3.98Å; F476-F516 HydrophobicContact CB-CB 4.02Å; F476-F516 HydrophobicContact CB-CD2 4.05Å; F476-F516 HydrophobicContact CD1-CB 3.72Å; F476-F516 HydrophobicContact CD1-CD2 4.32Å; F476-F516 HydrophobicContact CD1-CG 4.4Å; F476-F516 HydrophobicContact CD2-CB 4.04Å; F476-F516 HydrophobicContact CE1-CB 4.16Å; F476-F516 HydrophobicContact CE2-CB 4.48Å; F476-F516 HydrophobicContact CG-CB 3.65Å; F476-F516 HydrophobicContact CG-CD2 4.4Å; F476-A517 HydrophobicContact CD2-CB 4.03Å; F476-A517 HydrophobicContact CE2-CB 3.88Å
477	Q	93.6	Very high	94.3	Very high	107 Å²	107	38 Å²	38	50%	0.5	19%	0.19	S	C	.	.	H	α-helix	trans	-85.9	-25.4	-177.6	-68	-70.4	-84.3	0	0	114	W473 R474 S475	W473-Q477 HydrophobicContact CD2-CG 4.14Å; W473-Q477 HydrophobicContact CG-CG 4.42Å; W473-Q477 HydrophobicContact CZ2-CG 3.89Å; W473-Q477 WeakPolarHBondContact O-CB 3.26Å; W473-Q477 VanDerWaalsContact O-CG 3.25Å; W473-Q477 WeakPolarHBondContact O-CG 3.29Å; W473-Q477 PolarHBondContact O-N 3.38Å; R474-Q477 PolarHBondContact O-N 3.1Å; S475-Q477 PolarHBondContact O-N 3.39Å
478	N	90.4	Very high	94	Very high	92 Å²	92	39.3 Å²	39.3	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-118.4	-18.1	-166.9	-60.5	119.1	0	0	0	115.4	R474 Y485	R474-N478 VanDerWaalsContact O-CB 3.25Å; R474-N478 WeakPolarHBondContact O-CB 3.38Å; R474-N478 PolarHBondContact O-N 3.05Å; R474-N478 PolarHBondContact O-OD1 3.23Å; R474-N478 VanDerWaalsContact O-OD1 3.07Å; N478-Y485 HydrophobicContact CB-CD2 3.66Å; N478-Y485 HydrophobicContact CB-CE2 3.71Å; N478-Y485 HydrophobicContact CB-CG 4.11Å
479	V	91.3	Very high	93.6	Very high	39 Å²	39	40.7 Å²	40.7	24%	0.236	21%	0.207	C	C	.	.	S	Bend	trans	-142.8	173.9	-176.8	-64.7	0	0	0	0	112.9	S475 Y485 I491	S475-V479 VanDerWaalsContact O-CG2 3.24Å; S475-V479 WeakPolarHBondContact O-CG2 3.43Å; S475-V479 PolarHBondContact O-N 2.8Å; S475-V479 VanDerWaalsContact O-N 3.09Å; V479-Y485 HydrophobicContact CG1-CD2 3.95Å; V479-I491 HydrophobicContact CG1-CG2 4.06Å
480	T	88.8	Confident	93.3	Very high	91 Å²	91	40.7 Å²	40.7	56%	0.558	21%	0.207	S	C	*	.			trans	-87.1	175.2	171.9	60.7	0	0	0	0	111.6	E482 Y483	T480-E482 PolarHBondContact O-N 3.13Å; T480-Y483 PolarHBondContact O-N 2.93Å
481	S	86.4	Confident	93.1	Very high	63 Å²	63	42.6 Å²	42.6	44%	0.441	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-27.3	176.7	45.3	0	0	0	0	114.8	Y483 Q510	S481-Y483 PolarHBondContact O-N 3.4Å; S481-Q510 PolarHBondContact O-NE2 3.08Å
482	E	86.8	Confident	92.8	Very high	81 Å²	81	42.3 Å²	42.3	38%	0.379	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	3.4	-174.4	-46.9	-45.3	111.2	0	0	114	T480 S493 Q494	T480-E482 PolarHBondContact O-N 3.13Å; E482-S493 CarbonylContact O-C 3.58Å; E482-Q494 PolarHBondContact O-N 2.92Å; E482-Q494 PolarHBondContact OE2-NE2 2.94Å
483	Y	92.4	Very high	92.6	Very high	103 Å²	103	43.4 Å²	43.4	40%	0.404	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.8	-175.6	-60.7	-98.6	0	0	0	112.3	T480 S481 I491 L492	T480-Y483 PolarHBondContact O-N 2.93Å; S481-Y483 PolarHBondContact O-N 3.4Å; Y483-I491 HydrophobicContact CD1-CG2 4.19Å; Y483-L492 CarbonylContact C-O 3.59Å; Y483-L492 VanDerWaalsContact CA-O 3.22Å; Y483-L492 WeakPolarHBondContact CA-O 3.28Å
484	L	95.3	Very high	92.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.3	164.9	-75.4	-177.4	0	0	0	111.2	F486 I491 L492 M497 C506 I509 Q510 P513	L484-F486 HydrophobicContact CB-CD2 4.1Å; L484-F486 HydrophobicContact CB-CE2 3.6Å; L484-F486 HydrophobicContact CB-CZ 4.41Å; L484-F486 HydrophobicContact CD1-CE2 4.08Å; L484-F486 HydrophobicContact CD1-CZ 4.13Å; L484-F486 PolarHBondContact O-N 2.86Å; L484-I491 WeakPolarHBondContact O-CA 3.34Å; L484-L492 PolarHBondContact N-O 3.23Å; L484-L492 PolarHBondContact O-N 3.07Å; L484-M497 HydrophobicContact CB-SD 3.93Å; L484-M497 HydrophobicContact CD1-SD 3.67Å; L484-M497 HydrophobicContact CG-CE 4.42Å; L484-M497 HydrophobicContact CG-SD 3.63Å; L484-C506 HydrophobicContact CD1-CB 3.85Å; L484-I509 HydrophobicContact CD1-CB 4.26Å; L484-I509 HydrophobicContact CD1-CG2 3.99Å; L484-I509 HydrophobicContact CD2-CG2 4.09Å; L484-Q510 HydrophobicContact CD1-CG 4.26Å; L484-Q510 HydrophobicContact CD2-CG 3.79Å; L484-Q510 HydrophobicContact CG-CG 3.95Å; L484-P513 HydrophobicContact CD2-CG 4.44Å
485	Y	95.1	Very high	92.1	Very high	36 Å²	36	47.4 Å²	47.4	14%	0.141	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	83.1	-176.5	-164.1	-79.8	0	0	0	110.9	L471 R474 S475 N478 V479 P488 I491	L471-Y485 VanDerWaalsContact CD1-O 3.25Å; L471-Y485 WeakPolarHBondContact CD1-O 3.38Å; R474-Y485 HydrophobicContact CB-CD1 3.72Å; R474-Y485 HydrophobicContact CB-CE1 4.48Å; R474-Y485 HydrophobicContact CB-CG 4.34Å; R474-Y485 HydrophobicContact CG-CD1 4.36Å; R474-Y485 PolarHBondContact NE-O 3.39Å; S475-Y485 PolarHBondContact OG-N 3.23Å; N478-Y485 HydrophobicContact CB-CD2 3.66Å; N478-Y485 HydrophobicContact CB-CE2 3.71Å; N478-Y485 HydrophobicContact CB-CG 4.11Å; V479-Y485 HydrophobicContact CG1-CD2 3.95Å; Y485-P488 HydrophobicContact CE1-CG 4.35Å; Y485-P488 WeakPolarHBondContact OH-CA 3.25Å; Y485-P488 WeakPolarHBondContact OH-CB 3.15Å; Y485-I491 HydrophobicContact CD2-CD1 3.58Å; Y485-I491 HydrophobicContact CD2-CG1 3.66Å; Y485-I491 HydrophobicContact CD2-CG2 4.43Å; Y485-I491 HydrophobicContact CE2-CD1 3.47Å; Y485-I491 VanDerWaalsContact CE2-CD1 3.47Å; Y485-I491 HydrophobicContact CE2-CG1 3.92Å; Y485-I491 HydrophobicContact CG-CG1 4.32Å
486	F	95	Very high	91.8	Very high	16 Å²	16	49.7 Å²	49.7	7%	0.07	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-48.1	177.8	-68.8	-98.3	0	0	0	111.1	L426 L429 L471 R474 L484 L490 L492 I502	L426-F486 HydrophobicContact CD2-CD1 3.47Å; L426-F486 VanDerWaalsContact CD2-CD1 3.47Å; L426-F486 HydrophobicContact CD2-CE1 3.78Å; L426-F486 HydrophobicContact CD2-CG 4.04Å; L429-F486 HydrophobicContact CD2-CB 3.92Å; L471-F486 HydrophobicContact CD1-CB 4.45Å; L471-F486 HydrophobicContact CD1-CD1 4.04Å; L471-F486 HydrophobicContact CD1-CD2 4.35Å; L471-F486 HydrophobicContact CD1-CE1 4.38Å; L471-F486 HydrophobicContact CD1-CG 4.03Å; L471-F486 HydrophobicContact CD2-CD1 3.9Å; L471-F486 HydrophobicContact CD2-CE1 3.61Å; L471-F486 HydrophobicContact CD2-CZ 4.13Å; R474-F486 PolarHBondContact NE-O 3.13Å; R474-F486 PolarHBondContact NH2-O 2.85Å; L484-F486 HydrophobicContact CB-CD2 4.1Å; L484-F486 HydrophobicContact CB-CE2 3.6Å; L484-F486 HydrophobicContact CB-CZ 4.41Å; L484-F486 HydrophobicContact CD1-CE2 4.08Å; L484-F486 HydrophobicContact CD1-CZ 4.13Å; L484-F486 PolarHBondContact O-N 2.86Å; F486-L490 WeakPolarHBondContact CA-O 3.31Å; F486-L490 HydrophobicContact CB-CB 4.32Å; F486-L490 HydrophobicContact CB-CD2 3.9Å; F486-L490 HydrophobicContact CB-CG 3.91Å; F486-L490 WeakPolarHBondContact CB-O 3.4Å; F486-L490 HydrophobicContact CG-CD2 4.43Å; F486-L490 HydrophobicContact CG-CG 4.5Å; F486-L490 PolarHBondContact N-O 3Å; F486-L492 HydrophobicContact CD2-CD1 4.22Å; F486-L492 HydrophobicContact CD2-CG 4.11Å; F486-L492 HydrophobicContact CE2-CB 4.41Å; F486-L492 HydrophobicContact CE2-CD1 3.7Å; F486-L492 HydrophobicContact CE2-CG 4Å; F486-L492 HydrophobicContact CZ-CD1 4.38Å; F486-I502 HydrophobicContact CZ-CD1 4.39Å
487	A	93.5	Very high	91.5	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	169.4	174.5	0	0	0	0	0	109.4	V407 L429 D489 L490 I491	V407-A487 WeakPolarHBondContact O-CB 3.44Å; L429-A487 HydrophobicContact CD1-CB 4.01Å; L429-A487 HydrophobicContact CD2-CB 3.98Å; A487-D489 WeakPolarHBondContact CB-OD1 3.47Å; A487-D489 PolarHBondContact O-N 3.48Å; A487-D489 VanDerWaalsContact O-N 3.15Å; A487-L490 HydrophobicContact CB-CB 4.31Å; A487-L490 PolarHBondContact N-O 2.76Å; A487-L490 CarbonylContact O-C 3.58Å; A487-L490 VanDerWaalsContact O-C 3.23Å; A487-L490 PolarHBondContact O-N 3.31Å; A487-I491 WeakPolarHBondContact O-CG1 3.35Å
488	P	89.8	Confident	91.4	Very high	37 Å²	37	48.4 Å²	48.4	24%	0.24	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.9	-179.8	-18.5	29.7	0	0	0	114.5	I406 Y408 Y485	I406-P488 HydrophobicContact CG2-CG 3.25Å; Y408-P488 HydrophobicContact CD1-CB 4.27Å; Y408-P488 HydrophobicContact CD1-CG 4.17Å; Y408-P488 HydrophobicContact CE1-CB 3.78Å; Y408-P488 HydrophobicContact CE1-CG 3.81Å; Y485-P488 HydrophobicContact CE1-CG 4.35Å; Y485-P488 WeakPolarHBondContact OH-CA 3.25Å; Y485-P488 WeakPolarHBondContact OH-CB 3.15Å
489	D	89.6	Confident	91.4	Very high	34 Å²	34	51 Å²	51	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.8	177.6	52.6	3.9	0	0	0	113.3	Y408 S409 G410 N413 A487	Y408-D489 WeakPolarHBondContact CB-OD2 3.4Å; Y408-D489 HydrophobicContact CD1-CB 4.46Å; S409-D489 WeakPolarHBondContact CB-OD1 3.38Å; S409-D489 PolarHBondContact N-OD1 2.9Å; S409-D489 PolarHBondContact N-OD2 3.29Å; S409-D489 PolarHBondContact OG-OD1 3.36Å; S409-D489 PolarHBondContact OG-OD2 3.17Å; G410-D489 WeakPolarHBondContact CA-OD2 3.25Å; G410-D489 PolarHBondContact N-OD2 2.89Å; N413-D489 PolarHBondContact ND2-O 3.48Å; N413-D489 VanDerWaalsContact ND2-O 3.17Å; A487-D489 WeakPolarHBondContact CB-OD1 3.47Å; A487-D489 PolarHBondContact O-N 3.48Å; A487-D489 VanDerWaalsContact O-N 3.15Å
490	L	92.4	Very high	91.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	87.6	178.9	-178.4	61.6	0	0	0	109.8	S409 Y411 L422 L426 L429 F486 A487 L492	S409-L490 WeakPolarHBondContact OG-CB 3.41Å; Y411-L490 HydrophobicContact CD1-CD1 3.6Å; Y411-L490 HydrophobicContact CD2-CD1 4.06Å; Y411-L490 HydrophobicContact CE1-CD1 3.92Å; Y411-L490 HydrophobicContact CE2-CD1 4.34Å; Y411-L490 HydrophobicContact CG-CB 4.47Å; Y411-L490 HydrophobicContact CG-CD1 3.67Å; L422-L490 HydrophobicContact CD1-CD1 3.83Å; L426-L490 HydrophobicContact CD2-CD2 3.7Å; L426-L490 HydrophobicContact CG-CD2 4.22Å; L429-L490 HydrophobicContact CD2-CD2 4.37Å; F486-L490 WeakPolarHBondContact CA-O 3.31Å; F486-L490 HydrophobicContact CB-CB 4.32Å; F486-L490 HydrophobicContact CB-CD2 3.9Å; F486-L490 HydrophobicContact CB-CG 3.91Å; F486-L490 WeakPolarHBondContact CB-O 3.4Å; F486-L490 HydrophobicContact CG-CD2 4.43Å; F486-L490 HydrophobicContact CG-CG 4.5Å; F486-L490 PolarHBondContact N-O 3Å; A487-L490 HydrophobicContact CB-CB 4.31Å; A487-L490 PolarHBondContact N-O 2.76Å; A487-L490 CarbonylContact O-C 3.58Å; A487-L490 VanDerWaalsContact O-C 3.23Å; A487-L490 PolarHBondContact O-N 3.31Å; L490-L492 HydrophobicContact CD1-CD2 3.82Å; L490-L492 HydrophobicContact CD1-CG 4.41Å
491	I	92.4	Very high	91.3	Very high	56 Å²	56	47.7 Å²	47.7	29%	0.287	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.5	174.6	-51.5	174.3	0	0	0	106.6	V479 Y483 L484 Y485 A487	V479-I491 HydrophobicContact CG1-CG2 4.06Å; Y483-I491 HydrophobicContact CD1-CG2 4.19Å; L484-I491 WeakPolarHBondContact O-CA 3.34Å; Y485-I491 HydrophobicContact CD2-CD1 3.58Å; Y485-I491 HydrophobicContact CD2-CG1 3.66Å; Y485-I491 HydrophobicContact CD2-CG2 4.43Å; Y485-I491 HydrophobicContact CE2-CD1 3.47Å; Y485-I491 VanDerWaalsContact CE2-CD1 3.47Å; Y485-I491 HydrophobicContact CE2-CG1 3.92Å; Y485-I491 HydrophobicContact CG-CG1 4.32Å; A487-I491 WeakPolarHBondContact O-CG1 3.35Å
492	L	92.4	Very high	91.7	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.5	-179.5	-59.4	-174.4	0	0	0	110	L422 Y483 L484 F486 L490 Q496 M497	L422-L492 HydrophobicContact CD1-CD1 4.46Å; L422-L492 HydrophobicContact CD1-CD2 4.3Å; L422-L492 HydrophobicContact CD2-CD1 4.34Å; Y483-L492 CarbonylContact C-O 3.59Å; Y483-L492 VanDerWaalsContact CA-O 3.22Å; Y483-L492 WeakPolarHBondContact CA-O 3.28Å; L484-L492 PolarHBondContact N-O 3.23Å; L484-L492 PolarHBondContact O-N 3.07Å; F486-L492 HydrophobicContact CD2-CD1 4.22Å; F486-L492 HydrophobicContact CD2-CG 4.11Å; F486-L492 HydrophobicContact CE2-CB 4.41Å; F486-L492 HydrophobicContact CE2-CD1 3.7Å; F486-L492 HydrophobicContact CE2-CG 4Å; F486-L492 HydrophobicContact CZ-CD1 4.38Å; L490-L492 HydrophobicContact CD1-CD2 3.82Å; L490-L492 HydrophobicContact CD1-CG 4.41Å; L492-Q496 HydrophobicContact CD2-CB 4.35Å; L492-M497 HydrophobicContact CB-CG 3.57Å; L492-M497 HydrophobicContact CB-SD 4.33Å; L492-M497 HydrophobicContact CD1-CG 4.27Å
493	S	92.4	Very high	92.1	Very high	24 Å²	24	44.5 Å²	44.5	17%	0.168	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	160.9	167.7	62.1	0	0	0	0	111.9	E482 E495 Q496 M497	E482-S493 CarbonylContact O-C 3.58Å; S493-E495 PolarHBondContact O-N 2.95Å; S493-E495 VanDerWaalsContact O-N 3.13Å; S493-Q496 PolarHBondContact O-N 3.43Å; S493-Q496 WeakPolarHBondContact OG-CG 3.3Å; S493-Q496 PolarHBondContact OG-N 3.46Å; S493-Q496 PolarHBondContact OG-OE1 3.44Å; S493-M497 WeakPolarHBondContact O-CG 3.49Å; S493-M497 PolarHBondContact O-N 3.04Å
494	Q	92.1	Very high	92.2	Very high	64 Å²	64	45.4 Å²	45.4	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-52.1	-36.2	177.3	-172.7	-179.1	101	0	0	113.4	E482 M497 R498	E482-Q494 PolarHBondContact O-N 2.92Å; E482-Q494 PolarHBondContact OE2-NE2 2.94Å; Q494-M497 HydrophobicContact CB-CE 4.44Å; Q494-R498 WeakPolarHBondContact O-CG 3.4Å; Q494-R498 PolarHBondContact O-N 3.14Å
495	E	90.1	Very high	92.2	Very high	93 Å²	93	46.4 Å²	46.4	44%	0.435	22%	0.22	S	C	.	.	H	α-helix	trans	-71.2	-44	176.9	179.8	58.4	-166.2	0	0	112.2	S493 M497 R498 R499	S493-E495 PolarHBondContact O-N 2.95Å; S493-E495 VanDerWaalsContact O-N 3.13Å; E495-M497 VanDerWaalsContact C-N 3.32Å; E495-M497 PolarHBondContact O-N 3.04Å; E495-R498 WeakPolarHBondContact O-CB 3.3Å; E495-R498 PolarHBondContact O-N 3.35Å; E495-R499 WeakPolarHBondContact O-CG 3.26Å; E495-R499 PolarHBondContact O-N 2.8Å; E495-R499 VanDerWaalsContact O-N 3.09Å; E495-R499 IonicContact OE1-CZ 2.77Å; E495-R499 VanDerWaalsContact OE1-CZ 3.23Å; E495-R499 IonicContact OE1-NE 2.84Å; E495-R499 PolarHBondContact OE1-NE 3.43Å; E495-R499 IonicContact OE1-NH2 2.71Å; E495-R499 PolarHBondContact OE1-NH2 3.23Å
496	Q	90.3	Very high	92.3	Very high	50 Å²	50	44.8 Å²	44.8	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-35.9	174.2	-70.6	165.1	-52.6	0	0	111.8	L492 S493 R499 S500	L492-Q496 HydrophobicContact CD2-CB 4.35Å; S493-Q496 PolarHBondContact O-N 3.43Å; S493-Q496 WeakPolarHBondContact OG-CG 3.3Å; S493-Q496 PolarHBondContact OG-N 3.46Å; S493-Q496 PolarHBondContact OG-OE1 3.44Å; Q496-R499 PolarHBondContact O-N 3.05Å; Q496-S500 WeakPolarHBondContact O-CB 3.06Å; Q496-S500 PolarHBondContact O-N 3.47Å
497	M	92.3	Very high	92.3	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-42.9	172.6	-68.6	-171.4	-71.8	0	0	110.8	L484 L492 S493 Q494 E495 R499 S500 Y503 C506	L484-M497 HydrophobicContact CB-SD 3.93Å; L484-M497 HydrophobicContact CD1-SD 3.67Å; L484-M497 HydrophobicContact CG-CE 4.42Å; L484-M497 HydrophobicContact CG-SD 3.63Å; L492-M497 HydrophobicContact CB-CG 3.57Å; L492-M497 HydrophobicContact CB-SD 4.33Å; L492-M497 HydrophobicContact CD1-CG 4.27Å; S493-M497 WeakPolarHBondContact O-CG 3.49Å; S493-M497 PolarHBondContact O-N 3.04Å; Q494-M497 HydrophobicContact CB-CE 4.44Å; E495-M497 VanDerWaalsContact C-N 3.32Å; E495-M497 PolarHBondContact O-N 3.04Å; M497-R499 VanDerWaalsContact C-N 3.31Å; M497-R499 PolarHBondContact O-N 2.81Å; M497-S500 WeakPolarHBondContact O-CB 3.19Å; M497-S500 PolarHBondContact O-N 2.82Å; M497-S500 VanDerWaalsContact O-N 3.17Å; M497-S500 PolarHBondContact O-OG 3.36Å; M497-Y503 HydrophobicContact CB-CD2 4.34Å; M497-Y503 VanDerWaalsContact O-CB 3.31Å; M497-Y503 WeakPolarHBondContact O-CB 3.39Å; M497-Y503 WeakPolarHBondContact O-CD2 3.49Å; M497-C506 HydrophobicContact CB-CB 4.16Å; M497-C506 HydrophobicContact CG-CB 4.04Å; M497-C506 HydrophobicContact SD-CB 3.65Å
498	R	91.3	Very high	92.4	Very high	130 Å²	130	48.3 Å²	48.3	49%	0.491	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-34.6	174.3	-84.4	-177.6	172.3	123.8	7.6	114.1	Q494 E495 Y503	Q494-R498 WeakPolarHBondContact O-CG 3.4Å; Q494-R498 PolarHBondContact O-N 3.14Å; E495-R498 WeakPolarHBondContact O-CB 3.3Å; E495-R498 PolarHBondContact O-N 3.35Å; R498-Y503 HydrophobicContact CB-CD2 4.4Å; R498-Y503 HydrophobicContact CB-CE2 4.25Å; R498-Y503 HydrophobicContact CG-CD2 3.99Å; R498-Y503 HydrophobicContact CG-CE1 4.48Å; R498-Y503 HydrophobicContact CG-CE2 3.38Å; R498-Y503 PolarHBondContact NE-OH 3.27Å
499	R	89.1	Confident	92.8	Very high	147 Å²	147	46.9 Å²	46.9	56%	0.555	23%	0.225	S	C	*	.	H	α-helix	trans	-81.6	-17.4	176.5	-64.1	173.8	-169.7	-169.1	2.1	113.6	E417 E495 Q496 M497	E417-R499 IonicContact OE2-CZ 2.79Å; E417-R499 IonicContact OE2-NH1 3.99Å; E417-R499 PolarHBondContact OE2-NH1 3.34Å; E495-R499 WeakPolarHBondContact O-CG 3.26Å; E495-R499 PolarHBondContact O-N 2.8Å; E495-R499 VanDerWaalsContact O-N 3.09Å; E495-R499 IonicContact OE1-CZ 2.77Å; E495-R499 VanDerWaalsContact OE1-CZ 3.23Å; E495-R499 IonicContact OE1-NE 2.84Å; E495-R499 PolarHBondContact OE1-NE 3.43Å; E495-R499 IonicContact OE1-NH2 2.71Å; E495-R499 PolarHBondContact OE1-NH2 3.23Å; Q496-R499 PolarHBondContact O-N 3.05Å; M497-R499 VanDerWaalsContact C-N 3.31Å; M497-R499 PolarHBondContact O-N 2.81Å
500	S	90.3	Very high	93.1	Very high	13 Å²	13	46 Å²	46	9%	0.091	22%	0.22	C	C	.	.	S	Bend	trans	-74.7	150.1	-175.9	78.7	0	0	0	0	112.5	Q496 M497 I502 Y503	Q496-S500 WeakPolarHBondContact O-CB 3.06Å; Q496-S500 PolarHBondContact O-N 3.47Å; M497-S500 WeakPolarHBondContact O-CB 3.19Å; M497-S500 PolarHBondContact O-N 2.82Å; M497-S500 VanDerWaalsContact O-N 3.17Å; M497-S500 PolarHBondContact O-OG 3.36Å; S500-I502 PolarHBondContact O-N 3.45Å; S500-I502 WeakPolarHBondContact OG-CG1 3.27Å; S500-I502 PolarHBondContact OG-N 3.04Å; S500-Y503 PolarHBondContact O-N 3Å; S500-Y503 PolarHBondContact OG-N 3.39Å
501	P	89.3	Confident	93.3	Very high	47 Å²	47	48 Å²	48	31%	0.305	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	1.6	171.5	32	-37.8	0	0	0	113.5	P419 L423 F598	P419-P501 HydrophobicContact CB-CB 4.36Å; P419-P501 HydrophobicContact CB-CG 3.95Å; L423-P501 HydrophobicContact CD1-CG 3.93Å; L423-P501 HydrophobicContact CD2-CG 4.12Å; L423-P501 HydrophobicContact CG-CG 3.94Å; P501-F598 WeakPolarHBondContact O-CE2 3.28Å
502	I	93.6	Very high	93.5	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.072	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	20.3	-176.1	58.4	164.2	0	0	0	112.7	L423 L426 F486 S500 D504 L505 C506 F598	L423-I502 HydrophobicContact CD2-CG2 3.94Å; L426-I502 HydrophobicContact CD1-CD1 3.59Å; F486-I502 HydrophobicContact CZ-CD1 4.39Å; S500-I502 PolarHBondContact O-N 3.45Å; S500-I502 WeakPolarHBondContact OG-CG1 3.27Å; S500-I502 PolarHBondContact OG-N 3.04Å; I502-D504 PolarHBondContact O-N 2.88Å; I502-L505 HydrophobicContact CB-CB 4.41Å; I502-L505 HydrophobicContact CB-CD1 4.21Å; I502-L505 HydrophobicContact CG2-CD1 4.11Å; I502-L505 WeakPolarHBondContact O-CB 3.48Å; I502-L505 PolarHBondContact O-N 3.33Å; I502-C506 PolarHBondContact O-N 3.39Å; I502-C506 PolarHBondContact O-SG 2.79Å; I502-F598 HydrophobicContact CG2-CD1 4.2Å; I502-F598 HydrophobicContact CG2-CE1 3.49Å; I502-F598 VanDerWaalsContact CG2-CE1 3.49Å; I502-F598 HydrophobicContact CG2-CE2 4.19Å; I502-F598 HydrophobicContact CG2-CZ 3.48Å; I502-F598 VanDerWaalsContact CG2-CZ 3.48Å
503	Y	94.6	Very high	93.8	Very high	64 Å²	64	46 Å²	46	25%	0.251	22%	0.22	S	C	.	.	H	α-helix	trans	-51.7	-51	-176	178.8	-124.1	0	0	0	113.4	M497 R498 S500 L505 C506 L507	M497-Y503 HydrophobicContact CB-CD2 4.34Å; M497-Y503 VanDerWaalsContact O-CB 3.31Å; M497-Y503 WeakPolarHBondContact O-CB 3.39Å; M497-Y503 WeakPolarHBondContact O-CD2 3.49Å; R498-Y503 HydrophobicContact CB-CD2 4.4Å; R498-Y503 HydrophobicContact CB-CE2 4.25Å; R498-Y503 HydrophobicContact CG-CD2 3.99Å; R498-Y503 HydrophobicContact CG-CE1 4.48Å; R498-Y503 HydrophobicContact CG-CE2 3.38Å; R498-Y503 PolarHBondContact NE-OH 3.27Å; S500-Y503 PolarHBondContact O-N 3Å; S500-Y503 PolarHBondContact OG-N 3.39Å; Y503-L505 PolarHBondContact O-N 2.81Å; Y503-C506 WeakPolarHBondContact O-CA 3.39Å; Y503-C506 WeakPolarHBondContact O-CB 3.31Å; Y503-C506 PolarHBondContact O-N 3.2Å; Y503-L507 HydrophobicContact CD1-CD1 4.24Å; Y503-L507 HydrophobicContact CD2-CG 4.25Å; Y503-L507 HydrophobicContact CE1-CD1 3.7Å; Y503-L507 HydrophobicContact CE1-CG 4.33Å; Y503-L507 HydrophobicContact CE2-CD1 4.14Å; Y503-L507 HydrophobicContact CE2-CD2 3.85Å; Y503-L507 HydrophobicContact CE2-CG 3.9Å; Y503-L507 PolarHBondContact O-N 2.93Å
504	D	95.3	Very high	93.9	Very high	121 Å²	121	48 Å²	48	65%	0.647	23%	0.226	S	C	*	.	H	α-helix	trans	-63.9	-29.2	-179.8	-64.6	-33.7	0	0	0	113	I502 A508	I502-D504 PolarHBondContact O-N 2.88Å; D504-A508 WeakPolarHBondContact O-CB 3.1Å; D504-A508 PolarHBondContact O-N 3.26Å; D504-A508 VanDerWaalsContact O-N 3.11Å
505	L	96.2	Very high	94.2	Very high	22 Å²	22	47 Å²	47	12%	0.115	22%	0.222	C	C	.	.	H	α-helix	trans	-73.9	-40.3	172.6	-56	-178.6	0	0	0	110.9	I502 Y503 A508 I509 K594 V595 F598	I502-L505 HydrophobicContact CB-CB 4.41Å; I502-L505 HydrophobicContact CB-CD1 4.21Å; I502-L505 HydrophobicContact CG2-CD1 4.11Å; I502-L505 WeakPolarHBondContact O-CB 3.48Å; I502-L505 PolarHBondContact O-N 3.33Å; Y503-L505 PolarHBondContact O-N 2.81Å; L505-A508 PolarHBondContact O-N 3.46Å; L505-I509 WeakPolarHBondContact O-CB 3.34Å; L505-I509 WeakPolarHBondContact O-CD1 3.49Å; L505-I509 WeakPolarHBondContact O-CG1 3.42Å; L505-I509 PolarHBondContact O-N 3.49Å; L505-K594 HydrophobicContact CD2-CB 3.91Å; L505-V595 HydrophobicContact CD2-CG2 4.26Å; L505-F598 HydrophobicContact CD1-CB 3.65Å; L505-F598 HydrophobicContact CD1-CD1 3.77Å; L505-F598 HydrophobicContact CD1-CD2 4.16Å; L505-F598 HydrophobicContact CD1-CE1 4.49Å; L505-F598 HydrophobicContact CD1-CG 3.59Å; L505-F598 HydrophobicContact CD2-CB 4.41Å
506	C	96.3	Very high	94.6	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-47	176.1	-65.8	0	0	0	0	110.9	L484 M497 I502 Y503 A508 I509 Q510	L484-C506 HydrophobicContact CD1-CB 3.85Å; M497-C506 HydrophobicContact CB-CB 4.16Å; M497-C506 HydrophobicContact CG-CB 4.04Å; M497-C506 HydrophobicContact SD-CB 3.65Å; I502-C506 PolarHBondContact O-N 3.39Å; I502-C506 PolarHBondContact O-SG 2.79Å; Y503-C506 WeakPolarHBondContact O-CA 3.39Å; Y503-C506 WeakPolarHBondContact O-CB 3.31Å; Y503-C506 PolarHBondContact O-N 3.2Å; C506-A508 VanDerWaalsContact C-N 3.34Å; C506-A508 PolarHBondContact O-N 3.46Å; C506-I509 PolarHBondContact O-N 2.97Å; C506-I509 VanDerWaalsContact O-N 3.17Å; C506-Q510 WeakPolarHBondContact O-CG 3.15Å; C506-Q510 PolarHBondContact O-N 3Å
507	L	94.6	Very high	94.8	Very high	75 Å²	75	42.5 Å²	42.5	39%	0.393	21%	0.209	S	C	.	.	H	α-helix	trans	-56.5	-46.2	172.6	-68.2	-175.9	0	0	0	111.8	Y503 I509 Q510	Y503-L507 HydrophobicContact CD1-CD1 4.24Å; Y503-L507 HydrophobicContact CD2-CG 4.25Å; Y503-L507 HydrophobicContact CE1-CD1 3.7Å; Y503-L507 HydrophobicContact CE1-CG 4.33Å; Y503-L507 HydrophobicContact CE2-CD1 4.14Å; Y503-L507 HydrophobicContact CE2-CD2 3.85Å; Y503-L507 HydrophobicContact CE2-CG 3.9Å; Y503-L507 PolarHBondContact O-N 2.93Å; L507-I509 VanDerWaalsContact C-N 3.32Å; L507-I509 PolarHBondContact O-N 2.71Å; L507-Q510 PolarHBondContact O-N 2.9Å
508	A	96.4	Very high	95	Very high	16 Å²	16	47.5 Å²	47.5	13%	0.132	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-32.8	177.9	0	0	0	0	0	113	D504 L505 C506 I591	D504-A508 WeakPolarHBondContact O-CB 3.1Å; D504-A508 PolarHBondContact O-N 3.26Å; D504-A508 VanDerWaalsContact O-N 3.11Å; L505-A508 PolarHBondContact O-N 3.46Å; C506-A508 VanDerWaalsContact C-N 3.34Å; C506-A508 PolarHBondContact O-N 3.46Å; A508-I591 HydrophobicContact CB-CG1 4.48Å; A508-I591 HydrophobicContact CB-CG2 4.12Å; A508-I591 VanDerWaalsContact O-CD1 3.27Å; A508-I591 WeakPolarHBondContact O-CD1 3.39Å
509	I	97.2	Very high	95.2	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-75.6	-34.9	177.7	-71.5	164.3	0	0	0	111.4	V468 L471 L484 L505 C506 L507 F511 I512 P513 I591 V595	V468-I509 HydrophobicContact CG1-CG1 4.2Å; L471-I509 HydrophobicContact CD2-CD1 4.2Å; L471-I509 HydrophobicContact CD2-CG2 3.76Å; L471-I509 HydrophobicContact CG-CG2 4.04Å; L484-I509 HydrophobicContact CD1-CB 4.26Å; L484-I509 HydrophobicContact CD1-CG2 3.99Å; L484-I509 HydrophobicContact CD2-CG2 4.09Å; L505-I509 WeakPolarHBondContact O-CB 3.34Å; L505-I509 WeakPolarHBondContact O-CD1 3.49Å; L505-I509 WeakPolarHBondContact O-CG1 3.42Å; L505-I509 PolarHBondContact O-N 3.49Å; C506-I509 PolarHBondContact O-N 2.97Å; C506-I509 VanDerWaalsContact O-N 3.17Å; L507-I509 VanDerWaalsContact C-N 3.32Å; L507-I509 PolarHBondContact O-N 2.71Å; I509-F511 PolarHBondContact O-N 3.5Å; I509-F511 VanDerWaalsContact O-N 3.12Å; I509-I512 WeakPolarHBondContact O-CB 3.41Å; I509-I512 PolarHBondContact O-N 2.87Å; I509-P513 WeakPolarHBondContact O-CD 3.22Å; I509-I591 HydrophobicContact CG1-CG2 4.15Å; I509-V595 HydrophobicContact CD1-CG2 4.06Å; I509-V595 HydrophobicContact CG1-CG2 4.38Å
510	Q	95.8	Very high	95.5	Very high	15 Å²	15	42 Å²	42	7%	0.07	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-22.9	178.2	-81.4	175.5	-60.9	0	0	113.8	S481 L484 C506 L507 I512 P513 Q514	S481-Q510 PolarHBondContact O-NE2 3.08Å; L484-Q510 HydrophobicContact CD1-CG 4.26Å; L484-Q510 HydrophobicContact CD2-CG 3.79Å; L484-Q510 HydrophobicContact CG-CG 3.95Å; C506-Q510 WeakPolarHBondContact O-CG 3.15Å; C506-Q510 PolarHBondContact O-N 3Å; L507-Q510 PolarHBondContact O-N 2.9Å; Q510-I512 PolarHBondContact O-N 3.35Å; Q510-P513 VanDerWaalsContact O-CD 3.26Å; Q510-P513 WeakPolarHBondContact O-CD 3.25Å; Q510-P513 WeakPolarHBondContact O-CG 3.35Å; Q510-Q514 WeakPolarHBondContact O-CG 3.3Å; Q510-Q514 PolarHBondContact O-N 2.87Å
511	F	96.8	Very high	95.8	Very high	44 Å²	44	41.6 Å²	41.6	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-54	-36.7	170.1	175.7	-102	0	0	0	113	I509 Q514 E515 L584 A587 I591	I509-F511 PolarHBondContact O-N 3.5Å; I509-F511 VanDerWaalsContact O-N 3.12Å; F511-Q514 PolarHBondContact O-N 3.49Å; F511-E515 HydrophobicContact CD1-CG 4.33Å; F511-E515 HydrophobicContact CD2-CG 4.18Å; F511-E515 HydrophobicContact CE1-CG 3.9Å; F511-E515 HydrophobicContact CE2-CG 3.72Å; F511-E515 HydrophobicContact CG-CG 4.47Å; F511-E515 HydrophobicContact CZ-CG 3.57Å; F511-E515 WeakPolarHBondContact O-CG 3.42Å; F511-E515 PolarHBondContact O-N 3.44Å; F511-L584 HydrophobicContact CD1-CD1 4.31Å; F511-L584 HydrophobicContact CE1-CD1 3.78Å; F511-A587 HydrophobicContact CE1-CB 4.14Å; F511-I591 HydrophobicContact CB-CD1 4.22Å; F511-I591 HydrophobicContact CD1-CD1 3.62Å; F511-I591 HydrophobicContact CE1-CD1 4.41Å; F511-I591 HydrophobicContact CG-CD1 4.26Å
512	I	97.7	Very high	96.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-71.1	-51.8	-173.2	-56.6	165.6	0	0	0	112.7	V468 I509 Q510 Q514 E515 F516 M588 I591	V468-I512 HydrophobicContact CG1-CD1 3.35Å; I509-I512 WeakPolarHBondContact O-CB 3.41Å; I509-I512 PolarHBondContact O-N 2.87Å; Q510-I512 PolarHBondContact O-N 3.35Å; I512-Q514 VanDerWaalsContact C-N 3.27Å; I512-Q514 PolarHBondContact O-N 3.38Å; I512-E515 PolarHBondContact O-N 3.06Å; I512-F516 HydrophobicContact CG2-CD2 4.23Å; I512-F516 HydrophobicContact CG2-CE1 4.29Å; I512-F516 HydrophobicContact CG2-CE2 3.71Å; I512-F516 HydrophobicContact CG2-CZ 3.76Å; I512-F516 WeakPolarHBondContact O-CG 3.49Å; I512-F516 PolarHBondContact O-N 3.18Å; I512-M588 HydrophobicContact CD1-CE 3.69Å; I512-M588 HydrophobicContact CD1-CG 3.82Å; I512-M588 HydrophobicContact CD1-SD 3.8Å; I512-M588 HydrophobicContact CG1-CE 4.49Å; I512-M588 HydrophobicContact CG1-CG 3.85Å; I512-M588 HydrophobicContact CG1-SD 3.95Å; I512-M588 HydrophobicContact CG2-SD 3.96Å; I512-I591 HydrophobicContact CD1-CD1 4.41Å; I512-I591 HydrophobicContact CG1-CD1 4.21Å
513	P	97.4	Very high	96.2	Very high	17 Å²	17	44.2 Å²	44.2	11%	0.11	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-30.4	173.5	23.4	-31.5	0	0	0	113	G472 F476 L484 I509 Q510 F516 A517	G472-P513 WeakPolarHBondContact O-CB 3.28Å; F476-P513 HydrophobicContact CB-CB 3.98Å; L484-P513 HydrophobicContact CD2-CG 4.44Å; I509-P513 WeakPolarHBondContact O-CD 3.22Å; Q510-P513 VanDerWaalsContact O-CD 3.26Å; Q510-P513 WeakPolarHBondContact O-CD 3.25Å; Q510-P513 WeakPolarHBondContact O-CG 3.35Å; P513-F516 PolarHBondContact O-N 2.99Å; P513-A517 PolarHBondContact O-N 3.33Å
514	Q	96.3	Very high	96.2	Very high	65 Å²	65	44.9 Å²	44.9	30%	0.304	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-49.6	172.7	-71.1	170.6	13.3	0	0	111	Q510 F511 I512 F516 A517 N518	Q510-Q514 WeakPolarHBondContact O-CG 3.3Å; Q510-Q514 PolarHBondContact O-N 2.87Å; F511-Q514 PolarHBondContact O-N 3.49Å; I512-Q514 VanDerWaalsContact C-N 3.27Å; I512-Q514 PolarHBondContact O-N 3.38Å; Q514-F516 VanDerWaalsContact C-N 3.32Å; Q514-F516 PolarHBondContact O-N 2.96Å; Q514-A517 WeakPolarHBondContact O-CB 3.44Å; Q514-A517 PolarHBondContact O-N 2.99Å; Q514-A517 VanDerWaalsContact O-N 3.14Å; Q514-N518 PolarHBondContact O-N 3.15Å; Q514-N518 PolarHBondContact O-ND2 3.19Å
515	E	97.7	Very high	96.3	Very high	44 Å²	44	39.1 Å²	39.1	21%	0.206	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-31.3	177	-72.7	-68	86.5	0	0	112.9	F511 I512 A517 N518 L519 L584	F511-E515 HydrophobicContact CD1-CG 4.33Å; F511-E515 HydrophobicContact CD2-CG 4.18Å; F511-E515 HydrophobicContact CE1-CG 3.9Å; F511-E515 HydrophobicContact CE2-CG 3.72Å; F511-E515 HydrophobicContact CG-CG 4.47Å; F511-E515 HydrophobicContact CZ-CG 3.57Å; F511-E515 WeakPolarHBondContact O-CG 3.42Å; F511-E515 PolarHBondContact O-N 3.44Å; I512-E515 PolarHBondContact O-N 3.06Å; E515-A517 VanDerWaalsContact C-N 3.33Å; E515-A517 PolarHBondContact O-N 3.45Å; E515-N518 PolarHBondContact O-N 2.82Å; E515-N518 PolarHBondContact OE1-ND2 3.01Å; E515-L519 VanDerWaalsContact O-CB 3.28Å; E515-L519 WeakPolarHBondContact O-CB 3.38Å; E515-L519 VanDerWaalsContact O-CG 3.3Å; E515-L519 WeakPolarHBondContact O-CG 3.32Å; E515-L519 PolarHBondContact O-N 3.28Å; E515-L584 HydrophobicContact CB-CD1 3.72Å; E515-L584 HydrophobicContact CB-CD2 3.92Å; E515-L584 HydrophobicContact CB-CG 4.41Å; E515-L584 HydrophobicContact CG-CD1 4.08Å
516	F	98	Very high	96.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-38.6	170.4	-70.5	-22.1	0	0	0	112.9	F469 W473 F476 I512 P513 Q514 Q520 V521 F526 L584	F469-F516 HydrophobicContact CD2-CE1 4.4Å; F469-F516 AromaticContact CD2-CZ 3.73Å; F469-F516 HydrophobicContact CD2-CZ 3.73Å; F469-F516 HydrophobicContact CE1-CZ 4.47Å; F469-F516 AromaticContact CE2-CE1 3.66Å; F469-F516 HydrophobicContact CE2-CE1 3.66Å; F469-F516 AromaticContact CE2-CZ 3.37Å; F469-F516 HydrophobicContact CE2-CZ 3.37Å; F469-F516 HydrophobicContact CG-CZ 4.45Å; F469-F516 HydrophobicContact CZ-CE1 4.05Å; F469-F516 AromaticContact CZ-CZ 3.76Å; F469-F516 HydrophobicContact CZ-CZ 3.76Å; W473-F516 HydrophobicContact CB-CE2 3.95Å; W473-F516 HydrophobicContact CE3-CD2 4.11Å; W473-F516 HydrophobicContact CE3-CE2 4.18Å; F476-F516 HydrophobicContact CB-CB 4.02Å; F476-F516 HydrophobicContact CB-CD2 4.05Å; F476-F516 HydrophobicContact CD1-CB 3.72Å; F476-F516 HydrophobicContact CD1-CD2 4.32Å; F476-F516 HydrophobicContact CD1-CG 4.4Å; F476-F516 HydrophobicContact CD2-CB 4.04Å; F476-F516 HydrophobicContact CE1-CB 4.16Å; F476-F516 HydrophobicContact CE2-CB 4.48Å; F476-F516 HydrophobicContact CG-CB 3.65Å; F476-F516 HydrophobicContact CG-CD2 4.4Å; I512-F516 HydrophobicContact CG2-CD2 4.23Å; I512-F516 HydrophobicContact CG2-CE1 4.29Å; I512-F516 HydrophobicContact CG2-CE2 3.71Å; I512-F516 HydrophobicContact CG2-CZ 3.76Å; I512-F516 WeakPolarHBondContact O-CG 3.49Å; I512-F516 PolarHBondContact O-N 3.18Å; P513-F516 PolarHBondContact O-N 2.99Å; Q514-F516 VanDerWaalsContact C-N 3.32Å; Q514-F516 PolarHBondContact O-N 2.96Å; F516-Q520 VanDerWaalsContact O-CA 3.31Å; F516-Q520 WeakPolarHBondContact O-CA 3.47Å; F516-Q520 PolarHBondContact O-N 3.48Å; F516-V521 HydrophobicContact CB-CG2 4.45Å; F516-V521 HydrophobicContact CD1-CB 4.15Å; F516-V521 HydrophobicContact CD1-CG1 4.49Å; F516-V521 HydrophobicContact CD1-CG2 3.76Å; F516-V521 HydrophobicContact CG-CG2 4.49Å; F516-V521 PolarHBondContact O-N 2.69Å; F516-F526 HydrophobicContact CZ-CD2 4.24Å; F516-L584 HydrophobicContact CD1-CD2 3.63Å; F516-L584 HydrophobicContact CE1-CD2 3.58Å
517	A	95.4	Very high	96.5	Very high	48 Å²	48	38.1 Å²	38.1	40%	0.397	20%	0.196	S	C	.	.	H	α-helix	trans	-69.9	-46.7	173.2	0	0	0	0	0	112	F476 P513 Q514 E515 L519 Q520	F476-A517 HydrophobicContact CD2-CB 4.03Å; F476-A517 HydrophobicContact CE2-CB 3.88Å; P513-A517 PolarHBondContact O-N 3.33Å; Q514-A517 WeakPolarHBondContact O-CB 3.44Å; Q514-A517 PolarHBondContact O-N 2.99Å; Q514-A517 VanDerWaalsContact O-N 3.14Å; E515-A517 VanDerWaalsContact C-N 3.33Å; E515-A517 PolarHBondContact O-N 3.45Å; A517-L519 PolarHBondContact O-N 2.89Å; A517-Q520 WeakPolarHBondContact O-CG 3.5Å; A517-Q520 PolarHBondContact O-N 2.99Å; A517-Q520 VanDerWaalsContact O-N 3.14Å
518	N	95.7	Very high	96.6	Very high	106 Å²	106	34.6 Å²	34.6	57%	0.567	18%	0.177	S	C	*	.	H	α-helix	trans	-59.9	-44.7	179.8	-66.5	-22	0	0	0	112.1	Q514 E515 Q520	Q514-N518 PolarHBondContact O-N 3.15Å; Q514-N518 PolarHBondContact O-ND2 3.19Å; E515-N518 PolarHBondContact O-N 2.82Å; E515-N518 PolarHBondContact OE1-ND2 3.01Å; N518-Q520 VanDerWaalsContact C-N 3.33Å
519	L	95.9	Very high	96.7	Very high	27 Å²	27	33.8 Å²	33.8	14%	0.141	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.6	178.8	-59.5	179.1	0	0	0	113.1	E515 A517 V521 R577 H580 L581 L584	E515-L519 VanDerWaalsContact O-CB 3.28Å; E515-L519 WeakPolarHBondContact O-CB 3.38Å; E515-L519 VanDerWaalsContact O-CG 3.3Å; E515-L519 WeakPolarHBondContact O-CG 3.32Å; E515-L519 PolarHBondContact O-N 3.28Å; A517-L519 PolarHBondContact O-N 2.89Å; L519-V521 HydrophobicContact CB-CG2 3.89Å; L519-V521 PolarHBondContact O-N 3.01Å; L519-R577 VanDerWaalsContact O-CZ 3.3Å; L519-R577 PolarHBondContact O-NH1 3.47Å; L519-R577 PolarHBondContact O-NH2 3.32Å; L519-H580 HydrophobicContact CD1-CB 4.28Å; L519-H580 HydrophobicContact CD2-CB 3.78Å; L519-L581 HydrophobicContact CB-CD2 4.49Å; L519-L581 HydrophobicContact CD1-CD2 4.19Å; L519-L584 HydrophobicContact CD1-CD2 4.38Å
520	Q	94.9	Very high	96.7	Very high	134 Å²	134	33.8 Å²	33.8	63%	0.626	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	58.3	-173.2	-58.7	178.5	5	0	0	111.5	F516 A517 N518 T522 K567 R577	F516-Q520 VanDerWaalsContact O-CA 3.31Å; F516-Q520 WeakPolarHBondContact O-CA 3.47Å; F516-Q520 PolarHBondContact O-N 3.48Å; A517-Q520 WeakPolarHBondContact O-CG 3.5Å; A517-Q520 PolarHBondContact O-N 2.99Å; A517-Q520 VanDerWaalsContact O-N 3.14Å; N518-Q520 VanDerWaalsContact C-N 3.33Å; Q520-T522 PolarHBondContact O-N 3.28Å; Q520-K567 PolarHBondContact O-NZ 2.99Å; Q520-R577 PolarHBondContact O-NH2 3.38Å
521	V	96.8	Very high	96.9	Very high	6 Å²	6	33.1 Å²	33.1	4%	0.036	17%	0.167	C	C	.	.			trans	-66.5	128.3	-174.2	-179	0	0	0	0	110.2	W473 F516 L519 E525 F526 M529 L581	W473-V521 HydrophobicContact CZ3-CB 4.24Å; W473-V521 HydrophobicContact CZ3-CG1 4.1Å; F516-V521 HydrophobicContact CB-CG2 4.45Å; F516-V521 HydrophobicContact CD1-CB 4.15Å; F516-V521 HydrophobicContact CD1-CG1 4.49Å; F516-V521 HydrophobicContact CD1-CG2 3.76Å; F516-V521 HydrophobicContact CG-CG2 4.49Å; F516-V521 PolarHBondContact O-N 2.69Å; L519-V521 HydrophobicContact CB-CG2 3.89Å; L519-V521 PolarHBondContact O-N 3.01Å; V521-E525 HydrophobicContact CG1-CB 3.92Å; V521-F526 HydrophobicContact CG1-CB 4.23Å; V521-M529 HydrophobicContact CG1-SD 4.34Å; V521-L581 HydrophobicContact CG1-CD2 4.37Å; V521-L581 HydrophobicContact CG2-CD2 3.59Å
522	T	95.8	Very high	96.9	Very high	37 Å²	37	31 Å²	31	23%	0.227	16%	0.158	C	C	.	.			trans	-82.6	167	178.7	81.1	0	0	0	0	111.6	Q520 E524 E525 F526 K567	Q520-T522 PolarHBondContact O-N 3.28Å; T522-E524 VanDerWaalsContact C-N 3.32Å; T522-E524 WeakPolarHBondContact CB-OE2 3.46Å; T522-E524 PolarHBondContact O-N 3.19Å; T522-E524 PolarHBondContact OG1-OE2 3.24Å; T522-E525 PolarHBondContact N-OE2 3.31Å; T522-E525 PolarHBondContact O-N 3.32Å; T522-E525 WeakPolarHBondContact OG1-CG 3.4Å; T522-E525 PolarHBondContact OG1-N 2.88Å; T522-F526 PolarHBondContact O-N 2.67Å; T522-K567 HydrophobicContact CG2-CD 3.8Å
523	R	95.2	Very high	96.9	Very high	79 Å²	79	31.3 Å²	31.3	30%	0.298	16%	0.16	S	C	.	.	H	α-helix	trans	-62.8	-41.5	-179	-178.5	56.9	169.1	152.5	1.8	111.4	E403 W473 F526 L527	E403-R523 VanDerWaalsContact CG-NH2 3.32Å; E403-R523 IonicContact OE2-CZ 2.72Å; E403-R523 IonicContact OE2-NH1 3.73Å; E403-R523 PolarHBondContact OE2-NH1 3.11Å; E403-R523 IonicContact OE2-NH2 3.89Å; E403-R523 PolarHBondContact OE2-NH2 3.31Å; W473-R523 HydrophobicContact CZ2-CB 4.4Å; R523-F526 VanDerWaalsContact NH1-CD1 3.32Å; R523-F526 VanDerWaalsContact NH1-CE1 3.26Å; R523-F526 PolarHBondContact O-N 2.96Å; R523-L527 HydrophobicContact CG-CD1 4.14Å; R523-L527 WeakPolarHBondContact O-CB 3.37Å; R523-L527 WeakPolarHBondContact O-CG 3.49Å; R523-L527 PolarHBondContact O-N 3.49Å
524	E	95.1	Very high	96.9	Very high	77 Å²	77	30.5 Å²	30.5	36%	0.36	15%	0.154	S	C	.	.	H	α-helix	trans	-66.2	-43.1	179.4	-47.4	82.5	172.6	0	0	111.1	I396 T522 L527 C528 A563	I396-E524 HydrophobicContact CD1-CB 4.29Å; I396-E524 HydrophobicContact CG2-CB 4.39Å; I396-E524 HydrophobicContact CG2-CG 4.1Å; T522-E524 VanDerWaalsContact C-N 3.32Å; T522-E524 WeakPolarHBondContact CB-OE2 3.46Å; T522-E524 PolarHBondContact O-N 3.19Å; T522-E524 PolarHBondContact OG1-OE2 3.24Å; E524-L527 PolarHBondContact O-N 3.36Å; E524-C528 PolarHBondContact O-N 3.46Å; E524-C528 VanDerWaalsContact O-N 3.07Å; E524-C528 PolarHBondContact O-SG 3.26Å; E524-A563 HydrophobicContact CB-CB 4.19Å
525	E	97.1	Very high	96.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-48.6	174.3	-70.1	172.8	158.3	0	0	111.2	V521 T522 L527 C528 M529 L560 A563 I564 R577 L581	V521-E525 HydrophobicContact CG1-CB 3.92Å; T522-E525 PolarHBondContact N-OE2 3.31Å; T522-E525 PolarHBondContact O-N 3.32Å; T522-E525 WeakPolarHBondContact OG1-CG 3.4Å; T522-E525 PolarHBondContact OG1-N 2.88Å; E525-L527 VanDerWaalsContact C-N 3.33Å; E525-L527 PolarHBondContact O-N 2.97Å; E525-C528 PolarHBondContact O-N 3.07Å; E525-M529 WeakPolarHBondContact O-CB 3.25Å; E525-M529 WeakPolarHBondContact O-CG 3.49Å; E525-M529 PolarHBondContact O-N 2.74Å; E525-L560 HydrophobicContact CB-CD1 4.37Å; E525-A563 HydrophobicContact CG-CB 4.32Å; E525-I564 HydrophobicContact CG-CG1 4.48Å; E525-R577 IonicContact OE1-CZ 2.68Å; E525-R577 IonicContact OE1-NE 3.78Å; E525-R577 PolarHBondContact OE1-NE 3.12Å; E525-R577 IonicContact OE1-NH2 3.72Å; E525-R577 PolarHBondContact OE1-NH2 2.91Å; E525-R577 IonicContact OE2-CZ 2.71Å; E525-R577 IonicContact OE2-NE 3.5Å; E525-R577 IonicContact OE2-NH2 3.04Å; E525-R577 PolarHBondContact OE2-NH2 2.83Å; E525-L581 HydrophobicContact CB-CD1 4.41Å; E525-L581 HydrophobicContact CG-CD1 4.22Å
526	F	98.2	Very high	96.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-55.8	-45.8	175	166	-91.8	0	0	0	111.9	F469 W473 F516 V521 T522 R523 M529 K530	F469-F526 AromaticContact CD1-CD2 3.88Å; F469-F526 HydrophobicContact CD1-CD2 3.88Å; F469-F526 AromaticContact CD1-CE2 3.31Å; F469-F526 HydrophobicContact CD1-CE2 3.31Å; F469-F526 HydrophobicContact CD1-CZ 4.03Å; F469-F526 AromaticContact CE1-CD2 3.24Å; F469-F526 HydrophobicContact CE1-CD2 3.24Å; F469-F526 AromaticContact CE1-CE2 3.2Å; F469-F526 HydrophobicContact CE1-CE2 3.2Å; F469-F526 HydrophobicContact CE1-CG 4.14Å; F469-F526 HydrophobicContact CE1-CZ 4.09Å; F469-F526 WeakPolarHBondContact CE1-O 3.24Å; F469-F526 HydrophobicContact CG-CE2 4.21Å; F469-F526 AromaticContact CZ-CD2 3.73Å; F469-F526 HydrophobicContact CZ-CD2 3.73Å; F469-F526 HydrophobicContact CZ-CE2 4.06Å; W473-F526 HydrophobicContact CB-CD2 3.69Å; W473-F526 HydrophobicContact CB-CE2 3.25Å; W473-F526 HydrophobicContact CB-CG 4.5Å; W473-F526 HydrophobicContact CB-CZ 3.74Å; W473-F526 HydrophobicContact CD2-CB 4.04Å; W473-F526 HydrophobicContact CD2-CD1 4.03Å; W473-F526 AromaticContact CD2-CD2 3.52Å; W473-F526 HydrophobicContact CD2-CD2 3.52Å; W473-F526 HydrophobicContact CD2-CE1 4.44Å; W473-F526 AromaticContact CD2-CE2 3.98Å; W473-F526 HydrophobicContact CD2-CE2 3.98Å; W473-F526 AromaticContact CD2-CG 3.55Å; W473-F526 HydrophobicContact CD2-CG 3.55Å; W473-F526 HydrophobicContact CD2-CZ 4.4Å; W473-F526 HydrophobicContact CE3-CB 3.67Å; W473-F526 AromaticContact CE3-CD2 3.48Å; W473-F526 HydrophobicContact CE3-CD2 3.48Å; W473-F526 VanDerWaalsContact CE3-CD2 3.48Å; W473-F526 HydrophobicContact CE3-CE2 4.3Å; W473-F526 AromaticContact CE3-CG 3.61Å; W473-F526 HydrophobicContact CE3-CG 3.61Å; W473-F526 HydrophobicContact CG-CD1 4.17Å; W473-F526 AromaticContact CG-CD2 3.61Å; W473-F526 HydrophobicContact CG-CD2 3.61Å; W473-F526 HydrophobicContact CG-CE1 4.09Å; W473-F526 AromaticContact CG-CE2 3.52Å; W473-F526 HydrophobicContact CG-CE2 3.52Å; W473-F526 AromaticContact CG-CG 3.95Å; W473-F526 HydrophobicContact CG-CG 3.95Å; W473-F526 AromaticContact CG-CZ 3.76Å; W473-F526 HydrophobicContact CG-CZ 3.76Å; W473-F526 HydrophobicContact CH2-CB 4.04Å; W473-F526 HydrophobicContact CZ2-CB 4.38Å; W473-F526 HydrophobicContact CZ3-CB 3.67Å; W473-F526 HydrophobicContact CZ3-CD2 4.36Å; W473-F526 HydrophobicContact CZ3-CG 4.13Å; F516-F526 HydrophobicContact CZ-CD2 4.24Å; V521-F526 HydrophobicContact CG1-CB 4.23Å; T522-F526 PolarHBondContact O-N 2.67Å; R523-F526 VanDerWaalsContact NH1-CD1 3.32Å; R523-F526 VanDerWaalsContact NH1-CE1 3.26Å; R523-F526 PolarHBondContact O-N 2.96Å; F526-M529 PolarHBondContact O-N 3.41Å; F526-K530 HydrophobicContact CE1-CD 3.97Å; F526-K530 HydrophobicContact CZ-CB 4.46Å; F526-K530 HydrophobicContact CZ-CD 3.9Å; F526-K530 WeakPolarHBondContact O-CB 3.35Å; F526-K530 PolarHBondContact O-N 2.95Å
527	L	97.8	Very high	96.3	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-44.2	-178.4	-73.4	169.8	0	0	0	112.1	L399 E400 E403 R523 E524 E525 K530 A531	L399-L527 HydrophobicContact CB-CB 4.07Å; L399-L527 HydrophobicContact CB-CD1 4.32Å; L399-L527 HydrophobicContact CB-CD2 4.43Å; L399-L527 HydrophobicContact CD1-CB 4.25Å; E400-L527 HydrophobicContact CB-CD1 4.34Å; E400-L527 HydrophobicContact CG-CD1 3.43Å; E400-L527 VanDerWaalsContact CG-CD1 3.43Å; E403-L527 VanDerWaalsContact CD-CD2 3.41Å; E403-L527 HydrophobicContact CG-CD2 3.45Å; E403-L527 VanDerWaalsContact CG-CD2 3.45Å; R523-L527 HydrophobicContact CG-CD1 4.14Å; R523-L527 WeakPolarHBondContact O-CB 3.37Å; R523-L527 WeakPolarHBondContact O-CG 3.49Å; R523-L527 PolarHBondContact O-N 3.49Å; E524-L527 PolarHBondContact O-N 3.36Å; E525-L527 VanDerWaalsContact C-N 3.33Å; E525-L527 PolarHBondContact O-N 2.97Å; L527-K530 PolarHBondContact O-N 3.48Å; L527-A531 PolarHBondContact O-N 2.85Å
528	C	97.8	Very high	96.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-44.4	174.5	-70.4	0	0	0	0	111.9	I396 E524 E525 K530 A531 I532 L560	I396-C528 WeakPolarHBondContact CD1-SG 3.39Å; E524-C528 PolarHBondContact O-N 3.46Å; E524-C528 VanDerWaalsContact O-N 3.07Å; E524-C528 PolarHBondContact O-SG 3.26Å; E525-C528 PolarHBondContact O-N 3.07Å; C528-K530 VanDerWaalsContact C-N 3.35Å; C528-K530 PolarHBondContact O-N 3.31Å; C528-A531 PolarHBondContact O-N 3.09Å; C528-I532 VanDerWaalsContact O-CG1 3.25Å; C528-I532 WeakPolarHBondContact O-CG1 3.47Å; C528-I532 PolarHBondContact O-N 2.78Å; C528-L560 HydrophobicContact CB-CB 3.79Å; C528-L560 HydrophobicContact CB-CD1 4.08Å
529	M	98.4	Very high	95.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.9	-43.5	175.7	-70.5	169.6	73.1	0	0	111.6	F469 V521 E525 F526 A531 I532 I533 L560 L581 L584 M585	F469-M529 HydrophobicContact CE1-CB 3.99Å; F469-M529 HydrophobicContact CE2-CB 4.4Å; F469-M529 HydrophobicContact CE2-CE 4.02Å; F469-M529 HydrophobicContact CZ-CB 3.49Å; F469-M529 VanDerWaalsContact CZ-CB 3.49Å; F469-M529 HydrophobicContact CZ-CE 3.98Å; F469-M529 HydrophobicContact CZ-CG 4.49Å; F469-M529 HydrophobicContact CZ-SD 4.33Å; V521-M529 HydrophobicContact CG1-SD 4.34Å; E525-M529 WeakPolarHBondContact O-CB 3.25Å; E525-M529 WeakPolarHBondContact O-CG 3.49Å; E525-M529 PolarHBondContact O-N 2.74Å; F526-M529 PolarHBondContact O-N 3.41Å; M529-A531 PolarHBondContact O-N 3.01Å; M529-I532 CarbonylContact O-C 3.56Å; M529-I532 PolarHBondContact O-N 3.04Å; M529-I532 VanDerWaalsContact O-N 3.13Å; M529-I533 WeakPolarHBondContact O-CG1 3.24Å; M529-I533 PolarHBondContact O-N 2.62Å; M529-L560 HydrophobicContact CG-CD1 3.97Å; M529-L560 HydrophobicContact CG-CD2 4.05Å; M529-L581 HydrophobicContact CE-CB 4.14Å; M529-L581 HydrophobicContact CE-CD2 4.38Å; M529-L581 VanDerWaalsContact CE-O 3.28Å; M529-L581 WeakPolarHBondContact CE-O 3.45Å; M529-L581 HydrophobicContact SD-CB 3.97Å; M529-L581 HydrophobicContact SD-CD2 3.88Å; M529-L581 HydrophobicContact SD-CG 4.33Å; M529-L584 HydrophobicContact CE-CD2 4.47Å; M529-M585 HydrophobicContact CB-SD 3.98Å; M529-M585 HydrophobicContact CE-CG 3.73Å; M529-M585 HydrophobicContact CE-SD 4.1Å; M529-M585 HydrophobicContact CG-SD 3.93Å
530	K	98.2	Very high	95.6	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.035	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-45.5	176.1	-170.8	-177.7	174.2	176.2	0	111.6	E403 W440 L466 F469 F526 L527 C528 I532 I533 L534	E403-K530 IonicContact OE1-NZ 2.64Å; E403-K530 PolarHBondContact OE1-NZ 3.49Å; E403-K530 IonicContact OE2-NZ 2.96Å; W440-K530 HydrophobicContact CH2-CD 4.33Å; W440-K530 HydrophobicContact CH2-CG 3.81Å; W440-K530 HydrophobicContact CZ2-CB 4.35Å; W440-K530 HydrophobicContact CZ2-CD 3.78Å; W440-K530 HydrophobicContact CZ2-CG 3.68Å; L466-K530 HydrophobicContact CD2-CG 3.9Å; L466-K530 WeakPolarHBondContact CD2-O 3.34Å; F469-K530 HydrophobicContact CD1-CB 3.92Å; F469-K530 HydrophobicContact CD1-CG 4.21Å; F469-K530 HydrophobicContact CE1-CB 3.8Å; F526-K530 HydrophobicContact CE1-CD 3.97Å; F526-K530 HydrophobicContact CZ-CB 4.46Å; F526-K530 HydrophobicContact CZ-CD 3.9Å; F526-K530 WeakPolarHBondContact O-CB 3.35Å; F526-K530 PolarHBondContact O-N 2.95Å; L527-K530 PolarHBondContact O-N 3.48Å; C528-K530 VanDerWaalsContact C-N 3.35Å; C528-K530 PolarHBondContact O-N 3.31Å; K530-I532 VanDerWaalsContact C-N 3.31Å; K530-I532 PolarHBondContact O-N 3.13Å; K530-I533 PolarHBondContact O-N 2.76Å; K530-L534 PolarHBondContact O-N 3.15Å
531	A	98.1	Very high	95.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-35.6	175.3	0	0	0	0	0	112.6	L399 L444 L527 C528 M529 Y556	L399-A531 HydrophobicContact CD2-CB 4.08Å; L444-A531 HydrophobicContact CD2-CB 4.26Å; L527-A531 PolarHBondContact O-N 2.85Å; C528-A531 PolarHBondContact O-N 3.09Å; M529-A531 PolarHBondContact O-N 3.01Å; A531-Y556 HydrophobicContact CB-CD1 3.47Å; A531-Y556 VanDerWaalsContact CB-CD1 3.47Å; A531-Y556 HydrophobicContact CB-CD2 4.34Å; A531-Y556 HydrophobicContact CB-CE1 3.76Å; A531-Y556 HydrophobicContact CB-CG 3.8Å
532	I	98.3	Very high	95	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.9	-34.1	174.4	-64	163.4	0	0	0	111.5	C528 M529 K530 L534 L535 T536 I557 L560 M585 F638	C528-I532 VanDerWaalsContact O-CG1 3.25Å; C528-I532 WeakPolarHBondContact O-CG1 3.47Å; C528-I532 PolarHBondContact O-N 2.78Å; M529-I532 CarbonylContact O-C 3.56Å; M529-I532 PolarHBondContact O-N 3.04Å; M529-I532 VanDerWaalsContact O-N 3.13Å; K530-I532 VanDerWaalsContact C-N 3.31Å; K530-I532 PolarHBondContact O-N 3.13Å; I532-L534 VanDerWaalsContact C-N 3.29Å; I532-L534 PolarHBondContact O-N 3.05Å; I532-L535 CarbonylContact O-C 3.55Å; I532-L535 VanDerWaalsContact O-CA 3.24Å; I532-L535 WeakPolarHBondContact O-CA 3.41Å; I532-L535 WeakPolarHBondContact O-CB 3.28Å; I532-L535 PolarHBondContact O-N 3.03Å; I532-T536 HydrophobicContact CG2-CG2 4.31Å; I532-T536 PolarHBondContact O-N 3.21Å; I532-T536 VanDerWaalsContact O-N 3.13Å; I532-I557 HydrophobicContact CD1-CG1 3.98Å; I532-I557 HydrophobicContact CG1-CG1 4.29Å; I532-L560 HydrophobicContact CD1-CB 3.98Å; I532-L560 HydrophobicContact CD1-CD2 3.76Å; I532-M585 HydrophobicContact CB-CE 3.8Å; I532-M585 HydrophobicContact CG2-CE 3.4Å; I532-M585 HydrophobicContact CG2-SD 4.47Å; I532-F638 HydrophobicContact CG2-CE2 3.9Å; I532-F638 HydrophobicContact CG2-CZ 3.71Å
533	I	97.7	Very high	94.9	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-64.4	-28.5	178.4	-72.9	169.3	0	0	0	113	N465 L466 F469 M529 K530 L535 T536 M585	N465-I533 HydrophobicContact CB-CG2 3.43Å; N465-I533 VanDerWaalsContact CB-CG2 3.43Å; L466-I533 HydrophobicContact CD2-CB 4.04Å; L466-I533 HydrophobicContact CD2-CG2 3.76Å; L466-I533 HydrophobicContact CG-CG2 4.08Å; F469-I533 HydrophobicContact CB-CD1 3.88Å; F469-I533 HydrophobicContact CD1-CD1 3.68Å; F469-I533 HydrophobicContact CD2-CD1 3.37Å; F469-I533 HydrophobicContact CE1-CD1 3.99Å; F469-I533 HydrophobicContact CE2-CD1 3.67Å; F469-I533 HydrophobicContact CG-CD1 3.37Å; F469-I533 HydrophobicContact CZ-CD1 4Å; M529-I533 WeakPolarHBondContact O-CG1 3.24Å; M529-I533 PolarHBondContact O-N 2.62Å; K530-I533 PolarHBondContact O-N 2.76Å; I533-L535 PolarHBondContact O-N 3.45Å; I533-T536 PolarHBondContact O-OG1 2.9Å; I533-M585 HydrophobicContact CD1-CE 4.41Å; I533-M585 HydrophobicContact CG1-CE 3.55Å
534	L	97.4	Very high	94.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.6	167.6	177.1	60.8	0	0	0	112.2	W440 S441 L444 F447 L458 I459 S462 L466 K530 I532	W440-L534 HydrophobicContact CZ3-CB 4.29Å; W440-L534 HydrophobicContact CZ3-CD2 4.14Å; S441-L534 WeakPolarHBondContact OG-CD2 3.38Å; L444-L534 HydrophobicContact CD1-CD2 3.31Å; F447-L534 HydrophobicContact CD2-CD2 3.85Å; F447-L534 HydrophobicContact CE2-CD1 4.33Å; F447-L534 HydrophobicContact CE2-CD2 3.81Å; F447-L534 HydrophobicContact CE2-CG 4.33Å; L458-L534 HydrophobicContact CB-CD1 4.21Å; I459-L534 HydrophobicContact CG1-CD1 4.31Å; S462-L534 VanDerWaalsContact OG-CD1 3.26Å; S462-L534 WeakPolarHBondContact OG-CD1 3.37Å; L466-L534 HydrophobicContact CD1-CB 4.47Å; L466-L534 HydrophobicContact CD1-CD1 4.36Å; K530-L534 PolarHBondContact O-N 3.15Å; I532-L534 VanDerWaalsContact C-N 3.29Å; I532-L534 PolarHBondContact O-N 3.05Å
535	L	96.5	Very high	94.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	17.7	-170.8	-48.5	174.6	0	0	0	112.5	L458 I532 I533 F549 M552 R553 Y556	L458-L535 HydrophobicContact CD1-CD2 4.18Å; I532-L535 CarbonylContact O-C 3.55Å; I532-L535 VanDerWaalsContact O-CA 3.24Å; I532-L535 WeakPolarHBondContact O-CA 3.41Å; I532-L535 WeakPolarHBondContact O-CB 3.28Å; I532-L535 PolarHBondContact O-N 3.03Å; I533-L535 PolarHBondContact O-N 3.45Å; L535-F549 HydrophobicContact CB-CE2 3.8Å; L535-F549 HydrophobicContact CB-CZ 4.19Å; L535-F549 HydrophobicContact CD2-CD2 3.9Å; L535-F549 HydrophobicContact CD2-CE2 3.65Å; L535-F549 HydrophobicContact CG-CE2 4.3Å; L535-M552 HydrophobicContact CD1-CE 4.14Å; L535-M552 HydrophobicContact CD1-CG 3.93Å; L535-M552 HydrophobicContact CD1-SD 4.18Å; L535-M552 HydrophobicContact CD2-CE 4.27Å; L535-M552 HydrophobicContact CD2-SD 4.08Å; L535-R553 HydrophobicContact CB-CB 4.22Å; L535-R553 HydrophobicContact CB-CG 4.02Å; L535-R553 HydrophobicContact CD1-CB 4.01Å; L535-R553 HydrophobicContact CD1-CG 4.48Å; L535-R553 WeakPolarHBondContact O-CD 3.21Å; L535-R553 PolarHBondContact O-NE 3.44Å; L535-R553 VanDerWaalsContact O-NE 3.08Å; L535-Y556 HydrophobicContact CD1-CD2 3.98Å
536	T	91.9	Very high	94.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	15%	0.153	C	C	.	.	S	Bend	trans	-92.4	-6.9	173.8	47	0	0	0	0	114.2	I532 I533 M585 P635 L636	I532-T536 HydrophobicContact CG2-CG2 4.31Å; I532-T536 PolarHBondContact O-N 3.21Å; I532-T536 VanDerWaalsContact O-N 3.13Å; I533-T536 PolarHBondContact O-OG1 2.9Å; T536-M585 HydrophobicContact CG2-CE 3.89Å; T536-P635 CarbonylContact O-C 3.54Å; T536-P635 WeakPolarHBondContact O-CA 3.26Å; T536-L636 PolarHBondContact O-N 3.32Å
537	T	90.6	Very high	94.6	Very high	13 Å²	13	33.3 Å²	33.3	8%	0.08	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	121.2	-171.1	-42.9	0	0	0	0	111.7	Y461 V633	Y461-T537 HydrophobicContact CG-CG2 4.39Å; T537-V633 HydrophobicContact CG2-CG1 3.35Å
538	V	92.4	Very high	94.5	Very high	7 Å²	7	34.7 Å²	34.7	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	157.1	-175	-61.5	0	0	0	0	111.1	L458 L543 F549 K634 L636	L458-V538 HydrophobicContact CD2-CG1 4.29Å; V538-L543 HydrophobicContact CG1-CD1 3.99Å; V538-L543 HydrophobicContact CG1-CG 4.38Å; V538-F549 HydrophobicContact CG1-CE1 3.89Å; V538-F549 HydrophobicContact CG1-CE2 4.06Å; V538-F549 HydrophobicContact CG1-CZ 3.5Å; V538-F549 VanDerWaalsContact CG1-CZ 3.5Å; V538-K634 HydrophobicContact CG2-CB 4.2Å; V538-K634 PolarHBondContact N-O 3.01Å; V538-K634 VanDerWaalsContact N-O 3.07Å; V538-K634 PolarHBondContact O-N 2.75Å; V538-L636 HydrophobicContact CG1-CD1 3.82Å; V538-L636 HydrophobicContact CG1-CG 4.47Å; V538-L636 HydrophobicContact CG2-CD1 4.03Å; V538-L636 HydrophobicContact CG2-CD2 3.87Å; V538-L636 HydrophobicContact CG2-CG 3.96Å
539	P	91	Very high	94.5	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.058	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	156.1	172.4	31.4	-36.7	0	0	0	111.6	T457 Y461 E541 G542 L543 M632	T457-P539 HydrophobicContact CG2-CG 4.32Å; Y461-P539 HydrophobicContact CE2-CB 4.04Å; Y461-P539 HydrophobicContact CE2-CG 4.49Å; P539-E541 VanDerWaalsContact C-N 3.26Å; P539-E541 HydrophobicContact CB-CG 4.04Å; P539-E541 HydrophobicContact CG-CG 4.25Å; P539-E541 PolarHBondContact O-N 2.9Å; P539-G542 WeakPolarHBondContact CG-O 3.36Å; P539-G542 PolarHBondContact O-N 3.38Å; P539-G542 VanDerWaalsContact O-N 3.13Å; P539-L543 HydrophobicContact CG-CD2 4.08Å; P539-M632 WeakPolarHBondContact CA-O 3.31Å
540	L	88.1	Confident	94.3	Very high	116 Å²	116	40 Å²	40	61%	0.607	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-33.8	178.6	-83.8	-178.7	0	0	0	113.6	G542 G631 M632 K634	L540-G542 PolarHBondContact O-N 2.94Å; L540-G631 WeakPolarHBondContact CD1-O 3.37Å; L540-M632 PolarHBondContact N-O 3.35Å; L540-K634 HydrophobicContact CD2-CB 4.16Å
541	E	88.2	Confident	94.2	Very high	187 Å²	187	45.6 Å²	45.6	87%	0.874	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-9.6	178.5	57.9	-175.6	169.2	0	0	114.1	P539	P539-E541 VanDerWaalsContact C-N 3.26Å; P539-E541 HydrophobicContact CB-CG 4.04Å; P539-E541 HydrophobicContact CG-CG 4.25Å; P539-E541 PolarHBondContact O-N 2.9Å
542	G	90.9	Very high	94.1	Very high	29 Å²	29	45.8 Å²	45.8	30%	0.299	25%	0.248	S	C	.	.			trans	83.3	178.9	-174.2	0	0	0	0	0	113.6	P539 L540	P539-G542 WeakPolarHBondContact CG-O 3.36Å; P539-G542 PolarHBondContact O-N 3.38Å; P539-G542 VanDerWaalsContact O-N 3.13Å; L540-G542 PolarHBondContact O-N 2.94Å
543	L	93.6	Very high	94.1	Very high	16 Å²	16	47.8 Å²	47.8	8%	0.084	26%	0.255	C	S	.	.			trans	-102.4	150.6	-179	-63.6	174	0	0	0	111.4	D454 L458 V538 P539 S545 Q546 F549	D454-L543 HydrophobicContact CB-CD2 4.1Å; L458-L543 HydrophobicContact CD1-CD1 4.26Å; L458-L543 HydrophobicContact CD2-CD1 4.16Å; L458-L543 HydrophobicContact CG-CD1 4.37Å; V538-L543 HydrophobicContact CG1-CD1 3.99Å; V538-L543 HydrophobicContact CG1-CG 4.38Å; P539-L543 HydrophobicContact CG-CD2 4.08Å; L543-S545 VanDerWaalsContact C-N 3.26Å; L543-S545 PolarHBondContact O-N 3.06Å; L543-Q546 WeakPolarHBondContact O-CB 3.3Å; L543-Q546 PolarHBondContact O-N 3.45Å; L543-F549 HydrophobicContact CD1-CB 3.84Å; L543-F549 HydrophobicContact CD1-CD1 3.93Å; L543-F549 HydrophobicContact CD1-CD2 3.49Å; L543-F549 VanDerWaalsContact CD1-CD2 3.49Å; L543-F549 HydrophobicContact CD1-CE1 4.38Å; L543-F549 HydrophobicContact CD1-CE2 3.97Å; L543-F549 HydrophobicContact CD1-CG 3.46Å; L543-F549 VanDerWaalsContact CD1-CG 3.46Å; L543-F549 HydrophobicContact CD1-CZ 4.4Å
544	K	94.6	Very high	94	Very high	134 Å²	134	52.1 Å²	52.1	58%	0.583	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-35.3	178.2	-64	-178.9	172.4	-171.9	0	112.1	H451 N453 D454	H451-K544 HydrophobicContact CB-CB 4.04Å; H451-K544 HydrophobicContact CB-CD 4.39Å; H451-K544 VanDerWaalsContact CD2-CD 3.4Å; H451-K544 WeakPolarHBondContact CD2-CD 3.44Å; H451-K544 PolarHBondContact CE1-NZ 2.88Å; H451-K544 WeakPolarHBondContact NE2-CD 3.38Å; H451-K544 PolarHBondContact NE2-NZ 3.43Å; N453-K544 PolarHBondContact ND2-NZ 3.45Å; D454-K544 PolarHBondContact OD1-N 3.24Å; D454-K544 PolarHBondContact OD2-N 3.34Å
545	S	94.6	Very high	93.8	Very high	31 Å²	31	54 Å²	54	22%	0.217	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	37.4	177.4	-63.9	0	0	0	0	112.2	H451 D454 L543 A547 A548 F549	H451-S545 WeakPolarHBondContact CB-OG 3.37Å; H451-S545 PolarHBondContact N-OG 3.26Å; D454-S545 WeakPolarHBondContact OD2-CB 3.3Å; D454-S545 PolarHBondContact OD2-N 2.76Å; L543-S545 VanDerWaalsContact C-N 3.26Å; L543-S545 PolarHBondContact O-N 3.06Å; S545-A547 VanDerWaalsContact C-N 3.29Å; S545-A547 PolarHBondContact O-N 2.87Å; S545-A547 VanDerWaalsContact O-N 3.11Å; S545-A548 PolarHBondContact O-N 3.42Å; S545-F549 PolarHBondContact O-N 3.49Å
546	Q	95.3	Very high	93.8	Very high	62 Å²	62	54.3 Å²	54.3	29%	0.29	29%	0.287	S	S	.	.	H	α-helix	trans	-44.4	-47.1	-174.2	-170.7	63.6	29.6	0	0	114.2	L543 A548 F549 E550	L543-Q546 WeakPolarHBondContact O-CB 3.3Å; L543-Q546 PolarHBondContact O-N 3.45Å; Q546-A548 PolarHBondContact O-N 3.14Å; Q546-F549 WeakPolarHBondContact O-CB 3.42Å; Q546-F549 PolarHBondContact O-N 3.35Å; Q546-E550 WeakPolarHBondContact CG-OE1 3.47Å; Q546-E550 PolarHBondContact NE2-OE1 3.08Å; Q546-E550 WeakPolarHBondContact O-CG 3.49Å; Q546-E550 PolarHBondContact O-N 3.42Å
547	A	95.2	Very high	94	Very high	79 Å²	79	55 Å²	55	65%	0.653	29%	0.29	S	S	*	.	H	α-helix	trans	-64.2	-40.3	-179.9	0	0	0	0	0	113.3	S545 E550 E551	S545-A547 VanDerWaalsContact C-N 3.29Å; S545-A547 PolarHBondContact O-N 2.87Å; S545-A547 VanDerWaalsContact O-N 3.11Å; A547-E550 PolarHBondContact O-N 2.89Å; A547-E551 WeakPolarHBondContact O-CB 3.26Å; A547-E551 PolarHBondContact O-N 3.02Å
548	A	96	Very high	94.2	Very high	31 Å²	31	59 Å²	59	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-73	-30.9	177.1	0	0	0	0	0	111.9	L450 S545 Q546 M552	L450-A548 HydrophobicContact CD2-CB 3.87Å; S545-A548 PolarHBondContact O-N 3.42Å; Q546-A548 PolarHBondContact O-N 3.14Å; A548-M552 VanDerWaalsContact O-CB 3.25Å; A548-M552 WeakPolarHBondContact O-CB 3.28Å; A548-M552 PolarHBondContact O-N 2.92Å
549	F	97.2	Very high	94.3	Very high	2 Å²	2	59 Å²	59	1%	0.009	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-45.7	170.2	167.1	-96.1	0	0	0	111.6	L450 L458 L535 V538 L543 S545 Q546 M552 R553 L636	L450-F549 HydrophobicContact CD2-CB 4.06Å; L458-F549 HydrophobicContact CD1-CD2 3.91Å; L458-F549 HydrophobicContact CD1-CE2 4.2Å; L458-F549 HydrophobicContact CD2-CD2 4.16Å; L458-F549 HydrophobicContact CD2-CE2 3.67Å; L535-F549 HydrophobicContact CB-CE2 3.8Å; L535-F549 HydrophobicContact CB-CZ 4.19Å; L535-F549 HydrophobicContact CD2-CD2 3.9Å; L535-F549 HydrophobicContact CD2-CE2 3.65Å; L535-F549 HydrophobicContact CG-CE2 4.3Å; V538-F549 HydrophobicContact CG1-CE1 3.89Å; V538-F549 HydrophobicContact CG1-CE2 4.06Å; V538-F549 HydrophobicContact CG1-CZ 3.5Å; V538-F549 VanDerWaalsContact CG1-CZ 3.5Å; L543-F549 HydrophobicContact CD1-CB 3.84Å; L543-F549 HydrophobicContact CD1-CD1 3.93Å; L543-F549 HydrophobicContact CD1-CD2 3.49Å; L543-F549 VanDerWaalsContact CD1-CD2 3.49Å; L543-F549 HydrophobicContact CD1-CE1 4.38Å; L543-F549 HydrophobicContact CD1-CE2 3.97Å; L543-F549 HydrophobicContact CD1-CG 3.46Å; L543-F549 VanDerWaalsContact CD1-CG 3.46Å; L543-F549 HydrophobicContact CD1-CZ 4.4Å; S545-F549 PolarHBondContact O-N 3.49Å; Q546-F549 WeakPolarHBondContact O-CB 3.42Å; Q546-F549 PolarHBondContact O-N 3.35Å; F549-M552 PolarHBondContact O-N 3.4Å; F549-R553 VanDerWaalsContact O-CB 3.32Å; F549-R553 WeakPolarHBondContact O-CB 3.33Å; F549-R553 PolarHBondContact O-N 2.94Å; F549-L636 HydrophobicContact CE1-CD1 3.75Å; F549-L636 HydrophobicContact CZ-CD1 3.71Å
550	E	95.7	Very high	94.5	Very high	109 Å²	109	58.5 Å²	58.5	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-41.5	177.6	-75.4	174.1	-166.1	0	0	111.7	Q546 A547 R553 Q554	Q546-E550 WeakPolarHBondContact CG-OE1 3.47Å; Q546-E550 PolarHBondContact NE2-OE1 3.08Å; Q546-E550 WeakPolarHBondContact O-CG 3.49Å; Q546-E550 PolarHBondContact O-N 3.42Å; A547-E550 PolarHBondContact O-N 2.89Å; E550-R553 PolarHBondContact O-N 3.42Å; E550-Q554 WeakPolarHBondContact O-CB 3.49Å; E550-Q554 PolarHBondContact O-N 2.8Å
551	E	95.9	Very high	94.8	Very high	126 Å²	126	54.8 Å²	54.8	59%	0.589	28%	0.284	S	S	*	.	H	α-helix	trans	-59.6	-51.6	172	-164.4	-157.8	137.2	0	0	111.1	A547 R553 Q554 N555	A547-E551 WeakPolarHBondContact O-CB 3.26Å; A547-E551 PolarHBondContact O-N 3.02Å; E551-R553 PolarHBondContact O-N 2.97Å; E551-Q554 PolarHBondContact O-N 3.34Å; E551-N555 WeakPolarHBondContact O-CB 3.23Å; E551-N555 PolarHBondContact O-N 2.93Å; E551-N555 PolarHBondContact O-ND2 2.94Å; E551-N555 PolarHBondContact O-OD1 3.32Å; E551-N555 PolarHBondContact OE1-ND2 3.11Å
552	M	95.8	Very high	95	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-47.9	178.6	-175.1	-173.8	172.8	0	0	111.6	L444 F447 L450 L535 A548 F549 Q554 N555 Y556	L444-M552 HydrophobicContact CB-CE 4.09Å; L444-M552 HydrophobicContact CD1-CE 4.25Å; F447-M552 HydrophobicContact CB-CE 3.71Å; F447-M552 HydrophobicContact CB-SD 4.18Å; F447-M552 HydrophobicContact CD2-CE 3.99Å; F447-M552 HydrophobicContact CD2-SD 4.31Å; F447-M552 HydrophobicContact CG-CE 4.36Å; L450-M552 HydrophobicContact CD1-SD 4.13Å; L535-M552 HydrophobicContact CD1-CE 4.14Å; L535-M552 HydrophobicContact CD1-CG 3.93Å; L535-M552 HydrophobicContact CD1-SD 4.18Å; L535-M552 HydrophobicContact CD2-CE 4.27Å; L535-M552 HydrophobicContact CD2-SD 4.08Å; A548-M552 VanDerWaalsContact O-CB 3.25Å; A548-M552 WeakPolarHBondContact O-CB 3.28Å; A548-M552 PolarHBondContact O-N 2.92Å; F549-M552 PolarHBondContact O-N 3.4Å; M552-Q554 PolarHBondContact O-N 2.89Å; M552-N555 WeakPolarHBondContact O-CB 3.32Å; M552-N555 PolarHBondContact O-N 3.44Å; M552-Y556 HydrophobicContact CE-CD2 4.44Å; M552-Y556 HydrophobicContact CE-CE2 3.6Å; M552-Y556 HydrophobicContact CG-CD2 4.12Å; M552-Y556 HydrophobicContact CG-CE2 3.69Å; M552-Y556 WeakPolarHBondContact O-CD2 3.48Å; M552-Y556 PolarHBondContact O-N 3.41Å
553	R	96.8	Very high	95	Very high	42 Å²	42	47.7 Å²	47.7	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-44.1	178.2	-171.6	178.5	-176.3	-85.3	2.2	111.3	L535 F549 E550 E551 N555 Y556 I557 L636	L535-R553 HydrophobicContact CB-CB 4.22Å; L535-R553 HydrophobicContact CB-CG 4.02Å; L535-R553 HydrophobicContact CD1-CB 4.01Å; L535-R553 HydrophobicContact CD1-CG 4.48Å; L535-R553 WeakPolarHBondContact O-CD 3.21Å; L535-R553 PolarHBondContact O-NE 3.44Å; L535-R553 VanDerWaalsContact O-NE 3.08Å; F549-R553 VanDerWaalsContact O-CB 3.32Å; F549-R553 WeakPolarHBondContact O-CB 3.33Å; F549-R553 PolarHBondContact O-N 2.94Å; E550-R553 PolarHBondContact O-N 3.42Å; E551-R553 PolarHBondContact O-N 2.97Å; R553-N555 VanDerWaalsContact C-N 3.28Å; R553-N555 PolarHBondContact O-N 3.09Å; R553-Y556 PolarHBondContact O-N 3.19Å; R553-I557 HydrophobicContact CG-CD1 4.02Å; R553-I557 VanDerWaalsContact O-CG1 3.31Å; R553-I557 WeakPolarHBondContact O-CG1 3.15Å; R553-I557 PolarHBondContact O-N 3.16Å; R553-L636 PolarHBondContact NH2-O 3.19Å
554	Q	95.5	Very high	95	Very high	98 Å²	98	47 Å²	47	46%	0.458	24%	0.239	S	C	.	.	H	α-helix	trans	-69.1	-26.8	177.9	-169.1	59.7	15.2	0	0	112.3	E550 E551 M552 R558	E550-Q554 WeakPolarHBondContact O-CB 3.49Å; E550-Q554 PolarHBondContact O-N 2.8Å; E551-Q554 PolarHBondContact O-N 3.34Å; M552-Q554 PolarHBondContact O-N 2.89Å; Q554-R558 WeakPolarHBondContact O-CG 3.34Å; Q554-R558 PolarHBondContact O-N 3.27Å; Q554-R558 VanDerWaalsContact O-N 3.14Å; Q554-R558 PolarHBondContact O-NH1 3.37Å
555	N	94.7	Very high	94.8	Very high	40 Å²	40	45.2 Å²	45.2	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-54.2	172.7	-66.6	-17.6	0	0	0	110.4	E551 M552 R553 I557 R558 E559	E551-N555 WeakPolarHBondContact O-CB 3.23Å; E551-N555 PolarHBondContact O-N 2.93Å; E551-N555 PolarHBondContact O-ND2 2.94Å; E551-N555 PolarHBondContact O-OD1 3.32Å; E551-N555 PolarHBondContact OE1-ND2 3.11Å; M552-N555 WeakPolarHBondContact O-CB 3.32Å; M552-N555 PolarHBondContact O-N 3.44Å; R553-N555 VanDerWaalsContact C-N 3.28Å; R553-N555 PolarHBondContact O-N 3.09Å; N555-I557 VanDerWaalsContact C-N 3.32Å; N555-I557 PolarHBondContact O-N 2.84Å; N555-R558 WeakPolarHBondContact O-CA 3.4Å; N555-R558 WeakPolarHBondContact O-CB 3.42Å; N555-R558 PolarHBondContact O-N 3.38Å; N555-R558 VanDerWaalsContact OD1-CZ 3.23Å; N555-R558 PolarHBondContact OD1-NH1 3.04Å; N555-R558 PolarHBondContact OD1-NH2 3.42Å; N555-E559 PolarHBondContact O-N 3.38Å
556	Y	96.9	Very high	94.2	Very high	5 Å²	5	50.2 Å²	50.2	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-30.9	178	-66.2	-72.9	0	0	0	114	I395 L399 L444 P445 A531 L535 M552 R553 R558 E559 L560	I395-Y556 HydrophobicContact CG2-CD1 4.48Å; I395-Y556 HydrophobicContact CG2-CE1 3.97Å; L399-Y556 HydrophobicContact CD1-CD1 4.38Å; L399-Y556 HydrophobicContact CD1-CE1 4.23Å; L399-Y556 HydrophobicContact CD2-CE1 4.13Å; L444-Y556 HydrophobicContact CD2-CE1 4.45Å; P445-Y556 WeakPolarHBondContact CB-OH 3.29Å; P445-Y556 WeakPolarHBondContact CD-OH 3.34Å; P445-Y556 PolarHBondContact O-OH 2.86Å; A531-Y556 HydrophobicContact CB-CD1 3.47Å; A531-Y556 VanDerWaalsContact CB-CD1 3.47Å; A531-Y556 HydrophobicContact CB-CD2 4.34Å; A531-Y556 HydrophobicContact CB-CE1 3.76Å; A531-Y556 HydrophobicContact CB-CG 3.8Å; L535-Y556 HydrophobicContact CD1-CD2 3.98Å; M552-Y556 HydrophobicContact CE-CD2 4.44Å; M552-Y556 HydrophobicContact CE-CE2 3.6Å; M552-Y556 HydrophobicContact CG-CD2 4.12Å; M552-Y556 HydrophobicContact CG-CE2 3.69Å; M552-Y556 WeakPolarHBondContact O-CD2 3.48Å; M552-Y556 PolarHBondContact O-N 3.41Å; R553-Y556 PolarHBondContact O-N 3.19Å; Y556-R558 VanDerWaalsContact C-N 3.32Å; Y556-R558 PolarHBondContact O-N 3.35Å; Y556-E559 PolarHBondContact O-N 2.96Å; Y556-L560 PolarHBondContact O-N 2.92Å
557	I	96.3	Very high	93.5	Very high	15 Å²	15	50.7 Å²	50.7	8%	0.077	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-36.9	171.3	-72.1	167.4	0	0	0	111.5	I532 R553 N555 S561 F578 F638	I532-I557 HydrophobicContact CD1-CG1 3.98Å; I532-I557 HydrophobicContact CG1-CG1 4.29Å; R553-I557 HydrophobicContact CG-CD1 4.02Å; R553-I557 VanDerWaalsContact O-CG1 3.31Å; R553-I557 WeakPolarHBondContact O-CG1 3.15Å; R553-I557 PolarHBondContact O-N 3.16Å; N555-I557 VanDerWaalsContact C-N 3.32Å; N555-I557 PolarHBondContact O-N 2.84Å; I557-S561 WeakPolarHBondContact O-CB 3.42Å; I557-S561 PolarHBondContact O-N 3.41Å; I557-S561 PolarHBondContact O-OG 3.32Å; I557-F578 HydrophobicContact CG2-CE2 4.21Å; I557-F578 HydrophobicContact CG2-CZ 4.04Å; I557-F638 HydrophobicContact CD1-CE1 3.81Å; I557-F638 HydrophobicContact CD1-CZ 3.91Å; I557-F638 HydrophobicContact CG1-CE1 4.12Å; I557-F638 HydrophobicContact CG1-CZ 4.1Å
558	R	94.6	Very high	92.9	Very high	98 Å²	98	49.6 Å²	49.6	37%	0.37	24%	0.237	S	C	.	.	H	α-helix	trans	-69	-38.3	171.6	-68.7	-167.4	-43.7	-75.3	12	111.8	Q554 N555 Y556 S561 R562	Q554-R558 WeakPolarHBondContact O-CG 3.34Å; Q554-R558 PolarHBondContact O-N 3.27Å; Q554-R558 VanDerWaalsContact O-N 3.14Å; Q554-R558 PolarHBondContact O-NH1 3.37Å; N555-R558 WeakPolarHBondContact O-CA 3.4Å; N555-R558 WeakPolarHBondContact O-CB 3.42Å; N555-R558 PolarHBondContact O-N 3.38Å; N555-R558 VanDerWaalsContact OD1-CZ 3.23Å; N555-R558 PolarHBondContact OD1-NH1 3.04Å; N555-R558 PolarHBondContact OD1-NH2 3.42Å; Y556-R558 VanDerWaalsContact C-N 3.32Å; Y556-R558 PolarHBondContact O-N 3.35Å; R558-S561 WeakPolarHBondContact O-CB 3.25Å; R558-S561 PolarHBondContact O-N 3.47Å; R558-R562 WeakPolarHBondContact O-CG 3.48Å; R558-R562 PolarHBondContact O-N 2.73Å
559	E	94.1	Very high	91.9	Very high	6 Å²	6	57.6 Å²	57.6	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-45.4	175.1	-55.6	-41.6	136.2	0	0	112.7	S392 I395 N555 Y556 S561 R562 A563	S392-E559 WeakPolarHBondContact CA-OE2 3.39Å; S392-E559 WeakPolarHBondContact CB-OE2 3.28Å; I395-E559 HydrophobicContact CB-CG 4.25Å; I395-E559 HydrophobicContact CD1-CG 4.09Å; I395-E559 HydrophobicContact CG2-CG 3.87Å; N555-E559 PolarHBondContact O-N 3.38Å; Y556-E559 PolarHBondContact O-N 2.96Å; E559-S561 VanDerWaalsContact C-N 3.26Å; E559-S561 PolarHBondContact O-N 3.32Å; E559-R562 PolarHBondContact O-N 3.5Å; E559-R562 VanDerWaalsContact O-N 3.09Å; E559-R562 IonicContact OE1-CZ 3.43Å; E559-R562 IonicContact OE1-NH1 2.69Å; E559-R562 PolarHBondContact OE1-NH1 2.88Å; E559-R562 IonicContact OE2-CZ 2.73Å; E559-R562 IonicContact OE2-NH1 3.78Å; E559-R562 PolarHBondContact OE2-NH1 2.88Å; E559-A563 PolarHBondContact O-N 2.87Å
560	L	95.9	Very high	91.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.4	-43.9	172.2	-179.4	57.2	0	0	0	110.9	E525 C528 M529 I532 Y556 R562 A563 I564 F578 L581 T582	E525-L560 HydrophobicContact CB-CD1 4.37Å; C528-L560 HydrophobicContact CB-CB 3.79Å; C528-L560 HydrophobicContact CB-CD1 4.08Å; M529-L560 HydrophobicContact CG-CD1 3.97Å; M529-L560 HydrophobicContact CG-CD2 4.05Å; I532-L560 HydrophobicContact CD1-CB 3.98Å; I532-L560 HydrophobicContact CD1-CD2 3.76Å; Y556-L560 PolarHBondContact O-N 2.92Å; L560-R562 VanDerWaalsContact C-N 3.35Å; L560-R562 PolarHBondContact O-N 2.89Å; L560-A563 PolarHBondContact O-N 3.21Å; L560-I564 HydrophobicContact CD1-CD1 4.08Å; L560-I564 HydrophobicContact CD1-CG1 4.38Å; L560-I564 HydrophobicContact CG-CD1 3.92Å; L560-I564 WeakPolarHBondContact O-CD1 3.49Å; L560-I564 VanDerWaalsContact O-CG1 3.26Å; L560-I564 WeakPolarHBondContact O-CG1 3.42Å; L560-I564 PolarHBondContact O-N 2.87Å; L560-F578 HydrophobicContact CD2-CD2 4.4Å; L560-F578 HydrophobicContact CD2-CE2 4.12Å; L560-F578 HydrophobicContact CG-CD2 4.44Å; L560-F578 HydrophobicContact CG-CE2 4.4Å; L560-L581 HydrophobicContact CD1-CD1 4.3Å; L560-T582 HydrophobicContact CD2-CG2 4.24Å
561	S	94.3	Very high	90.3	Very high	37 Å²	37	61.2 Å²	61.2	26%	0.259	29%	0.294	S	S	.	.	H	α-helix	trans	-61.2	-40.2	176.5	-57.4	0	0	0	0	112.1	I557 R558 E559 H565	I557-S561 WeakPolarHBondContact O-CB 3.42Å; I557-S561 PolarHBondContact O-N 3.41Å; I557-S561 PolarHBondContact O-OG 3.32Å; R558-S561 WeakPolarHBondContact O-CB 3.25Å; R558-S561 PolarHBondContact O-N 3.47Å; E559-S561 VanDerWaalsContact C-N 3.26Å; E559-S561 PolarHBondContact O-N 3.32Å; S561-H565 PolarHBondContact O-N 2.94Å; S561-H565 PolarHBondContact O-ND1 3.25Å
562	R	90.7	Very high	89.8	Confident	52 Å²	52	60.2 Å²	60.2	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-69.8	-42.8	176.8	-68.1	-164.9	-157.4	88.4	-7.7	112.2	E388 R558 E559 L560 I564 H565 M566	E388-R562 IonicContact OE1-CZ 3.35Å; E388-R562 IonicContact OE1-NE 3.13Å; E388-R562 IonicContact OE1-NH2 2.73Å; E388-R562 PolarHBondContact OE1-NH2 2.87Å; R558-R562 WeakPolarHBondContact O-CG 3.48Å; R558-R562 PolarHBondContact O-N 2.73Å; E559-R562 PolarHBondContact O-N 3.5Å; E559-R562 VanDerWaalsContact O-N 3.09Å; E559-R562 IonicContact OE1-CZ 3.43Å; E559-R562 IonicContact OE1-NH1 2.69Å; E559-R562 PolarHBondContact OE1-NH1 2.88Å; E559-R562 IonicContact OE2-CZ 2.73Å; E559-R562 IonicContact OE2-NH1 3.78Å; E559-R562 PolarHBondContact OE2-NH1 2.88Å; L560-R562 VanDerWaalsContact C-N 3.35Å; L560-R562 PolarHBondContact O-N 2.89Å; R562-I564 VanDerWaalsContact C-N 3.32Å; R562-I564 PolarHBondContact O-N 3.31Å; R562-H565 PolarHBondContact O-N 2.92Å; R562-H565 VanDerWaalsContact O-N 3.09Å; R562-M566 PolarHBondContact O-N 3.39Å; R562-M566 VanDerWaalsContact O-N 3.16Å
563	A	91.9	Very high	89.5	Confident	15 Å²	15	61.6 Å²	61.6	12%	0.124	31%	0.309	C	S	.	.	H	α-helix	trans	-55.7	-47.1	175.3	0	0	0	0	0	111.4	E524 E525 E559 L560 H565 M566	E524-A563 HydrophobicContact CB-CB 4.19Å; E525-A563 HydrophobicContact CG-CB 4.32Å; E559-A563 PolarHBondContact O-N 2.87Å; L560-A563 PolarHBondContact O-N 3.21Å; A563-H565 VanDerWaalsContact C-N 3.33Å; A563-H565 PolarHBondContact O-N 3.21Å; A563-M566 WeakPolarHBondContact O-CB 3.29Å; A563-M566 PolarHBondContact O-N 3.4Å; A563-M566 VanDerWaalsContact O-N 3.11Å
564	I	93.6	Very high	89.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-41.8	175.3	-69.4	162.4	0	0	0	111.9	E525 L560 R562 M566 K567 E568 S574 R577 F578 L581	E525-I564 HydrophobicContact CG-CG1 4.48Å; L560-I564 HydrophobicContact CD1-CD1 4.08Å; L560-I564 HydrophobicContact CD1-CG1 4.38Å; L560-I564 HydrophobicContact CG-CD1 3.92Å; L560-I564 WeakPolarHBondContact O-CD1 3.49Å; L560-I564 VanDerWaalsContact O-CG1 3.26Å; L560-I564 WeakPolarHBondContact O-CG1 3.42Å; L560-I564 PolarHBondContact O-N 2.87Å; R562-I564 VanDerWaalsContact C-N 3.32Å; R562-I564 PolarHBondContact O-N 3.31Å; I564-M566 VanDerWaalsContact C-N 3.28Å; I564-M566 PolarHBondContact O-N 2.97Å; I564-K567 PolarHBondContact O-N 2.95Å; I564-E568 HydrophobicContact CG2-CB 4.46Å; I564-E568 HydrophobicContact CG2-CG 4.48Å; I564-E568 WeakPolarHBondContact O-CB 3.27Å; I564-E568 PolarHBondContact O-N 3.23Å; I564-S574 WeakPolarHBondContact CG2-O 3.17Å; I564-R577 HydrophobicContact CG1-CG 4.37Å; I564-R577 HydrophobicContact CG2-CB 3.99Å; I564-R577 HydrophobicContact CG2-CG 4.16Å; I564-F578 HydrophobicContact CD1-CB 3.84Å; I564-F578 HydrophobicContact CD1-CD2 3.85Å; I564-F578 HydrophobicContact CD1-CG 4.32Å; I564-L581 HydrophobicContact CD1-CD1 3.83Å; I564-L581 HydrophobicContact CG1-CD1 3.87Å
565	H	89.1	Confident	89	Confident	97 Å²	97	58.4 Å²	58.4	45%	0.449	30%	0.303	S	S	.	.	H	α-helix	trans	-71.8	-16	179.3	-76.8	87.3	0	0	0	114.2	S561 R562 A563	S561-H565 PolarHBondContact O-N 2.94Å; S561-H565 PolarHBondContact O-ND1 3.25Å; R562-H565 PolarHBondContact O-N 2.92Å; R562-H565 VanDerWaalsContact O-N 3.09Å; A563-H565 VanDerWaalsContact C-N 3.33Å; A563-H565 PolarHBondContact O-N 3.21Å
566	M	83.6	Confident	89	Confident	136 Å²	136	61.7 Å²	61.7	67%	0.67	32%	0.317	S	S	*	.	H	α-helix	trans	-74.1	-33.7	170.5	-64.4	-60.8	96.2	0	0	111.6	R562 A563 I564	R562-M566 PolarHBondContact O-N 3.39Å; R562-M566 VanDerWaalsContact O-N 3.16Å; A563-M566 WeakPolarHBondContact O-CB 3.29Å; A563-M566 PolarHBondContact O-N 3.4Å; A563-M566 VanDerWaalsContact O-N 3.11Å; I564-M566 VanDerWaalsContact C-N 3.28Å; I564-M566 PolarHBondContact O-N 2.97Å
567	K	79.6	Confident	89	Confident	73 Å²	73	62.8 Å²	62.8	32%	0.317	32%	0.321	S	S	.	.	H	α-helix	trans	-83.1	-53.8	175.1	-179.1	166.5	174.5	171.6	0	112.2	Q520 T522 I564	Q520-K567 PolarHBondContact O-NZ 2.99Å; T522-K567 HydrophobicContact CG2-CD 3.8Å; I564-K567 PolarHBondContact O-N 2.95Å
568	E	83.4	Confident	89	Confident	55 Å²	55	64.4 Å²	64.4	26%	0.257	33%	0.328	S	S	.	.			trans	-99.2	107.5	-174.7	-61.2	-59.5	161	0	0	112	I564 G570 A573 S574 R577	I564-E568 HydrophobicContact CG2-CB 4.46Å; I564-E568 HydrophobicContact CG2-CG 4.48Å; I564-E568 WeakPolarHBondContact O-CB 3.27Å; I564-E568 PolarHBondContact O-N 3.23Å; E568-G570 VanDerWaalsContact C-N 3.29Å; E568-G570 PolarHBondContact O-N 3.16Å; E568-A573 HydrophobicContact CB-CB 4.32Å; E568-A573 HydrophobicContact CG-CB 4.48Å; E568-S574 PolarHBondContact O-OG 3.17Å; E568-R577 HydrophobicContact CG-CB 4.2Å; E568-R577 VanDerWaalsContact CG-CD 3.47Å; E568-R577 HydrophobicContact CG-CG 4.45Å
569	K	73.9	Confident	89.1	Confident	200 Å²	200	64.3 Å²	64.3	87%	0.87	33%	0.328	S	S	*	.			trans	-82.9	4.6	-175.4	-62.8	-179.8	-178.3	175.1	0	114.8
570	G	80	Confident	89.2	Confident	34 Å²	34	68.1 Å²	68.1	35%	0.351	35%	0.346	S	S	.	.	S	Bend	trans	-129.3	124.3	-175	0	0	0	0	0	112.7	E568 V572 A573 S574	E568-G570 VanDerWaalsContact C-N 3.29Å; E568-G570 PolarHBondContact O-N 3.16Å; G570-V572 PolarHBondContact O-N 3.05Å; G570-A573 WeakPolarHBondContact O-CA 3.29Å; G570-A573 WeakPolarHBondContact O-CB 3.44Å; G570-A573 PolarHBondContact O-N 3.23Å; G570-S574 PolarHBondContact O-N 2.97Å; G570-S574 PolarHBondContact O-OG 2.93Å
571	M	80.7	Confident	89.3	Confident	153 Å²	153	68.1 Å²	68.1	75%	0.754	35%	0.346	S	S	*	.	H	α-helix	trans	-47.3	-39.2	-172.6	-176.1	-178.2	177.9	0	0	115	S575	M571-S575 WeakPolarHBondContact O-CB 3.39Å; M571-S575 PolarHBondContact O-N 3.43Å; M571-S575 PolarHBondContact O-OG 3.25Å
572	V	85.3	Confident	89.5	Confident	104 Å²	104	66.4 Å²	66.4	63%	0.63	33%	0.334	S	S	*	.	H	α-helix	trans	-68.8	-46.9	177.9	-179.8	0	0	0	0	111.1	G570 S575 Q576	G570-V572 PolarHBondContact O-N 3.05Å; V572-S575 PolarHBondContact O-N 3.28Å; V572-Q576 WeakPolarHBondContact O-CB 3.42Å; V572-Q576 WeakPolarHBondContact O-CG 3.44Å; V572-Q576 PolarHBondContact O-N 2.78Å
573	A	87.9	Confident	89.8	Confident	33 Å²	33	68.9 Å²	68.9	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-42.8	176.9	0	0	0	0	0	111.4	E568 G570 S575 Q576 R577	E568-A573 HydrophobicContact CB-CB 4.32Å; E568-A573 HydrophobicContact CG-CB 4.48Å; G570-A573 WeakPolarHBondContact O-CA 3.29Å; G570-A573 WeakPolarHBondContact O-CB 3.44Å; G570-A573 PolarHBondContact O-N 3.23Å; A573-S575 VanDerWaalsContact C-N 3.32Å; A573-S575 PolarHBondContact O-N 2.89Å; A573-Q576 PolarHBondContact O-N 2.78Å; A573-R577 VanDerWaalsContact O-CB 3.27Å; A573-R577 WeakPolarHBondContact O-CB 3.22Å; A573-R577 PolarHBondContact O-N 3.06Å
574	S	91.2	Very high	90	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-40.1	174.5	-40.2	0	0	0	0	111.8	I564 E568 G570 F578	I564-S574 WeakPolarHBondContact CG2-O 3.17Å; E568-S574 PolarHBondContact O-OG 3.17Å; G570-S574 PolarHBondContact O-N 2.97Å; G570-S574 PolarHBondContact O-OG 2.93Å; S574-F578 WeakPolarHBondContact O-CB 3.38Å; S574-F578 PolarHBondContact O-N 3.27Å
575	S	92.4	Very high	90.2	Very high	69 Å²	69	68.5 Å²	68.5	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-69.4	-43	177.4	-56.8	0	0	0	0	112.3	M571 V572 A573 F578 Y579	M571-S575 WeakPolarHBondContact O-CB 3.39Å; M571-S575 PolarHBondContact O-N 3.43Å; M571-S575 PolarHBondContact O-OG 3.25Å; V572-S575 PolarHBondContact O-N 3.28Å; A573-S575 VanDerWaalsContact C-N 3.32Å; A573-S575 PolarHBondContact O-N 2.89Å; S575-F578 PolarHBondContact O-N 2.78Å; S575-Y579 PolarHBondContact O-N 2.86Å
576	Q	93.9	Very high	90.5	Very high	109 Å²	109	64.6 Å²	64.6	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-45	174.3	-74	172.5	-44.1	0	0	110.9	V572 A573 F578 Y579 H580	V572-Q576 WeakPolarHBondContact O-CB 3.42Å; V572-Q576 WeakPolarHBondContact O-CG 3.44Å; V572-Q576 PolarHBondContact O-N 2.78Å; A573-Q576 PolarHBondContact O-N 2.78Å; Q576-F578 PolarHBondContact O-N 3.29Å; Q576-Y579 WeakPolarHBondContact O-CB 3.41Å; Q576-Y579 PolarHBondContact O-N 3.4Å; Q576-H580 PolarHBondContact O-CD2 2.88Å; Q576-H580 PolarHBondContact O-N 2.86Å
577	R	95.9	Very high	91	Very high	29 Å²	29	59.2 Å²	59.2	11%	0.109	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-42.1	177.9	-171.1	165.2	-174.2	77.7	12.7	112	L519 Q520 E525 I564 E568 A573 Y579 H580 L581	L519-R577 VanDerWaalsContact O-CZ 3.3Å; L519-R577 PolarHBondContact O-NH1 3.47Å; L519-R577 PolarHBondContact O-NH2 3.32Å; Q520-R577 PolarHBondContact O-NH2 3.38Å; E525-R577 IonicContact OE1-CZ 2.68Å; E525-R577 IonicContact OE1-NE 3.78Å; E525-R577 PolarHBondContact OE1-NE 3.12Å; E525-R577 IonicContact OE1-NH2 3.72Å; E525-R577 PolarHBondContact OE1-NH2 2.91Å; E525-R577 IonicContact OE2-CZ 2.71Å; E525-R577 IonicContact OE2-NE 3.5Å; E525-R577 IonicContact OE2-NH2 3.04Å; E525-R577 PolarHBondContact OE2-NH2 2.83Å; I564-R577 HydrophobicContact CG1-CG 4.37Å; I564-R577 HydrophobicContact CG2-CB 3.99Å; I564-R577 HydrophobicContact CG2-CG 4.16Å; E568-R577 HydrophobicContact CG-CB 4.2Å; E568-R577 VanDerWaalsContact CG-CD 3.47Å; E568-R577 HydrophobicContact CG-CG 4.45Å; A573-R577 VanDerWaalsContact O-CB 3.27Å; A573-R577 WeakPolarHBondContact O-CB 3.22Å; A573-R577 PolarHBondContact O-N 3.06Å; R577-Y579 PolarHBondContact O-N 2.99Å; R577-H580 PolarHBondContact O-N 3.26Å; R577-L581 HydrophobicContact CG-CD1 3.97Å; R577-L581 HydrophobicContact CG-CG 4.38Å; R577-L581 WeakPolarHBondContact O-CB 3.29Å; R577-L581 VanDerWaalsContact O-CG 3.27Å; R577-L581 WeakPolarHBondContact O-CG 3.4Å; R577-L581 PolarHBondContact O-N 2.81Å
578	F	96.9	Very high	91.7	Very high	48 Å²	48	55.9 Å²	55.9	21%	0.211	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-46.4	172.4	-175.1	-84.9	0	0	0	111.8	I557 L560 I564 S574 S575 Q576 T582 F638	I557-F578 HydrophobicContact CG2-CE2 4.21Å; I557-F578 HydrophobicContact CG2-CZ 4.04Å; L560-F578 HydrophobicContact CD2-CD2 4.4Å; L560-F578 HydrophobicContact CD2-CE2 4.12Å; L560-F578 HydrophobicContact CG-CD2 4.44Å; L560-F578 HydrophobicContact CG-CE2 4.4Å; I564-F578 HydrophobicContact CD1-CB 3.84Å; I564-F578 HydrophobicContact CD1-CD2 3.85Å; I564-F578 HydrophobicContact CD1-CG 4.32Å; S574-F578 WeakPolarHBondContact O-CB 3.38Å; S574-F578 PolarHBondContact O-N 3.27Å; S575-F578 PolarHBondContact O-N 2.78Å; Q576-F578 PolarHBondContact O-N 3.29Å; F578-T582 HydrophobicContact CD1-CG2 4.29Å; F578-T582 HydrophobicContact CE1-CG2 3.83Å; F578-T582 HydrophobicContact CE2-CG2 4.32Å; F578-T582 HydrophobicContact CZ-CG2 3.84Å; F578-T582 WeakPolarHBondContact O-CB 3.49Å; F578-T582 PolarHBondContact O-N 3.49Å; F578-T582 PolarHBondContact O-OG1 3.02Å; F578-F638 HydrophobicContact CE1-CD1 4.3Å; F578-F638 HydrophobicContact CZ-CD1 4.36Å; F578-F638 HydrophobicContact CZ-CE1 4.13Å
579	Y	96.5	Very high	92.1	Very high	96 Å²	96	54.6 Å²	54.6	38%	0.376	28%	0.281	S	S	.	.	H	α-helix	trans	-57.7	-48.4	175	169.1	-92.2	0	0	0	111.9	S575 Q576 R577 T582 K583 H639	S575-Y579 PolarHBondContact O-N 2.86Å; Q576-Y579 WeakPolarHBondContact O-CB 3.41Å; Q576-Y579 PolarHBondContact O-N 3.4Å; R577-Y579 PolarHBondContact O-N 2.99Å; Y579-T582 PolarHBondContact O-N 3.42Å; Y579-T582 PolarHBondContact O-OG1 3.31Å; Y579-K583 HydrophobicContact CE1-CD 3.93Å; Y579-K583 WeakPolarHBondContact O-CB 3.2Å; Y579-K583 PolarHBondContact O-N 3.33Å; Y579-H639 AromaticContact CD2-CD2 3.67Å; Y579-H639 AromaticContact CD2-CE1 3.86Å; Y579-H639 AromaticContact CD2-NE2 3.15Å; Y579-H639 WeakPolarHBondContact CD2-NE2 3.33Å; Y579-H639 AromaticContact CE2-CD2 3.63Å; Y579-H639 AromaticContact CE2-NE2 3.56Å
580	H	97.2	Very high	92.9	Very high	86 Å²	86	48 Å²	48	40%	0.398	26%	0.255	S	S	.	.	H	α-helix	trans	-65.1	-43.8	-178.7	-71	-66	0	0	0	112.7	L519 Q576 R577 K583 L584	L519-H580 HydrophobicContact CD1-CB 4.28Å; L519-H580 HydrophobicContact CD2-CB 3.78Å; Q576-H580 PolarHBondContact O-CD2 2.88Å; Q576-H580 PolarHBondContact O-N 2.86Å; R577-H580 PolarHBondContact O-N 3.26Å; H580-K583 PolarHBondContact O-N 3.29Å; H580-L584 PolarHBondContact O-N 3.27Å; H580-L584 VanDerWaalsContact O-N 3.11Å
581	L	97.9	Very high	93.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-43.8	177.9	-66.2	172.4	0	0	0	111.7	L519 V521 E525 M529 L560 I564 R577 L584 M585	L519-L581 HydrophobicContact CB-CD2 4.49Å; L519-L581 HydrophobicContact CD1-CD2 4.19Å; V521-L581 HydrophobicContact CG1-CD2 4.37Å; V521-L581 HydrophobicContact CG2-CD2 3.59Å; E525-L581 HydrophobicContact CB-CD1 4.41Å; E525-L581 HydrophobicContact CG-CD1 4.22Å; M529-L581 HydrophobicContact CE-CB 4.14Å; M529-L581 HydrophobicContact CE-CD2 4.38Å; M529-L581 VanDerWaalsContact CE-O 3.28Å; M529-L581 WeakPolarHBondContact CE-O 3.45Å; M529-L581 HydrophobicContact SD-CB 3.97Å; M529-L581 HydrophobicContact SD-CD2 3.88Å; M529-L581 HydrophobicContact SD-CG 4.33Å; L560-L581 HydrophobicContact CD1-CD1 4.3Å; I564-L581 HydrophobicContact CD1-CD1 3.83Å; I564-L581 HydrophobicContact CG1-CD1 3.87Å; R577-L581 HydrophobicContact CG-CD1 3.97Å; R577-L581 HydrophobicContact CG-CG 4.38Å; R577-L581 WeakPolarHBondContact O-CB 3.29Å; R577-L581 VanDerWaalsContact O-CG 3.27Å; R577-L581 WeakPolarHBondContact O-CG 3.4Å; R577-L581 PolarHBondContact O-N 2.81Å; L581-L584 PolarHBondContact O-N 2.82Å; L581-M585 PolarHBondContact O-N 2.93Å
582	T	97.2	Very high	94.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-74.8	-26	177.9	51.6	0	0	0	0	113.1	L560 F578 Y579 M585 D586 F638 H639	L560-T582 HydrophobicContact CD2-CG2 4.24Å; F578-T582 HydrophobicContact CD1-CG2 4.29Å; F578-T582 HydrophobicContact CE1-CG2 3.83Å; F578-T582 HydrophobicContact CE2-CG2 4.32Å; F578-T582 HydrophobicContact CZ-CG2 3.84Å; F578-T582 WeakPolarHBondContact O-CB 3.49Å; F578-T582 PolarHBondContact O-N 3.49Å; F578-T582 PolarHBondContact O-OG1 3.02Å; Y579-T582 PolarHBondContact O-N 3.42Å; Y579-T582 PolarHBondContact O-OG1 3.31Å; T582-M585 HydrophobicContact CG2-SD 4.5Å; T582-M585 WeakPolarHBondContact O-CB 3.19Å; T582-M585 PolarHBondContact O-N 3.31Å; T582-D586 PolarHBondContact O-N 3.12Å; T582-F638 HydrophobicContact CG2-CD1 3.75Å; T582-F638 HydrophobicContact CG2-CD2 4Å; T582-F638 HydrophobicContact CG2-CE1 3.88Å; T582-F638 HydrophobicContact CG2-CE2 4.13Å; T582-F638 HydrophobicContact CG2-CG 3.81Å; T582-F638 HydrophobicContact CG2-CZ 4.07Å; T582-H639 PolarHBondContact OG1-CE1 3.32Å; T582-H639 VanDerWaalsContact OG1-CE1 3.28Å
583	K	96.8	Very high	94.5	Very high	105 Å²	105	40.8 Å²	40.8	46%	0.457	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-37.9	169.7	-178.3	180	-177.5	177.1	0	112.3	Y579 H580 M585 D586 A587	Y579-K583 HydrophobicContact CE1-CD 3.93Å; Y579-K583 WeakPolarHBondContact O-CB 3.2Å; Y579-K583 PolarHBondContact O-N 3.33Å; H580-K583 PolarHBondContact O-N 3.29Å; K583-M585 VanDerWaalsContact C-N 3.3Å; K583-M585 PolarHBondContact O-N 3.38Å; K583-D586 PolarHBondContact O-N 2.95Å; K583-A587 WeakPolarHBondContact O-CB 3.45Å; K583-A587 PolarHBondContact O-N 3.01Å
584	L	97.3	Very high	94.7	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-42.1	172.2	174.7	56.9	0	0	0	110.9	F511 E515 F516 L519 M529 H580 L581 A587 M588	F511-L584 HydrophobicContact CD1-CD1 4.31Å; F511-L584 HydrophobicContact CE1-CD1 3.78Å; E515-L584 HydrophobicContact CB-CD1 3.72Å; E515-L584 HydrophobicContact CB-CD2 3.92Å; E515-L584 HydrophobicContact CB-CG 4.41Å; E515-L584 HydrophobicContact CG-CD1 4.08Å; F516-L584 HydrophobicContact CD1-CD2 3.63Å; F516-L584 HydrophobicContact CE1-CD2 3.58Å; L519-L584 HydrophobicContact CD1-CD2 4.38Å; M529-L584 HydrophobicContact CE-CD2 4.47Å; H580-L584 PolarHBondContact O-N 3.27Å; H580-L584 VanDerWaalsContact O-N 3.11Å; L581-L584 PolarHBondContact O-N 2.82Å; L584-A587 PolarHBondContact O-N 3.49Å; L584-M588 HydrophobicContact CD1-CG 4.36Å; L584-M588 WeakPolarHBondContact O-CG 3.42Å; L584-M588 PolarHBondContact O-N 2.88Å
585	M	97	Very high	94.8	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-44.1	175.1	-63.1	177.1	56.5	0	0	112.4	M529 I532 I533 T536 L581 T582 K583 M588 F638	M529-M585 HydrophobicContact CB-SD 3.98Å; M529-M585 HydrophobicContact CE-CG 3.73Å; M529-M585 HydrophobicContact CE-SD 4.1Å; M529-M585 HydrophobicContact CG-SD 3.93Å; I532-M585 HydrophobicContact CB-CE 3.8Å; I532-M585 HydrophobicContact CG2-CE 3.4Å; I532-M585 HydrophobicContact CG2-SD 4.47Å; I533-M585 HydrophobicContact CD1-CE 4.41Å; I533-M585 HydrophobicContact CG1-CE 3.55Å; T536-M585 HydrophobicContact CG2-CE 3.89Å; L581-M585 PolarHBondContact O-N 2.93Å; T582-M585 HydrophobicContact CG2-SD 4.5Å; T582-M585 WeakPolarHBondContact O-CB 3.19Å; T582-M585 PolarHBondContact O-N 3.31Å; K583-M585 VanDerWaalsContact C-N 3.3Å; K583-M585 PolarHBondContact O-N 3.38Å; M585-M588 PolarHBondContact O-N 3.34Å; M585-F638 HydrophobicContact CE-CE2 4.14Å
586	D	95.6	Very high	94.7	Very high	15 Å²	15	43.6 Å²	43.6	8%	0.08	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-43.2	177	-69.6	-23.6	0	0	0	112.1	T582 K583 M588 H589 L637 F638 H639	T582-D586 PolarHBondContact O-N 3.12Å; K583-D586 PolarHBondContact O-N 2.95Å; D586-M588 VanDerWaalsContact C-N 3.3Å; D586-M588 PolarHBondContact O-N 2.92Å; D586-H589 PolarHBondContact O-N 2.98Å; D586-L637 HydrophobicContact CB-CD2 4.31Å; D586-L637 WeakPolarHBondContact OD1-CA 3.45Å; D586-F638 PolarHBondContact OD1-N 3.14Å; D586-F638 PolarHBondContact OD2-N 3.11Å; D586-H639 WeakPolarHBondContact OD2-CB 3.46Å; D586-H639 IonicContact OD2-CE1 3.15Å; D586-H639 IonicContact OD2-CG 3.23Å; D586-H639 PolarHBondContact OD2-N 2.96Å; D586-H639 IonicContact OD2-ND1 3.89Å; D586-H639 PolarHBondContact OD2-ND1 3.21Å
587	A	94.5	Very high	94.5	Very high	24 Å²	24	42.5 Å²	42.5	20%	0.198	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-33.5	178.9	0	0	0	0	0	112.6	F511 K583 L584 H589 D590	F511-A587 HydrophobicContact CE1-CB 4.14Å; K583-A587 WeakPolarHBondContact O-CB 3.45Å; K583-A587 PolarHBondContact O-N 3.01Å; L584-A587 PolarHBondContact O-N 3.49Å; A587-H589 PolarHBondContact O-N 3.05Å; A587-D590 PolarHBondContact O-N 3.49Å
588	M	94.4	Very high	94.3	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-25.9	178.4	-83.1	-175.1	55.5	0	0	114.4	V468 F469 I512 L584 M585 D586 D590 I591 V592	V468-M588 HydrophobicContact CG1-CE 4.18Å; F469-M588 HydrophobicContact CB-CE 3.81Å; F469-M588 HydrophobicContact CD2-CE 3.79Å; F469-M588 HydrophobicContact CD2-SD 3.59Å; F469-M588 VanDerWaalsContact CD2-SD 3.59Å; F469-M588 HydrophobicContact CE2-SD 4.22Å; F469-M588 HydrophobicContact CG-CE 4.31Å; I512-M588 HydrophobicContact CD1-CE 3.69Å; I512-M588 HydrophobicContact CD1-CG 3.82Å; I512-M588 HydrophobicContact CD1-SD 3.8Å; I512-M588 HydrophobicContact CG1-CE 4.49Å; I512-M588 HydrophobicContact CG1-CG 3.85Å; I512-M588 HydrophobicContact CG1-SD 3.95Å; I512-M588 HydrophobicContact CG2-SD 3.96Å; L584-M588 HydrophobicContact CD1-CG 4.36Å; L584-M588 WeakPolarHBondContact O-CG 3.42Å; L584-M588 PolarHBondContact O-N 2.88Å; M585-M588 PolarHBondContact O-N 3.34Å; D586-M588 VanDerWaalsContact C-N 3.3Å; D586-M588 PolarHBondContact O-N 2.92Å; M588-D590 VanDerWaalsContact C-N 3.26Å; M588-D590 PolarHBondContact O-N 2.64Å; M588-I591 PolarHBondContact O-N 2.96Å; M588-I591 VanDerWaalsContact O-N 3.16Å; M588-V592 WeakPolarHBondContact O-CB 3.34Å; M588-V592 WeakPolarHBondContact O-CG2 3.39Å; M588-V592 PolarHBondContact O-N 3.36Å
589	H	91.3	Very high	94.1	Very high	27 Å²	27	42.2 Å²	42.2	13%	0.125	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-33.8	178.7	-71.1	-52.4	0	0	0	112.8	N465 D586 A587 K593 L637	N465-H589 PolarHBondContact OD1-ND1 3.47Å; D586-H589 PolarHBondContact O-N 2.98Å; A587-H589 PolarHBondContact O-N 3.05Å; H589-K593 VanDerWaalsContact O-CB 3.25Å; H589-K593 WeakPolarHBondContact O-CB 3.41Å; H589-K593 PolarHBondContact O-N 3.23Å; H589-L637 VanDerWaalsContact CD2-CD2 3.42Å; H589-L637 WeakPolarHBondContact CD2-CD2 3.46Å
590	D	91.3	Very high	93.8	Very high	61 Å²	61	38.7 Å²	38.7	33%	0.326	19%	0.188	S	C	.	.	H	α-helix	trans	-73.1	-33.5	176.5	-65.7	-44.9	0	0	0	111.9	A587 M588 K594 K641	A587-D590 PolarHBondContact O-N 3.49Å; M588-D590 VanDerWaalsContact C-N 3.26Å; M588-D590 PolarHBondContact O-N 2.64Å; D590-K594 PolarHBondContact O-N 2.77Å; D590-K641 IonicContact OD1-NZ 2.73Å; D590-K641 PolarHBondContact OD1-NZ 3.3Å; D590-K641 IonicContact OD2-NZ 2.72Å; D590-K641 PolarHBondContact OD2-NZ 3.03Å
591	I	94.4	Very high	93.5	Very high	7 Å²	7	37 Å²	37	4%	0.036	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-52	173.1	-63.3	162.4	0	0	0	109.9	A508 I509 F511 I512 M588 K593 K594 V595	A508-I591 HydrophobicContact CB-CG1 4.48Å; A508-I591 HydrophobicContact CB-CG2 4.12Å; A508-I591 VanDerWaalsContact O-CD1 3.27Å; A508-I591 WeakPolarHBondContact O-CD1 3.39Å; I509-I591 HydrophobicContact CG1-CG2 4.15Å; F511-I591 HydrophobicContact CB-CD1 4.22Å; F511-I591 HydrophobicContact CD1-CD1 3.62Å; F511-I591 HydrophobicContact CE1-CD1 4.41Å; F511-I591 HydrophobicContact CG-CD1 4.26Å; I512-I591 HydrophobicContact CD1-CD1 4.41Å; I512-I591 HydrophobicContact CG1-CD1 4.21Å; M588-I591 PolarHBondContact O-N 2.96Å; M588-I591 VanDerWaalsContact O-N 3.16Å; I591-K593 VanDerWaalsContact C-N 3.25Å; I591-K593 PolarHBondContact O-N 3.13Å; I591-K594 WeakPolarHBondContact O-CB 3.16Å; I591-K594 PolarHBondContact O-N 3.33Å; I591-V595 PolarHBondContact O-N 2.73Å; I591-V595 VanDerWaalsContact O-N 3.12Å
592	V	93.4	Very high	93.2	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-32.5	-179.4	174.6	0	0	0	0	111.4	M464 N465 V468 M588 V595 N596	M464-V592 HydrophobicContact CB-CG1 3.87Å; M464-V592 HydrophobicContact CG-CG1 3.84Å; N465-V592 HydrophobicContact CB-CG1 4.41Å; N465-V592 HydrophobicContact CB-CG2 4.34Å; N465-V592 WeakPolarHBondContact OD1-CG1 3.27Å; V468-V592 HydrophobicContact CB-CG2 4.08Å; V468-V592 HydrophobicContact CG1-CG2 4.11Å; V468-V592 HydrophobicContact CG2-CG2 4.38Å; M588-V592 WeakPolarHBondContact O-CB 3.34Å; M588-V592 WeakPolarHBondContact O-CG2 3.39Å; M588-V592 PolarHBondContact O-N 3.36Å; V592-V595 PolarHBondContact O-N 2.74Å; V592-N596 WeakPolarHBondContact O-CB 3.4Å; V592-N596 PolarHBondContact O-N 2.81Å; V592-N596 PolarHBondContact O-ND2 3Å
593	K	90.6	Very high	93	Very high	131 Å²	131	39.7 Å²	39.7	57%	0.57	20%	0.198	S	C	*	.	H	α-helix	trans	-59.5	-43.9	170.8	-175.9	177.5	178.8	-178.2	0	111.9	H589 I591 N596 L597	H589-K593 VanDerWaalsContact O-CB 3.25Å; H589-K593 WeakPolarHBondContact O-CB 3.41Å; H589-K593 PolarHBondContact O-N 3.23Å; I591-K593 VanDerWaalsContact C-N 3.25Å; I591-K593 PolarHBondContact O-N 3.13Å; K593-N596 PolarHBondContact O-N 3.29Å; K593-L597 HydrophobicContact CG-CD1 4.08Å; K593-L597 WeakPolarHBondContact O-CB 3.45Å; K593-L597 VanDerWaalsContact O-CG 3.27Å; K593-L597 WeakPolarHBondContact O-CG 3.34Å; K593-L597 PolarHBondContact O-N 3.13Å
594	K	92.2	Very high	92.7	Very high	103 Å²	103	40.1 Å²	40.1	45%	0.448	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-45.4	174.8	-65.7	177.1	-179.4	-177.2	0	111.6	L505 D590 I591 L597 F598	L505-K594 HydrophobicContact CD2-CB 3.91Å; D590-K594 PolarHBondContact O-N 2.77Å; I591-K594 WeakPolarHBondContact O-CB 3.16Å; I591-K594 PolarHBondContact O-N 3.33Å; K594-L597 PolarHBondContact O-N 3.38Å; K594-F598 PolarHBondContact O-N 2.84Å
595	V	93.8	Very high	92.5	Very high	18 Å²	18	43.7 Å²	43.7	11%	0.109	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-43.1	179.5	-176.2	0	0	0	0	111.6	M464 V468 L505 I509 I591 V592 F598 C599	M464-V595 HydrophobicContact CE-CG1 4.03Å; M464-V595 HydrophobicContact CG-CB 4.28Å; M464-V595 HydrophobicContact CG-CG1 3.96Å; M464-V595 HydrophobicContact SD-CB 4.46Å; M464-V595 HydrophobicContact SD-CG1 3.53Å; M464-V595 VanDerWaalsContact SD-CG1 3.53Å; V468-V595 HydrophobicContact CG2-CG2 4.4Å; L505-V595 HydrophobicContact CD2-CG2 4.26Å; I509-V595 HydrophobicContact CD1-CG2 4.06Å; I509-V595 HydrophobicContact CG1-CG2 4.38Å; I591-V595 PolarHBondContact O-N 2.73Å; I591-V595 VanDerWaalsContact O-N 3.12Å; V592-V595 PolarHBondContact O-N 2.74Å; V595-F598 PolarHBondContact O-N 3.46Å; V595-C599 VanDerWaalsContact O-CB 3.27Å; V595-C599 WeakPolarHBondContact O-CB 3.27Å; V595-C599 PolarHBondContact O-N 3.06Å
596	N	90.6	Very high	92.3	Very high	43 Å²	43	44.5 Å²	44.5	23%	0.23	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-41.5	174.9	-80.8	-29.2	0	0	0	112.5	M464 V592 K593 C599 L600	M464-N596 VanDerWaalsContact CB-OD1 3.23Å; M464-N596 WeakPolarHBondContact CB-OD1 3.44Å; M464-N596 WeakPolarHBondContact CG-OD1 3.35Å; V592-N596 WeakPolarHBondContact O-CB 3.4Å; V592-N596 PolarHBondContact O-N 2.81Å; V592-N596 PolarHBondContact O-ND2 3Å; K593-N596 PolarHBondContact O-N 3.29Å; N596-C599 PolarHBondContact O-N 3.5Å; N596-L600 VanDerWaalsContact O-CB 3.27Å; N596-L600 WeakPolarHBondContact O-CB 3.39Å; N596-L600 PolarHBondContact O-N 3.04Å
597	L	90.3	Very high	92	Very high	87 Å²	87	51.2 Å²	51.2	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-39.1	177.7	-74.4	168.5	0	0	0	112.4	K593 K594 S601 L629	K593-L597 HydrophobicContact CG-CD1 4.08Å; K593-L597 WeakPolarHBondContact O-CB 3.45Å; K593-L597 VanDerWaalsContact O-CG 3.27Å; K593-L597 WeakPolarHBondContact O-CG 3.34Å; K593-L597 PolarHBondContact O-N 3.13Å; K594-L597 PolarHBondContact O-N 3.38Å; L597-S601 PolarHBondContact O-N 3.32Å; L597-L629 HydrophobicContact CD2-CD2 4.41Å
598	F	92.2	Very high	91.8	Very high	58 Å²	58	53.6 Å²	53.6	25%	0.254	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-50.8	173.2	178.7	-87.3	0	0	0	111.7	L423 P501 I502 L505 K594 V595 L600 S601 T602	L423-F598 HydrophobicContact CD2-CE1 3.91Å; L423-F598 HydrophobicContact CD2-CZ 4.14Å; P501-F598 WeakPolarHBondContact O-CE2 3.28Å; I502-F598 HydrophobicContact CG2-CD1 4.2Å; I502-F598 HydrophobicContact CG2-CE1 3.49Å; I502-F598 VanDerWaalsContact CG2-CE1 3.49Å; I502-F598 HydrophobicContact CG2-CE2 4.19Å; I502-F598 HydrophobicContact CG2-CZ 3.48Å; I502-F598 VanDerWaalsContact CG2-CZ 3.48Å; L505-F598 HydrophobicContact CD1-CB 3.65Å; L505-F598 HydrophobicContact CD1-CD1 3.77Å; L505-F598 HydrophobicContact CD1-CD2 4.16Å; L505-F598 HydrophobicContact CD1-CE1 4.49Å; L505-F598 HydrophobicContact CD1-CG 3.59Å; L505-F598 HydrophobicContact CD2-CB 4.41Å; K594-F598 PolarHBondContact O-N 2.84Å; V595-F598 PolarHBondContact O-N 3.46Å; F598-L600 PolarHBondContact O-N 2.7Å; F598-S601 PolarHBondContact O-N 3.35Å; F598-T602 WeakPolarHBondContact CE1-OG1 3.27Å; F598-T602 PolarHBondContact O-N 3.28Å; F598-T602 PolarHBondContact O-OG1 3.26Å
599	C	92.1	Very high	91.6	Very high	12 Å²	12	56.4 Å²	56.4	8%	0.081	31%	0.305	C	S	.	.	H	α-helix	trans	-52.6	-42	177.9	-175.3	0	0	0	0	111.4	M464 V595 N596 F603	M464-C599 HydrophobicContact CE-CB 4.22Å; V595-C599 VanDerWaalsContact O-CB 3.27Å; V595-C599 WeakPolarHBondContact O-CB 3.27Å; V595-C599 PolarHBondContact O-N 3.06Å; N596-C599 PolarHBondContact O-N 3.5Å; C599-F603 VanDerWaalsContact O-CB 3.32Å; C599-F603 WeakPolarHBondContact O-CB 3.41Å; C599-F603 PolarHBondContact O-N 3Å
600	L	89.5	Confident	91.6	Very high	23 Å²	23	62.3 Å²	62.3	12%	0.12	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-49.9	171.8	171.4	59.5	0	0	0	113.3	N596 F598 T602 F603 I604 L625 L629	N596-L600 VanDerWaalsContact O-CB 3.27Å; N596-L600 WeakPolarHBondContact O-CB 3.39Å; N596-L600 PolarHBondContact O-N 3.04Å; F598-L600 PolarHBondContact O-N 2.7Å; L600-T602 VanDerWaalsContact C-N 3.28Å; L600-T602 PolarHBondContact O-N 3.03Å; L600-F603 WeakPolarHBondContact O-CB 3.27Å; L600-F603 PolarHBondContact O-N 2.9Å; L600-F603 VanDerWaalsContact O-N 3.12Å; L600-I604 HydrophobicContact CD1-CD1 3.67Å; L600-I604 HydrophobicContact CD1-CG1 4.01Å; L600-I604 HydrophobicContact CG-CD1 4.01Å; L600-I604 WeakPolarHBondContact O-CG1 3.47Å; L600-I604 PolarHBondContact O-N 3.17Å; L600-L625 HydrophobicContact CD1-CB 4.4Å; L600-L625 HydrophobicContact CD1-CD1 3.33Å; L600-L625 HydrophobicContact CD1-CD2 3.5Å; L600-L625 HydrophobicContact CD1-CG 3.9Å; L600-L625 HydrophobicContact CD2-CD1 3.57Å; L600-L625 HydrophobicContact CG-CD1 4.07Å; L600-L629 HydrophobicContact CD2-CD1 4.17Å; L600-L629 HydrophobicContact CD2-CD2 4.05Å; L600-L629 HydrophobicContact CD2-CG 4.28Å
601	S	90.7	Very high	91.7	Very high	51 Å²	51	59.7 Å²	59.7	36%	0.357	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-40.3	-178.9	-165.7	0	0	0	0	111.5	L597 F598 Q605	L597-S601 PolarHBondContact O-N 3.32Å; F598-S601 PolarHBondContact O-N 3.35Å; S601-Q605 WeakPolarHBondContact O-CB 3.32Å; S601-Q605 WeakPolarHBondContact O-CG 3.47Å; S601-Q605 PolarHBondContact O-N 2.89Å
602	T	92.7	Very high	91.7	Very high	4 Å²	4	66.2 Å²	66.2	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-68.6	-35.7	174.1	-51.9	0	0	0	0	112.1	L423 F598 L600 Q605 A606 M609 V611 F613	L423-T602 HydrophobicContact CD1-CG2 4.28Å; F598-T602 WeakPolarHBondContact CE1-OG1 3.27Å; F598-T602 PolarHBondContact O-N 3.28Å; F598-T602 PolarHBondContact O-OG1 3.26Å; L600-T602 VanDerWaalsContact C-N 3.28Å; L600-T602 PolarHBondContact O-N 3.03Å; T602-Q605 CarbonylContact O-C 3.41Å; T602-Q605 PolarHBondContact O-N 3.25Å; T602-A606 WeakPolarHBondContact O-CA 3.25Å; T602-A606 PolarHBondContact O-N 3.34Å; T602-M609 HydrophobicContact CG2-CE 4.19Å; T602-M609 HydrophobicContact CG2-SD 3.9Å; T602-V611 HydrophobicContact CG2-CB 3.97Å; T602-V611 HydrophobicContact CG2-CG1 3.77Å; T602-V611 HydrophobicContact CG2-CG2 3.99Å; T602-F613 HydrophobicContact CG2-CE2 3.98Å; T602-F613 HydrophobicContact CG2-CZ 3.79Å
603	F	92.9	Very high	91.8	Very high	53 Å²	53	67.5 Å²	67.5	23%	0.232	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-42.5	174.9	-178.6	-103.7	0	0	0	112.4	C599 L600 Q605 A606 F613 I621	C599-F603 VanDerWaalsContact O-CB 3.32Å; C599-F603 WeakPolarHBondContact O-CB 3.41Å; C599-F603 PolarHBondContact O-N 3Å; L600-F603 WeakPolarHBondContact O-CB 3.27Å; L600-F603 PolarHBondContact O-N 2.9Å; L600-F603 VanDerWaalsContact O-N 3.12Å; F603-Q605 PolarHBondContact O-N 3.44Å; F603-A606 WeakPolarHBondContact O-CB 3.46Å; F603-A606 PolarHBondContact O-N 3.43Å; F603-F613 HydrophobicContact CB-CD1 4.48Å; F603-F613 HydrophobicContact CB-CE1 4.04Å; F603-F613 HydrophobicContact CB-CE2 4.21Å; F603-F613 HydrophobicContact CB-CZ 3.89Å; F603-F613 HydrophobicContact CD2-CB 4.06Å; F603-F613 AromaticContact CD2-CD1 3.8Å; F603-F613 HydrophobicContact CD2-CD1 3.8Å; F603-F613 HydrophobicContact CD2-CD2 4.01Å; F603-F613 HydrophobicContact CD2-CE1 4.21Å; F603-F613 HydrophobicContact CD2-CE2 4.41Å; F603-F613 AromaticContact CD2-CG 3.68Å; F603-F613 HydrophobicContact CD2-CG 3.68Å; F603-F613 HydrophobicContact CD2-CZ 4.5Å; F603-F613 HydrophobicContact CE2-CB 4.25Å; F603-F613 HydrophobicContact CE2-CG 4.36Å; F603-I621 HydrophobicContact CB-CG2 4.27Å; F603-I621 HydrophobicContact CD1-CG2 3.68Å; F603-I621 HydrophobicContact CD2-CD1 4.19Å; F603-I621 HydrophobicContact CD2-CG2 4.37Å; F603-I621 HydrophobicContact CE1-CG2 4.06Å; F603-I621 HydrophobicContact CG-CD1 4.42Å; F603-I621 HydrophobicContact CG-CG2 3.85Å
604	I	90.6	Very high	92	Very high	113 Å²	113	62.7 Å²	62.7	58%	0.579	33%	0.334	S	S	*	.	H	α-helix	trans	-65.6	-29.3	175.3	-68.3	169.3	0	0	0	111.7	L600	L600-I604 HydrophobicContact CD1-CD1 3.67Å; L600-I604 HydrophobicContact CD1-CG1 4.01Å; L600-I604 HydrophobicContact CG-CD1 4.01Å; L600-I604 WeakPolarHBondContact O-CG1 3.47Å; L600-I604 PolarHBondContact O-N 3.17Å
605	Q	91.8	Very high	92	Very high	79 Å²	79	65.3 Å²	65.3	37%	0.369	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	16.7	-175.8	-61.3	178.4	10.4	0	0	113.1	S601 T602 F603 D607 G608 M609	S601-Q605 WeakPolarHBondContact O-CB 3.32Å; S601-Q605 WeakPolarHBondContact O-CG 3.47Å; S601-Q605 PolarHBondContact O-N 2.89Å; T602-Q605 CarbonylContact O-C 3.41Å; T602-Q605 PolarHBondContact O-N 3.25Å; F603-Q605 PolarHBondContact O-N 3.44Å; Q605-D607 PolarHBondContact O-N 2.91Å; Q605-G608 PolarHBondContact O-N 3.05Å; Q605-G608 VanDerWaalsContact O-N 3.11Å; Q605-M609 HydrophobicContact CB-CG 4.02Å; Q605-M609 HydrophobicContact CB-SD 4.03Å; Q605-M609 WeakPolarHBondContact O-CG 3.1Å; Q605-M609 PolarHBondContact O-N 3.49Å
606	A	92.6	Very high	92	Very high	20 Å²	20	67.4 Å²	67.4	17%	0.165	36%	0.357	C	S	.	.	H	α-helix	trans	-49.1	-55	-169.7	0	0	0	0	0	113.4	T602 F603 G608 M609 K610 V611 F613	T602-A606 WeakPolarHBondContact O-CA 3.25Å; T602-A606 PolarHBondContact O-N 3.34Å; F603-A606 WeakPolarHBondContact O-CB 3.46Å; F603-A606 PolarHBondContact O-N 3.43Å; A606-G608 PolarHBondContact O-N 3.11Å; A606-M609 CarbonylContact O-C 3.59Å; A606-M609 PolarHBondContact O-N 3.25Å; A606-K610 WeakPolarHBondContact O-CA 3.42Å; A606-K610 PolarHBondContact O-N 2.91Å; A606-V611 WeakPolarHBondContact CB-O 3.43Å; A606-V611 PolarHBondContact O-N 3.44Å; A606-F613 HydrophobicContact CB-CD2 4.09Å; A606-F613 HydrophobicContact CB-CE2 4.2Å
607	D	89.9	Confident	92.1	Very high	156 Å²	156	65.4 Å²	65.4	83%	0.834	35%	0.347	S	S	*	.	H	α-helix	trans	-60.3	-44.9	-179.9	-60	-40.9	0	0	0	112.4	Q605 M609 K610	Q605-D607 PolarHBondContact O-N 2.91Å; D607-M609 PolarHBondContact O-N 3.49Å; D607-K610 PolarHBondContact O-N 3.3Å
608	G	90.1	Very high	92.3	Very high	75 Å²	75	62.7 Å²	62.7	77%	0.773	34%	0.335	S	S	*	.	H	α-helix	trans	-69	-32.2	-179.3	0	0	0	0	0	113.2	Q605 A606	Q605-G608 PolarHBondContact O-N 3.05Å; Q605-G608 VanDerWaalsContact O-N 3.11Å; A606-G608 PolarHBondContact O-N 3.11Å
609	M	90.3	Very high	92.4	Very high	62 Å²	62	66 Å²	66	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-86.3	-9.3	175.3	-64.1	-172.9	69.8	0	0	113.3	H420 L423 T602 Q605 A606 D607 V611	H420-M609 WeakPolarHBondContact CB-O 3.48Å; L423-M609 HydrophobicContact CD1-CE 4.03Å; T602-M609 HydrophobicContact CG2-CE 4.19Å; T602-M609 HydrophobicContact CG2-SD 3.9Å; Q605-M609 HydrophobicContact CB-CG 4.02Å; Q605-M609 HydrophobicContact CB-SD 4.03Å; Q605-M609 WeakPolarHBondContact O-CG 3.1Å; Q605-M609 PolarHBondContact O-N 3.49Å; A606-M609 CarbonylContact O-C 3.59Å; A606-M609 PolarHBondContact O-N 3.25Å; D607-M609 PolarHBondContact O-N 3.49Å; M609-V611 VanDerWaalsContact C-N 3.27Å; M609-V611 HydrophobicContact CB-CB 4.36Å; M609-V611 HydrophobicContact CB-CG2 3.72Å; M609-V611 PolarHBondContact O-N 3.17Å
610	K	91.7	Very high	92.4	Very high	151 Å²	151	66 Å²	66	66%	0.657	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	38.4	-169.1	-54.1	-176.6	-179.1	-177.3	0	112.9	A606 D607	A606-K610 WeakPolarHBondContact O-CA 3.42Å; A606-K610 PolarHBondContact O-N 2.91Å; D607-K610 PolarHBondContact O-N 3.3Å
611	V	93.9	Very high	92.5	Very high	6 Å²	6	65.5 Å²	65.5	4%	0.036	35%	0.348	C	S	.	.			trans	-104.8	122.2	-178.3	178.9	0	0	0	0	110.8	H420 L423 N424 N427 T602 A606 M609 F613	H420-V611 HydrophobicContact CB-CG2 4.11Å; L423-V611 HydrophobicContact CB-CG1 3.98Å; L423-V611 HydrophobicContact CB-CG2 3.9Å; L423-V611 HydrophobicContact CD1-CG2 3.71Å; L423-V611 HydrophobicContact CG-CG2 4.46Å; N424-V611 WeakPolarHBondContact OD1-CA 3.39Å; N427-V611 WeakPolarHBondContact ND2-CG1 3.35Å; T602-V611 HydrophobicContact CG2-CB 3.97Å; T602-V611 HydrophobicContact CG2-CG1 3.77Å; T602-V611 HydrophobicContact CG2-CG2 3.99Å; A606-V611 WeakPolarHBondContact CB-O 3.43Å; A606-V611 PolarHBondContact O-N 3.44Å; M609-V611 VanDerWaalsContact C-N 3.27Å; M609-V611 HydrophobicContact CB-CB 4.36Å; M609-V611 HydrophobicContact CB-CG2 3.72Å; M609-V611 PolarHBondContact O-N 3.17Å; V611-F613 HydrophobicContact CB-CE2 4.24Å; V611-F613 HydrophobicContact CG1-CD2 4.16Å; V611-F613 HydrophobicContact CG1-CE2 3.58Å; V611-F613 HydrophobicContact CG1-CZ 4.15Å
612	E	93.4	Very high	92.4	Very high	143 Å²	143	65.4 Å²	65.4	67%	0.668	35%	0.351	S	S	*	.			trans	-88.8	135.4	179.2	-65.7	178	172.4	0	0	110.9	N424 N427	N424-E612 PolarHBondContact OD1-N 3.37Å; N427-E612 PolarHBondContact ND2-O 3.29Å
613	F	95	Very high	92	Very high	30 Å²	30	67.4 Å²	67.4	13%	0.132	37%	0.365	C	S	.	.			trans	-116.5	117.7	175	-76	-97.3	0	0	0	109.9	N427 T602 F603 A606 V611 M617 S618 I621	N427-F613 WeakPolarHBondContact ND2-CD1 3.46Å; N427-F613 VanDerWaalsContact ND2-CE1 3.34Å; N427-F613 WeakPolarHBondContact ND2-CE1 3.46Å; N427-F613 WeakPolarHBondContact ND2-CZ 3.46Å; T602-F613 HydrophobicContact CG2-CE2 3.98Å; T602-F613 HydrophobicContact CG2-CZ 3.79Å; F603-F613 HydrophobicContact CB-CD1 4.48Å; F603-F613 HydrophobicContact CB-CE1 4.04Å; F603-F613 HydrophobicContact CB-CE2 4.21Å; F603-F613 HydrophobicContact CB-CZ 3.89Å; F603-F613 HydrophobicContact CD2-CB 4.06Å; F603-F613 AromaticContact CD2-CD1 3.8Å; F603-F613 HydrophobicContact CD2-CD1 3.8Å; F603-F613 HydrophobicContact CD2-CD2 4.01Å; F603-F613 HydrophobicContact CD2-CE1 4.21Å; F603-F613 HydrophobicContact CD2-CE2 4.41Å; F603-F613 AromaticContact CD2-CG 3.68Å; F603-F613 HydrophobicContact CD2-CG 3.68Å; F603-F613 HydrophobicContact CD2-CZ 4.5Å; F603-F613 HydrophobicContact CE2-CB 4.25Å; F603-F613 HydrophobicContact CE2-CG 4.36Å; A606-F613 HydrophobicContact CB-CD2 4.09Å; A606-F613 HydrophobicContact CB-CE2 4.2Å; V611-F613 HydrophobicContact CB-CE2 4.24Å; V611-F613 HydrophobicContact CG1-CD2 4.16Å; V611-F613 HydrophobicContact CG1-CE2 3.58Å; V611-F613 HydrophobicContact CG1-CZ 4.15Å; F613-M617 HydrophobicContact CD1-CE 4.02Å; F613-M617 HydrophobicContact CD1-CG 4.46Å; F613-M617 HydrophobicContact CD1-SD 4.34Å; F613-M617 HydrophobicContact CE1-CE 3.98Å; F613-S618 WeakPolarHBondContact CB-OG 3.47Å; F613-S618 PolarHBondContact O-OG 2.99Å; F613-I621 HydrophobicContact CD1-CD1 3.87Å; F613-I621 HydrophobicContact CE1-CD1 3.97Å
614	P	95.3	Very high	91.2	Very high	29 Å²	29	65.5 Å²	65.5	19%	0.188	36%	0.357	C	S	.	.			trans	-61.7	159.7	177.4	-24.6	34.6	0	0	0	113.5	E431 M616 M617 S618	E431-P614 HydrophobicContact CB-CB 3.92Å; E431-P614 HydrophobicContact CB-CG 4.09Å; E431-P614 HydrophobicContact CG-CB 4.09Å; E431-P614 WeakPolarHBondContact OE1-CB 3.33Å; E431-P614 VanDerWaalsContact OE2-CB 3.31Å; E431-P614 WeakPolarHBondContact OE2-CB 3.45Å; P614-M616 PolarHBondContact O-N 3.11Å; P614-M617 PolarHBondContact O-N 3.3Å; P614-S618 WeakPolarHBondContact O-CB 3.38Å; P614-S618 PolarHBondContact O-N 3.18Å; P614-S618 PolarHBondContact O-OG 2.93Å
615	E	93.4	Very high	90.3	Very high	158 Å²	158	62 Å²	62	74%	0.738	34%	0.339	S	S	*	.	H	α-helix	trans	-59.1	-53.5	-168.7	-175.8	174.3	-142.7	0	0	112.5	M617 S618 E619	E615-M617 VanDerWaalsContact C-N 3.27Å; E615-M617 PolarHBondContact O-N 3.3Å; E615-S618 WeakPolarHBondContact O-CB 3.37Å; E615-S618 PolarHBondContact O-N 2.97Å; E615-S618 VanDerWaalsContact O-N 3.11Å; E615-E619 PolarHBondContact O-N 3.12Å
616	M	93.2	Very high	89.3	Confident	62 Å²	62	61.9 Å²	61.9	31%	0.305	35%	0.345	S	S	.	.	H	α-helix	trans	-66	-32.4	-178	-175.4	175.9	-67.5	0	0	112.2	E431 L434 L435 P614 V620	E431-M616 HydrophobicContact CG-CB 4.41Å; E431-M616 PolarHBondContact OE1-N 3.36Å; L434-M616 HydrophobicContact CD2-CG 3.85Å; L434-M616 HydrophobicContact CD2-SD 4.29Å; L434-M616 HydrophobicContact CG-CG 4.37Å; L434-M616 HydrophobicContact CG-SD 4.17Å; L435-M616 HydrophobicContact CD2-CE 3.52Å; L435-M616 HydrophobicContact CD2-SD 3.72Å; L435-M616 HydrophobicContact CG-SD 4.23Å; P614-M616 PolarHBondContact O-N 3.11Å; M616-V620 WeakPolarHBondContact O-CB 3.41Å; M616-V620 VanDerWaalsContact O-CG2 3.28Å; M616-V620 WeakPolarHBondContact O-CG2 3.47Å; M616-V620 PolarHBondContact O-N 2.96Å
617	M	93.4	Very high	88.6	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-69.2	-41	175	-174.8	169.3	174.6	0	0	110.8	N427 C430 W463 F613 P614 E615 V620 I621	N427-M617 HydrophobicContact CB-CE 4.35Å; N427-M617 HydrophobicContact CB-SD 4.01Å; N427-M617 WeakPolarHBondContact OD1-CE 3.48Å; C430-M617 HydrophobicContact CB-CE 4.06Å; C430-M617 HydrophobicContact CB-SD 3.73Å; W463-M617 HydrophobicContact CH2-CE 4.05Å; W463-M617 HydrophobicContact CH2-CG 4.19Å; W463-M617 HydrophobicContact CZ3-CE 4.33Å; W463-M617 HydrophobicContact CZ3-CG 4.24Å; F613-M617 HydrophobicContact CD1-CE 4.02Å; F613-M617 HydrophobicContact CD1-CG 4.46Å; F613-M617 HydrophobicContact CD1-SD 4.34Å; F613-M617 HydrophobicContact CE1-CE 3.98Å; P614-M617 PolarHBondContact O-N 3.3Å; E615-M617 VanDerWaalsContact C-N 3.27Å; E615-M617 PolarHBondContact O-N 3.3Å; M617-V620 PolarHBondContact O-N 2.98Å; M617-I621 HydrophobicContact CE-CD1 4.18Å; M617-I621 HydrophobicContact CG-CD1 3.87Å; M617-I621 VanDerWaalsContact O-CG1 3.25Å; M617-I621 WeakPolarHBondContact O-CG1 3.35Å; M617-I621 PolarHBondContact O-N 2.71Å
618	S	94.1	Very high	87.6	Confident	29 Å²	29	60.5 Å²	60.5	20%	0.203	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-45.5	177.2	-60.4	0	0	0	0	112.4	F613 P614 E615 V620 I621 A622	F613-S618 WeakPolarHBondContact CB-OG 3.47Å; F613-S618 PolarHBondContact O-OG 2.99Å; P614-S618 WeakPolarHBondContact O-CB 3.38Å; P614-S618 PolarHBondContact O-N 3.18Å; P614-S618 PolarHBondContact O-OG 2.93Å; E615-S618 WeakPolarHBondContact O-CB 3.37Å; E615-S618 PolarHBondContact O-N 2.97Å; E615-S618 VanDerWaalsContact O-N 3.11Å; S618-V620 VanDerWaalsContact C-N 3.35Å; S618-V620 PolarHBondContact O-N 3.04Å; S618-I621 PolarHBondContact O-N 2.86Å; S618-A622 VanDerWaalsContact O-CB 3.27Å; S618-A622 WeakPolarHBondContact O-CB 3.35Å; S618-A622 PolarHBondContact O-N 3.21Å
619	E	93.2	Very high	86.3	Confident	127 Å²	127	62 Å²	62	59%	0.593	32%	0.323	S	S	*	.	H	α-helix	trans	-58.3	-46.2	173.6	-71.2	-166.1	148.6	0	0	111.9	E615 A622 S623	E615-E619 PolarHBondContact O-N 3.12Å; E619-A622 PolarHBondContact O-N 3.38Å; E619-S623 VanDerWaalsContact O-CB 3.25Å; E619-S623 WeakPolarHBondContact O-CB 3.48Å; E619-S623 PolarHBondContact O-N 2.89Å; E619-S623 PolarHBondContact O-OG 3.29Å
620	V	92.4	Very high	85.5	Confident	13 Å²	13	62.3 Å²	62.3	8%	0.079	34%	0.335	C	S	.	.	H	α-helix	trans	-69.3	-33.2	-176.9	166.2	0	0	0	0	111.8	L434 Q460 W463 M616 M617 S618 Q624	L434-V620 HydrophobicContact CD2-CB 4.27Å; L434-V620 HydrophobicContact CD2-CG1 4.41Å; L434-V620 HydrophobicContact CD2-CG2 4.09Å; Q460-V620 HydrophobicContact CG-CG2 4.48Å; W463-V620 HydrophobicContact CD2-CG1 4.06Å; W463-V620 HydrophobicContact CG-CG1 4.23Å; M616-V620 WeakPolarHBondContact O-CB 3.41Å; M616-V620 VanDerWaalsContact O-CG2 3.28Å; M616-V620 WeakPolarHBondContact O-CG2 3.47Å; M616-V620 PolarHBondContact O-N 2.96Å; M617-V620 PolarHBondContact O-N 2.98Å; S618-V620 VanDerWaalsContact C-N 3.35Å; S618-V620 PolarHBondContact O-N 3.04Å; V620-Q624 WeakPolarHBondContact O-CB 3.36Å; V620-Q624 VanDerWaalsContact O-CG 3.3Å; V620-Q624 WeakPolarHBondContact O-CG 3.43Å; V620-Q624 PolarHBondContact O-NE2 3.02Å
621	I	90.8	Very high	84.8	Confident	12 Å²	12	57.2 Å²	57.2	6%	0.062	33%	0.326	C	S	.	.	H	α-helix	trans	-70.1	-56.7	170.8	-67.9	164.1	0	0	0	110.1	W463 F603 F613 M617 S618 S623 Q624 L625	W463-I621 HydrophobicContact CH2-CD1 4.47Å; W463-I621 HydrophobicContact CH2-CG1 4.2Å; W463-I621 HydrophobicContact CZ2-CG1 4.11Å; F603-I621 HydrophobicContact CB-CG2 4.27Å; F603-I621 HydrophobicContact CD1-CG2 3.68Å; F603-I621 HydrophobicContact CD2-CD1 4.19Å; F603-I621 HydrophobicContact CD2-CG2 4.37Å; F603-I621 HydrophobicContact CE1-CG2 4.06Å; F603-I621 HydrophobicContact CG-CD1 4.42Å; F603-I621 HydrophobicContact CG-CG2 3.85Å; F613-I621 HydrophobicContact CD1-CD1 3.87Å; F613-I621 HydrophobicContact CE1-CD1 3.97Å; M617-I621 HydrophobicContact CE-CD1 4.18Å; M617-I621 HydrophobicContact CG-CD1 3.87Å; M617-I621 VanDerWaalsContact O-CG1 3.25Å; M617-I621 WeakPolarHBondContact O-CG1 3.35Å; M617-I621 PolarHBondContact O-N 2.71Å; S618-I621 PolarHBondContact O-N 2.86Å; I621-S623 VanDerWaalsContact C-N 3.34Å; I621-S623 PolarHBondContact O-N 2.99Å; I621-Q624 PolarHBondContact O-N 3.09Å; I621-L625 WeakPolarHBondContact O-CB 3.33Å; I621-L625 PolarHBondContact O-N 3.4Å
622	A	89.2	Confident	84.2	Confident	50 Å²	50	61.3 Å²	61.3	41%	0.413	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-37.9	-172.5	0	0	0	0	0	113.5	S618 E619 P626	S618-A622 VanDerWaalsContact O-CB 3.27Å; S618-A622 WeakPolarHBondContact O-CB 3.35Å; S618-A622 PolarHBondContact O-N 3.21Å; E619-A622 PolarHBondContact O-N 3.38Å; A622-P626 VanDerWaalsContact O-CD 3.29Å; A622-P626 WeakPolarHBondContact O-CD 3.42Å
623	S	85.2	Confident	83.8	Confident	45 Å²	45	55.9 Å²	55.9	32%	0.315	32%	0.323	S	S	.	.	H	α-helix	trans	-74	-24.7	179.9	59.5	0	0	0	0	114.5	Q460 E619 I621 K627	Q460-S623 PolarHBondContact NE2-OG 3.4Å; E619-S623 VanDerWaalsContact O-CB 3.25Å; E619-S623 WeakPolarHBondContact O-CB 3.48Å; E619-S623 PolarHBondContact O-N 2.89Å; E619-S623 PolarHBondContact O-OG 3.29Å; I621-S623 VanDerWaalsContact C-N 3.34Å; I621-S623 PolarHBondContact O-N 2.99Å; S623-K627 WeakPolarHBondContact O-CE 3.41Å
624	Q	76.6	Confident	83.4	Confident	13 Å²	13	59.7 Å²	59.7	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-93.2	-37.6	177.4	-72.5	-177.3	73.9	0	0	113.3	Q460 Y461 V620 I621 K627 V628	Q460-Q624 VanDerWaalsContact C-CD 3.41Å; Q460-Q624 VanDerWaalsContact C-OE1 3.25Å; Q460-Q624 HydrophobicContact CB-CG 3.93Å; Q460-Q624 HydrophobicContact CG-CG 4.49Å; Q460-Q624 PolarHBondContact O-NE2 3.03Å; Q460-Q624 PolarHBondContact O-OE1 3.34Å; Y461-Q624 HydrophobicContact CD1-CG 4.1Å; Y461-Q624 HydrophobicContact CE1-CG 4.14Å; V620-Q624 WeakPolarHBondContact O-CB 3.36Å; V620-Q624 VanDerWaalsContact O-CG 3.3Å; V620-Q624 WeakPolarHBondContact O-CG 3.43Å; V620-Q624 PolarHBondContact O-NE2 3.02Å; I621-Q624 PolarHBondContact O-N 3.09Å; Q624-K627 WeakPolarHBondContact O-CA 3.43Å; Q624-K627 WeakPolarHBondContact O-CB 3.41Å; Q624-K627 PolarHBondContact O-N 3.06Å; Q624-V628 HydrophobicContact CB-CG2 4.23Å; Q624-V628 PolarHBondContact O-N 3.44Å
625	L	69.9	Low	83.2	Confident	39 Å²	39	61.3 Å²	61.3	20%	0.204	35%	0.35	C	S	.	.	H	α-helix	trans	-42	-57.5	-171.5	153.1	54.6	0	0	0	112.9	L600 I621 K627 V628 L629	L600-L625 HydrophobicContact CD1-CB 4.4Å; L600-L625 HydrophobicContact CD1-CD1 3.33Å; L600-L625 HydrophobicContact CD1-CD2 3.5Å; L600-L625 HydrophobicContact CD1-CG 3.9Å; L600-L625 HydrophobicContact CD2-CD1 3.57Å; L600-L625 HydrophobicContact CG-CD1 4.07Å; I621-L625 WeakPolarHBondContact O-CB 3.33Å; I621-L625 PolarHBondContact O-N 3.4Å; L625-K627 VanDerWaalsContact C-N 3.25Å; L625-K627 PolarHBondContact O-N 3.08Å; L625-V628 PolarHBondContact O-N 2.84Å; L625-L629 HydrophobicContact CD1-CD1 3.43Å; L625-L629 VanDerWaalsContact CD1-CD1 3.43Å; L625-L629 HydrophobicContact CD1-CG 3.82Å; L625-L629 PolarHBondContact O-N 3.17Å
626	P	72.2	Confident	83.1	Confident	78 Å²	78	55.6 Å²	55.6	51%	0.506	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-33.8	-179	-22.7	34.5	0	0	0	113	A622 A630	A622-P626 VanDerWaalsContact O-CD 3.29Å; A622-P626 WeakPolarHBondContact O-CD 3.42Å; P626-A630 WeakPolarHBondContact O-CB 3.43Å; P626-A630 PolarHBondContact O-N 2.89Å
627	K	77.1	Confident	83	Confident	79 Å²	79	55.5 Å²	55.5	34%	0.343	32%	0.324	S	S	.	.	H	α-helix	trans	-75.9	-40.3	-176.1	-49	-177.1	-174.3	176.9	0	112	Y461 S623 Q624 L625 G631 M632 V633	Y461-K627 VanDerWaalsContact OH-CD 3.32Å; Y461-K627 WeakPolarHBondContact OH-CD 3.46Å; S623-K627 WeakPolarHBondContact O-CE 3.41Å; Q624-K627 WeakPolarHBondContact O-CA 3.43Å; Q624-K627 WeakPolarHBondContact O-CB 3.41Å; Q624-K627 PolarHBondContact O-N 3.06Å; L625-K627 VanDerWaalsContact C-N 3.25Å; L625-K627 PolarHBondContact O-N 3.08Å; K627-G631 PolarHBondContact O-N 2.76Å; K627-M632 HydrophobicContact CB-CB 4.48Å; K627-M632 HydrophobicContact CB-CE 4.05Å; K627-M632 HydrophobicContact CG-CE 3.99Å; K627-M632 PolarHBondContact O-N 3.4Å; K627-V633 HydrophobicContact CB-CG2 4.47Å
628	V	68.2	Low	82.9	Confident	68 Å²	68	57.8 Å²	57.8	41%	0.412	33%	0.334	S	S	.	.	H	α-helix	trans	-69.4	-43	176.9	176.2	0	0	0	0	110.6	Q624 L625 G631 V633	Q624-V628 HydrophobicContact CB-CG2 4.23Å; Q624-V628 PolarHBondContact O-N 3.44Å; L625-V628 PolarHBondContact O-N 2.84Å; V628-G631 PolarHBondContact O-N 3.49Å; V628-V633 HydrophobicContact CG2-CG2 4.12Å
629	L	64	Low	82.8	Confident	106 Å²	106	59 Å²	59	56%	0.555	34%	0.337	S	S	*	.	H	α-helix	trans	-67.6	-40.4	175.9	-69.9	-172.5	0	0	0	112.9	L597 L600 L625 G631	L597-L629 HydrophobicContact CD2-CD2 4.41Å; L600-L629 HydrophobicContact CD2-CD1 4.17Å; L600-L629 HydrophobicContact CD2-CD2 4.05Å; L600-L629 HydrophobicContact CD2-CG 4.28Å; L625-L629 HydrophobicContact CD1-CD1 3.43Å; L625-L629 VanDerWaalsContact CD1-CD1 3.43Å; L625-L629 HydrophobicContact CD1-CG 3.82Å; L625-L629 PolarHBondContact O-N 3.17Å; L629-G631 PolarHBondContact O-N 3.32Å; L629-G631 VanDerWaalsContact O-N 3.13Å
630	A	73.8	Confident	82	Confident	68 Å²	68	58.9 Å²	58.9	56%	0.562	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	6.5	176.6	0	0	0	0	0	114.1	P626 M632	P626-A630 WeakPolarHBondContact O-CB 3.43Å; P626-A630 PolarHBondContact O-N 2.89Å; A630-M632 HydrophobicContact CB-CE 4.2Å; A630-M632 HydrophobicContact CB-CG 4.03Å; A630-M632 PolarHBondContact O-N 3.42Å
631	G	76.3	Confident	80.4	Confident	45 Å²	45	65 Å²	65	46%	0.464	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	14.8	178.6	0	0	0	0	0	114.7	L540 K627 V628 L629 V633	L540-G631 WeakPolarHBondContact CD1-O 3.37Å; K627-G631 PolarHBondContact O-N 2.76Å; V628-G631 PolarHBondContact O-N 3.49Å; L629-G631 PolarHBondContact O-N 3.32Å; L629-G631 VanDerWaalsContact O-N 3.13Å; G631-V633 PolarHBondContact O-N 3.46Å
632	M	81.8	Confident	77.8	Confident	92 Å²	92	76.8 Å²	76.8	45%	0.453	43%	0.425	S	S	.	.			trans	-75.9	16.7	-175.8	-60.5	-165	-68.9	0	0	114	P539 L540 K627 A630	P539-M632 WeakPolarHBondContact CA-O 3.31Å; L540-M632 PolarHBondContact N-O 3.35Å; K627-M632 HydrophobicContact CB-CB 4.48Å; K627-M632 HydrophobicContact CB-CE 4.05Å; K627-M632 HydrophobicContact CG-CE 3.99Å; K627-M632 PolarHBondContact O-N 3.4Å; A630-M632 HydrophobicContact CB-CE 4.2Å; A630-M632 HydrophobicContact CB-CG 4.03Å; A630-M632 PolarHBondContact O-N 3.42Å
633	V	84.9	Confident	77.2	Confident	29 Å²	29	78.2 Å²	78.2	18%	0.176	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.6	-172.5	-175.2	0	0	0	0	109.6	Y461 T537 K627 V628 G631	Y461-V633 HydrophobicContact CD1-CG1 4.33Å; Y461-V633 HydrophobicContact CD1-CG2 4.13Å; Y461-V633 HydrophobicContact CD2-CG1 4.14Å; Y461-V633 HydrophobicContact CE1-CG2 3.63Å; Y461-V633 HydrophobicContact CE2-CG1 4.36Å; Y461-V633 HydrophobicContact CE2-CG2 4.12Å; Y461-V633 HydrophobicContact CG-CG1 4.14Å; T537-V633 HydrophobicContact CG2-CG1 3.35Å; K627-V633 HydrophobicContact CB-CG2 4.47Å; V628-V633 HydrophobicContact CG2-CG2 4.12Å; G631-V633 PolarHBondContact O-N 3.46Å
634	K	86.9	Confident	76.8	Confident	110 Å²	110	79.9 Å²	79.9	48%	0.478	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.7	-175	-173.6	178	-179.8	179.9	0	110.6	V538 L540 L636	V538-K634 HydrophobicContact CG2-CB 4.2Å; V538-K634 PolarHBondContact N-O 3.01Å; V538-K634 VanDerWaalsContact N-O 3.07Å; V538-K634 PolarHBondContact O-N 2.75Å; L540-K634 HydrophobicContact CD2-CB 4.16Å; K634-L636 HydrophobicContact CD-CD2 4.38Å; K634-L636 HydrophobicContact CG-CD2 4.4Å
635	P	89.8	Confident	76.8	Confident	63 Å²	63	83.6 Å²	83.6	41%	0.409	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.6	165.6	30.2	-32.6	0	0	0	110	T536 L637	T536-P635 CarbonylContact O-C 3.54Å; T536-P635 WeakPolarHBondContact O-CA 3.26Å; P635-L637 HydrophobicContact CB-CD2 4.08Å; P635-L637 HydrophobicContact CB-CG 4.4Å; P635-L637 PolarHBondContact O-N 3.19Å
636	L	91.4	Very high	77.2	Confident	37 Å²	37	86.2 Å²	86.2	19%	0.194	47%	0.467	C	S	.	.			trans	-98.6	67.2	177.5	-59.6	-177	0	0	0	109.3	T536 V538 F549 R553 K634	T536-L636 PolarHBondContact O-N 3.32Å; V538-L636 HydrophobicContact CG1-CD1 3.82Å; V538-L636 HydrophobicContact CG1-CG 4.47Å; V538-L636 HydrophobicContact CG2-CD1 4.03Å; V538-L636 HydrophobicContact CG2-CD2 3.87Å; V538-L636 HydrophobicContact CG2-CG 3.96Å; F549-L636 HydrophobicContact CE1-CD1 3.75Å; F549-L636 HydrophobicContact CZ-CD1 3.71Å; R553-L636 PolarHBondContact NH2-O 3.19Å; K634-L636 HydrophobicContact CD-CD2 4.38Å; K634-L636 HydrophobicContact CG-CD2 4.4Å
637	L	91.4	Very high	77.5	Confident	61 Å²	61	86.8 Å²	86.8	32%	0.319	46%	0.464	S	S	.	.			trans	-57.2	149.2	178.6	-54.8	-178.8	0	0	0	111.5	D586 H589 P635 H639	D586-L637 HydrophobicContact CB-CD2 4.31Å; D586-L637 WeakPolarHBondContact OD1-CA 3.45Å; H589-L637 VanDerWaalsContact CD2-CD2 3.42Å; H589-L637 WeakPolarHBondContact CD2-CD2 3.46Å; P635-L637 HydrophobicContact CB-CD2 4.08Å; P635-L637 HydrophobicContact CB-CG 4.4Å; P635-L637 PolarHBondContact O-N 3.19Å; L637-H639 WeakPolarHBondContact CB-O 3.06Å
638	F	92.5	Very high	77.5	Confident	49 Å²	49	87.3 Å²	87.3	22%	0.215	47%	0.472	C	S	.	.	S	Bend	trans	-80.5	-31.2	169.5	-74.3	-92.5	0	0	0	111.9	I532 I557 F578 T582 M585 D586	I532-F638 HydrophobicContact CG2-CE2 3.9Å; I532-F638 HydrophobicContact CG2-CZ 3.71Å; I557-F638 HydrophobicContact CD1-CE1 3.81Å; I557-F638 HydrophobicContact CD1-CZ 3.91Å; I557-F638 HydrophobicContact CG1-CE1 4.12Å; I557-F638 HydrophobicContact CG1-CZ 4.1Å; F578-F638 HydrophobicContact CE1-CD1 4.3Å; F578-F638 HydrophobicContact CZ-CD1 4.36Å; F578-F638 HydrophobicContact CZ-CE1 4.13Å; T582-F638 HydrophobicContact CG2-CD1 3.75Å; T582-F638 HydrophobicContact CG2-CD2 4Å; T582-F638 HydrophobicContact CG2-CE1 3.88Å; T582-F638 HydrophobicContact CG2-CE2 4.13Å; T582-F638 HydrophobicContact CG2-CG 3.81Å; T582-F638 HydrophobicContact CG2-CZ 4.07Å; M585-F638 HydrophobicContact CE-CE2 4.14Å; D586-F638 PolarHBondContact OD1-N 3.14Å; D586-F638 PolarHBondContact OD2-N 3.11Å
639	H	90.7	Very high	78.2	Confident	55 Å²	55	88.6 Å²	88.6	26%	0.255	48%	0.477	S	S	.	.	S	Bend	trans	-124.2	140.8	-178.8	-46.4	95.6	0	0	0	111.9	Y579 T582 D586 L637	Y579-H639 AromaticContact CD2-CD2 3.67Å; Y579-H639 AromaticContact CD2-CE1 3.86Å; Y579-H639 AromaticContact CD2-NE2 3.15Å; Y579-H639 WeakPolarHBondContact CD2-NE2 3.33Å; Y579-H639 AromaticContact CE2-CD2 3.63Å; Y579-H639 AromaticContact CE2-NE2 3.56Å; T582-H639 PolarHBondContact OG1-CE1 3.32Å; T582-H639 VanDerWaalsContact OG1-CE1 3.28Å; D586-H639 WeakPolarHBondContact OD2-CB 3.46Å; D586-H639 IonicContact OD2-CE1 3.15Å; D586-H639 IonicContact OD2-CG 3.23Å; D586-H639 PolarHBondContact OD2-N 2.96Å; D586-H639 IonicContact OD2-ND1 3.89Å; D586-H639 PolarHBondContact OD2-ND1 3.21Å; L637-H639 WeakPolarHBondContact CB-O 3.06Å
640	T	77	Confident	79.3	Confident	125 Å²	125	87.3 Å²	87.3	77%	0.767	47%	0.471	S	S	*	.			trans	-67.2	132.1	164.6	48.5	0	0	0	0	109.6	Q642	T640-Q642 PolarHBondContact O-N 3.12Å
641	K	58.3	Low	79.7	Confident	141 Å²	141	88.9 Å²	88.9	61%	0.613	46%	0.463	S	S	*	.			trans	-59	129.9	165.9	-66.5	-171.5	173.1	-171.9	0	108.7	D590	D590-K641 IonicContact OD1-NZ 2.73Å; D590-K641 PolarHBondContact OD1-NZ 3.3Å; D590-K641 IonicContact OD2-NZ 2.72Å; D590-K641 PolarHBondContact OD2-NZ 3.03Å
642	Q	35.8	Very low	80	Confident	260 Å²	260	92.9 Å²	92.9	100%	1.215	46%	0.463	S	S	*	.			trans	-91.3	0	174.8	-69.9	-176	-26.6	0	0	110.3	T640	T640-Q642 PolarHBondContact O-N 3.12Å

Retrieved 642 of 642 residues in 3144.4 ms (Link to these results)

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