A0A096NDG3_PAPAN Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A096NDG3, Species PAPAN (Papio anubis, Olive baboon), Gene TXK, Length 527 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	34.5	Very low	24.9	Very low	241 Å²	241	150.3 Å²	150.3	100%	1.187	80%	0.799	S	S	*	*				0	92.9	0	-176.1	-171.3	-64.8	0	0	107.5
2	I	23.6	Very low	24.9	Very low	173 Å²	173	149.3 Å²	149.3	89%	0.887	80%	0.803	S	S	*	*			trans	-139.2	126.2	176	-60	179.7	0	0	0	105.8
3	L	22.4	Very low	25.2	Very low	174 Å²	174	151 Å²	151	91%	0.911	80%	0.799	S	S	*	*			trans	-87.7	126.8	178.1	-79.8	154.7	0	0	0	109.3
4	S	22.8	Very low	25.3	Very low	93 Å²	93	146.7 Å²	146.7	65%	0.65	79%	0.786	S	S	*	*			trans	-103.7	109.6	168.2	-173.2	0	0	0	0	109.1	Y6	S4-Y6 PolarHBondContact O-N 3.14Å
5	S	25.3	Very low	25.3	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	79%	0.785	S	S	*	*			trans	-84.1	101.2	176.3	54.4	0	0	0	0	110.6	N7	S5-N7 PolarHBondContact O-N 3.09Å; S5-N7 VanDerWaalsContact O-N 3.12Å
6	Y	24.9	Very low	25.6	Very low	201 Å²	201	142.5 Å²	142.5	79%	0.788	78%	0.783	S	S	*	*			trans	-72.1	99.3	173.8	-79.5	-94.3	0	0	0	111.4	S4	S4-Y6 PolarHBondContact O-N 3.14Å
7	N	25.1	Very low	25.6	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	78%	0.782	S	S	*	*			trans	-90.1	100.6	164.4	-84.8	-14.2	0	0	0	109.8	S5 I9	S5-N7 PolarHBondContact O-N 3.09Å; S5-N7 VanDerWaalsContact O-N 3.12Å; N7-I9 PolarHBondContact O-N 3.47Å; N7-I9 VanDerWaalsContact O-N 3.11Å
8	T	22.9	Very low	25.6	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.724	79%	0.79	S	S	*	*			trans	-78.3	92.3	-179.5	-51.6	0	0	0	0	111.3	Q10	T8-Q10 PolarHBondContact O-N 2.8Å
9	I	25	Very low	25.7	Very low	151 Å²	151	139.4 Å²	139.4	77%	0.774	79%	0.79	S	S	*	*			trans	-76	107.7	170.1	-59.5	176.9	0	0	0	108.7	N7 S11	N7-I9 PolarHBondContact O-N 3.47Å; N7-I9 VanDerWaalsContact O-N 3.11Å; I9-S11 PolarHBondContact O-N 3.27Å
10	Q	22.9	Very low	25.6	Very low	174 Å²	174	138.3 Å²	138.3	81%	0.813	79%	0.791	S	S	*	*			trans	-80.4	99.7	169.3	-76.2	-171.7	-39.2	0	0	110.5	T8 V12	T8-Q10 PolarHBondContact O-N 2.8Å; Q10-V12 PolarHBondContact O-N 3.31Å
11	S	24.5	Very low	25.6	Very low	78 Å²	78	137.7 Å²	137.7	55%	0.545	79%	0.79	S	S	.	*			trans	-84.3	104.1	170.5	38.7	0	0	0	0	111.1	I9 F13	I9-S11 PolarHBondContact O-N 3.27Å; S11-F13 WeakPolarHBondContact O-CD2 3.41Å; S11-F13 PolarHBondContact O-N 2.82Å; S11-F13 WeakPolarHBondContact OG-CE2 3.33Å
12	V	25.3	Very low	25.1	Very low	139 Å²	139	134.2 Å²	134.2	84%	0.842	77%	0.771	S	S	*	*			trans	-85.8	98.3	173.7	-177.7	0	0	0	0	108.8	Q10	Q10-V12 PolarHBondContact O-N 3.31Å
13	F	28	Very low	25.2	Very low	171 Å²	171	135.4 Å²	135.4	75%	0.75	77%	0.77	S	S	*	*			trans	-77.6	147.6	-173.9	-78.2	-83.9	0	0	0	114.2	S11 C15	S11-F13 WeakPolarHBondContact O-CD2 3.41Å; S11-F13 PolarHBondContact O-N 2.82Å; S11-F13 WeakPolarHBondContact OG-CE2 3.33Å; F13-C15 PolarHBondContact O-N 2.83Å
14	C	27.3	Very low	25.3	Very low	91 Å²	91	137.6 Å²	137.6	62%	0.615	77%	0.766	S	S	*	*			trans	-64.5	121.1	174.8	-174.1	0	0	0	0	111.5	C16	C14-C16 PolarHBondContact O-N 2.81Å
15	C	25.5	Very low	25.5	Very low	116 Å²	116	142.6 Å²	142.6	78%	0.784	78%	0.779	S	S	*	*			trans	-93.4	68.7	-171.3	-164.1	0	0	0	0	113.3	F13 C17	F13-C15 PolarHBondContact O-N 2.83Å; C15-C17 PolarHBondContact O-N 3.02Å
16	C	30	Very low	25.6	Very low	110 Å²	110	143.1 Å²	143.1	74%	0.743	78%	0.778	S	S	*	*			trans	-96.4	51.1	170.3	-83.3	0	0	0	0	112.4	C14	C14-C16 PolarHBondContact O-N 2.81Å
17	C	25.3	Very low	25.6	Very low	113 Å²	113	144.7 Å²	144.7	76%	0.764	78%	0.782	S	S	*	*			trans	-133.3	92.4	-178.8	-86.6	0	0	0	0	113	C15	C15-C17 PolarHBondContact O-N 3.02Å
18	C	25.2	Very low	25.7	Very low	137 Å²	137	143.3 Å²	143.3	93%	0.926	78%	0.779	S	S	*	*			trans	-152.4	46.6	165.9	-113	0	0	0	0	113.4
19	C	27.1	Very low	25.8	Very low	119 Å²	119	146.2 Å²	146.2	80%	0.804	79%	0.785	S	S	*	*			trans	-149.9	96.5	167.6	-106.4	0	0	0	0	110.5	V21	C19-V21 PolarHBondContact O-N 3.42Å
20	S	25.1	Very low	25.9	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	79%	0.788	S	S	*	*			trans	-79.6	109.9	-180	45.4	0	0	0	0	111.7	Q22	S20-Q22 PolarHBondContact O-N 3.39Å
21	V	25.1	Very low	25.9	Very low	127 Å²	127	143 Å²	143	77%	0.77	78%	0.78	S	S	*	*			trans	-78.5	86.5	177.5	-175.3	0	0	0	0	110.6	C19 K23	C19-V21 PolarHBondContact O-N 3.42Å; V21-K23 HydrophobicContact CG1-CG 4.32Å; V21-K23 PolarHBondContact O-N 3.46Å; V21-K23 VanDerWaalsContact O-N 3.17Å
22	Q	23.7	Very low	25.9	Very low	167 Å²	167	147.1 Å²	147.1	78%	0.78	80%	0.795	S	S	*	*			trans	-71.1	103.2	163.1	-75.7	-166.7	-9.1	0	0	109.9	S20 R24	S20-Q22 PolarHBondContact O-N 3.39Å; Q22-R24 VanDerWaalsContact C-N 3.34Å; Q22-R24 PolarHBondContact O-N 3.06Å
23	K	26.5	Very low	26	Very low	199 Å²	199	145.4 Å²	145.4	87%	0.865	79%	0.79	S	S	*	*			trans	-69.5	86.5	170.4	-73.3	-176.4	177.4	178.7	0	110.6	V21	V21-K23 HydrophobicContact CG1-CG 4.32Å; V21-K23 PolarHBondContact O-N 3.46Å; V21-K23 VanDerWaalsContact O-N 3.17Å
24	R	24.8	Very low	26.5	Very low	219 Å²	219	142.2 Å²	142.2	83%	0.826	79%	0.786	S	S	*	*			trans	-87.1	109.6	163.9	-113.9	-179.4	176.8	175.3	-0.8	109.5	Q22 V26	Q22-R24 VanDerWaalsContact C-N 3.34Å; Q22-R24 PolarHBondContact O-N 3.06Å; R24-V26 PolarHBondContact O-N 3.37Å
25	Q	26.7	Very low	26.6	Very low	198 Å²	198	145.1 Å²	145.1	93%	0.925	80%	0.796	S	S	*	*			trans	-68.4	119.9	163.4	-76.4	-176.7	-23.5	0	0	108.7
26	V	25.9	Very low	26.6	Very low	117 Å²	117	148.3 Å²	148.3	71%	0.709	80%	0.799	S	S	*	*			trans	-110.2	111.2	163.6	-178.8	0	0	0	0	106.8	R24	R24-V26 PolarHBondContact O-N 3.37Å
27	R	25.6	Very low	26.5	Very low	233 Å²	233	152.2 Å²	152.2	88%	0.879	81%	0.806	S	S	*	*			trans	-86.7	121.4	169.4	-115.6	-175.8	177.1	178.4	-0.3	107.5
28	T	27.5	Very low	26.6	Very low	117 Å²	117	154.9 Å²	154.9	72%	0.718	81%	0.812	S	S	*	*			trans	-126.9	103.9	168.5	-20.8	0	0	0	0	108.3
29	Q	25.1	Very low	26.8	Very low	178 Å²	178	154.1 Å²	154.1	83%	0.832	81%	0.805	S	S	*	*			trans	-91.1	126.2	163.9	-70.9	178	-87.4	0	0	108.2
30	I	26.6	Very low	26.9	Very low	164 Å²	164	155.5 Å²	155.5	84%	0.841	80%	0.8	S	S	*	*			trans	-135.6	149.4	152.6	-58.5	-176.7	0	0	0	106
31	S	23.1	Very low	27	Very low	94 Å²	94	160 Å²	160	66%	0.657	81%	0.805	S	S	*	*			trans	-149.3	151.6	-164.6	57.2	0	0	0	0	111.9
32	L	24.9	Very low	27.2	Very low	164 Å²	164	160.8 Å²	160.8	86%	0.859	80%	0.8	S	S	*	*			trans	69.9	143.6	167	-58.9	166.7	0	0	0	113.9
33	S	26.5	Very low	27.3	Very low	104 Å²	104	157.9 Å²	157.9	73%	0.727	79%	0.794	S	S	*	*			cis	-149.6	175.2	3	-93.6	0	0	0	0	109.7
34	P	40	Very low	27.3	Very low	104 Å²	104	154.9 Å²	154.9	68%	0.675	78%	0.783	S	S	*	*			trans	-94.3	171.2	-174.6	38.8	-36.5	0	0	0	114.7
35	D	27.8	Very low	27.4	Very low	152 Å²	152	154.2 Å²	154.2	81%	0.813	78%	0.78	S	S	*	*				178.2	174.7	114.8	-89.9	-27.4	0	0	0	114.4
36	E	27.1	Very low	27.3	Very low	183 Å²	183	156 Å²	156	86%	0.855	78%	0.779	S	S	*	*			trans	74.5	87.5	168.8	-57.2	-157.9	149	0	0	121.8
37	E	27.3	Very low	27.6	Very low	191 Å²	191	162 Å²	162	89%	0.893	79%	0.788	S	S	*	*				42.2	130.7	125.8	-57.6	-161.3	160.2	0	0	124.5
38	L	26.4	Very low	28.1	Very low	170 Å²	170	157.3 Å²	157.3	89%	0.89	79%	0.788	S	S	*	*			trans	-142.2	146.6	134.3	-91.9	176.3	0	0	0	109.6
39	P	30.8	Very low	28.1	Very low	120 Å²	120	162.7 Å²	162.7	78%	0.779	80%	0.795	S	S	*	*			trans	-89.5	155.4	-160.4	34	-37.3	0	0	0	116.6
40	E	28.4	Very low	28.2	Very low	149 Å²	149	160.7 Å²	160.7	70%	0.696	79%	0.79	S	S	*	*			trans	-76	163.7	179.2	-50.1	-177.5	139.5	0	0	115.1
41	K	27.6	Very low	28.2	Very low	209 Å²	209	157.3 Å²	157.3	91%	0.909	78%	0.781	S	S	*	*				-158.6	118.3	118.1	-108.5	155.2	-167.6	169.7	0	115.9
42	H	28.8	Very low	28.4	Very low	144 Å²	144	161 Å²	161	67%	0.667	79%	0.788	S	S	*	*			trans	-55.3	166.2	158.5	-72.2	-46.7	0	0	0	113.6
43	T	26.4	Very low	28.5	Very low	106 Å²	106	159.9 Å²	159.9	65%	0.65	78%	0.782	S	S	*	*			cis	-161	-158.6	-15.1	40.8	0	0	0	0	107.1
44	Q	26.7	Very low	28.6	Very low	137 Å²	137	160.9 Å²	160.9	64%	0.64	79%	0.789	S	S	*	*			cis	-163.6	156.9	10.7	-144.7	171.7	117.4	0	0	114.6
45	R	25.7	Very low	28	Very low	205 Å²	205	162.7 Å²	162.7	77%	0.774	79%	0.793	S	S	*	*			trans	37.9	122	150	-80.7	171.2	-173.7	174.9	-3	123.2
46	R	25.6	Very low	28.1	Very low	235 Å²	235	165.5 Å²	165.5	89%	0.887	80%	0.798	S	S	*	*				47.9	116.9	126	-65.5	-173.4	173.3	-164.7	-1.9	121.7
47	R	32.5	Very low	28.2	Very low	242 Å²	242	166.2 Å²	166.2	91%	0.913	80%	0.798	S	S	*	*				12.3	138.7	127.7	-74.6	-171.5	-176.5	-162.1	2.6	118.2
48	P	35.5	Very low	28.4	Very low	135 Å²	135	166.7 Å²	166.7	88%	0.877	80%	0.8	S	S	*	*				-142.4	-157.8	79.4	42.5	-26.1	0	0	0	117.1
49	W	27.4	Very low	28.5	Very low	230 Å²	230	163.6 Å²	163.6	87%	0.871	79%	0.793	S	S	*	*			trans	-86.3	174.3	-151.5	-136.5	40.7	0	0	0	116.5
50	L	27.6	Very low	28.5	Very low	136 Å²	136	164 Å²	164	71%	0.712	79%	0.789	S	S	*	*			trans	106.6	131.3	148	-82.1	162.4	0	0	0	123.6
51	S	25.6	Very low	28.5	Very low	94 Å²	94	162.9 Å²	162.9	66%	0.657	79%	0.792	S	S	*	*			trans	76.9	121.5	137.5	59.6	0	0	0	0	124
52	Q	27.5	Very low	28.6	Very low	171 Å²	171	156.9 Å²	156.9	80%	0.799	79%	0.79	S	S	*	*				85.7	127.4	128.4	-77.6	-174.8	-0.6	0	0	123.3
53	L	27.5	Very low	28.6	Very low	140 Å²	140	156.2 Å²	156.2	73%	0.733	80%	0.799	S	S	*	*			trans	58.3	120.3	132.4	-64.2	167.7	0	0	0	120.8
54	S	28.9	Very low	28.8	Very low	125 Å²	125	157.6 Å²	157.6	87%	0.874	81%	0.807	S	S	*	*			trans	-127.3	97.7	147.3	50	0	0	0	0	110.6
55	N	26.7	Very low	29.1	Very low	143 Å²	143	159.3 Å²	159.3	77%	0.765	82%	0.816	S	S	*	*			trans	-85.1	141.6	171.1	-121.2	-30	0	0	0	109.5
56	K	31	Very low	29.9	Very low	210 Å²	210	154.7 Å²	154.7	91%	0.913	81%	0.812	S	S	*	*			trans	-144.9	140.8	153	-118.4	169.9	-173.6	176.5	0	111.4
57	K	28.5	Very low	30.2	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	81%	0.809	S	S	*	*			trans	-91.1	150	-164.6	-54.9	171.2	-179.9	176.9	0	111.3
58	Q	31	Very low	30.5	Very low	201 Å²	201	147.2 Å²	147.2	94%	0.939	81%	0.807	S	S	*	*			trans	-151	143	133.4	-116.2	164.8	0.5	0	0	111.2
59	S	29.5	Very low	30.5	Very low	105 Å²	105	152.7 Å²	152.7	73%	0.734	81%	0.811	S	S	*	*			trans	-113.3	173.1	170.4	57.2	0	0	0	0	107.6
60	N	30.1	Very low	31.1	Very low	130 Å²	130	151.4 Å²	151.4	70%	0.695	81%	0.811	S	S	*	*			cis	-157.8	155	21.6	-152.3	23.1	0	0	0	112.9
61	T	29.3	Very low	31.9	Very low	125 Å²	125	150.9 Å²	150.9	77%	0.767	82%	0.816	S	S	*	*			trans	40	120.6	150.2	49.7	0	0	0	0	122.1
62	G	28.1	Very low	32.8	Very low	83 Å²	83	154 Å²	154	86%	0.856	83%	0.825	S	S	*	*			trans	-162	125.3	151.6	0	0	0	0	0	110
63	C	29.6	Very low	33.9	Very low	129 Å²	129	151 Å²	151	87%	0.872	82%	0.82	S	S	*	*			trans	-127.9	137.6	-171.2	-178	0	0	0	0	111.7
64	V	30.3	Very low	34.8	Very low	135 Å²	135	150.2 Å²	150.2	82%	0.818	82%	0.823	S	S	*	*			trans	-176.6	146.9	143.1	138.7	0	0	0	0	110.8
65	Q	33.6	Very low	35.6	Very low	174 Å²	174	151.8 Å²	151.8	81%	0.813	82%	0.821	S	S	*	*			trans	-136.6	170.3	165	-88.5	-142.9	21.8	0	0	107.2
66	P	41.4	Very low	36.5	Very low	108 Å²	108	150.2 Å²	150.2	70%	0.701	82%	0.818	S	S	*	*			cis	-142.8	-177.4	18.9	44.1	-26.3	0	0	0	116.5
67	S	31.9	Very low	37	Very low	118 Å²	118	146 Å²	146	83%	0.825	81%	0.812	S	S	*	*				176.3	172.1	116.1	56	0	0	0	0	112.5
68	K	39.4	Very low	37.7	Very low	201 Å²	201	141.6 Å²	141.6	87%	0.874	81%	0.807	S	S	*	*			trans	-114.3	139.7	-157.8	-56.7	165.1	-177.6	168.7	0	113.7
69	R	35.5	Very low	38	Very low	251 Å²	251	140.8 Å²	140.8	95%	0.947	80%	0.803	S	S	*	*			trans	-140	139.6	133.6	-70.5	-165.9	176.6	-175.7	-0.7	108.8
70	K	40.7	Very low	38.4	Very low	203 Å²	203	142 Å²	142	88%	0.883	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.5	140.6	172.5	-76.4	-171.6	174.6	-173.3	0	109.5
71	P	43.3	Very low	38.7	Very low	124 Å²	124	140.1 Å²	140.1	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.5	157.8	160.3	-18.1	32.4	0	0	0	111.6
72	L	44.5	Very low	39.6	Very low	161 Å²	161	142.6 Å²	142.6	84%	0.843	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74.5	155.9	166.2	-73.4	167	0	0	0	110.3
73	P	51.3	Low	41	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.4	149	173.4	28.4	-35.2	0	0	0	111
74	P	47.2	Very low	43	Very low	123 Å²	123	149.1 Å²	149.1	80%	0.799	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65.4	146.9	174.5	29.2	-34.7	0	0	0	110.8
75	L	45.7	Very low	45.6	Very low	158 Å²	158	145.6 Å²	145.6	83%	0.827	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-61.9	149.7	164.5	-73.6	163.8	0	0	0	109.6
76	P	45.5	Very low	48.2	Very low	110 Å²	110	141.8 Å²	141.8	71%	0.714	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-57.9	144.8	171.5	26.9	-34.5	0	0	0	109.8	S78	P76-S78 PolarHBondContact O-N 3.41Å
77	P	41.5	Very low	50.3	Low	121 Å²	121	136.6 Å²	136.6	79%	0.786	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-59.7	138.3	176.9	26.5	-33.9	0	0	0	109.6	E79	P77-E79 PolarHBondContact O-N 3.35Å
78	S	42.3	Very low	52.7	Low	106 Å²	106	132.8 Å²	132.8	74%	0.741	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-55.5	131.3	166.5	-175.7	0	0	0	0	108.3	P76 V80	P76-S78 PolarHBondContact O-N 3.41Å; S78-V80 PolarHBondContact O-N 2.82Å
79	E	37.9	Very low	54.6	Low	183 Å²	183	123.4 Å²	123.4	86%	0.855	66%	0.657	S	S	*	*			trans	-56.5	115.3	167.1	-67.4	-178.2	162.9	0	0	107.6	P77 A81	P77-E79 PolarHBondContact O-N 3.35Å; E79-A81 PolarHBondContact O-N 3.18Å
80	V	36.6	Very low	56	Low	130 Å²	130	113.2 Å²	113.2	79%	0.788	62%	0.621	S	S	*	*			trans	-71.6	112	167.3	178.7	0	0	0	0	104.7	S78 E82	S78-V80 PolarHBondContact O-N 2.82Å; V80-E82 PolarHBondContact O-N 2.97Å
81	A	38.2	Very low	57.1	Low	92 Å²	92	106.3 Å²	106.3	76%	0.76	59%	0.59	S	S	*	*			trans	-63.4	99.4	-179.1	0	0	0	0	0	109.4	E79 E83	E79-A81 PolarHBondContact O-N 3.18Å; A81-E83 PolarHBondContact O-N 3.42Å
82	E	48.2	Very low	58.5	Low	176 Å²	176	104.3 Å²	104.3	82%	0.822	57%	0.573	S	S	*	*			trans	-55.8	124.6	176.8	-63.3	-178	143.2	0	0	109.1	V80 K84	V80-E82 PolarHBondContact O-N 2.97Å; E82-K84 PolarHBondContact O-N 2.92Å
83	E	55.8	Low	60.1	Low	184 Å²	184	97.1 Å²	97.1	86%	0.86	53%	0.534	S	S	*	.			trans	-64.3	101.5	-179.6	-74.2	-162.1	138.7	0	0	109.7	A81 I85	A81-E83 PolarHBondContact O-N 3.42Å; E83-I85 WeakPolarHBondContact O-CG1 3.48Å; E83-I85 PolarHBondContact O-N 2.96Å
84	K	73.2	Confident	61.3	Low	166 Å²	166	98.7 Å²	98.7	72%	0.722	54%	0.536	S	S	*	.			trans	-63.7	95.7	-179.4	-79.1	177.4	-177.2	170.3	0	110.4	E82 Q86 L110	E82-K84 PolarHBondContact O-N 2.92Å; K84-Q86 PolarHBondContact O-N 3.32Å; K84-L110 HydrophobicContact CB-CD1 3.59Å; K84-L110 HydrophobicContact CD-CD2 4.36Å; K84-L110 HydrophobicContact CG-CD1 4Å
85	I	84.8	Confident	62.4	Low	61 Å²	61	95.5 Å²	95.5	31%	0.313	52%	0.516	S	S	.	.			trans	-68.2	94.8	-179.3	-54	-178.9	0	0	0	109	E83 V87 I111 E139	E83-I85 WeakPolarHBondContact O-CG1 3.48Å; E83-I85 PolarHBondContact O-N 2.96Å; I85-V87 HydrophobicContact CG2-CG1 4.24Å; I85-I111 HydrophobicContact CB-CB 4.23Å; I85-I111 HydrophobicContact CG2-CG1 4.34Å; I85-I111 WeakPolarHBondContact O-CB 3.28Å; I85-I111 PolarHBondContact O-N 2.83Å; I85-E139 HydrophobicContact CG2-CG 4.44Å
86	Q	87.1	Confident	63.3	Low	93 Å²	93	93.9 Å²	93.9	44%	0.435	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131	172.8	-166	178.2	3.4	0	0	110	K84 E108 N140	K84-Q86 PolarHBondContact O-N 3.32Å; Q86-E108 PolarHBondContact NE2-OE2 2.83Å; Q86-N140 HydrophobicContact CB-CB 4.43Å; Q86-N140 HydrophobicContact CG-CB 4.21Å; Q86-N140 PolarHBondContact O-N 2.89Å
87	V	85.5	Confident	64.3	Low	0 Å²	0	91 Å²	91	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	164.6	177.6	-60.8	0	0	0	0	110.8	I85 E108 Y109 I111 V137 T138	I85-V87 HydrophobicContact CG2-CG1 4.24Å; V87-E108 WeakPolarHBondContact O-CA 3.32Å; V87-Y109 WeakPolarHBondContact CG2-O 3.43Å; V87-Y109 PolarHBondContact N-O 2.88Å; V87-Y109 PolarHBondContact O-N 3.19Å; V87-I111 HydrophobicContact CB-CG1 4.46Å; V87-I111 HydrophobicContact CG1-CD1 4.1Å; V87-I111 HydrophobicContact CG1-CG1 3.64Å; V87-I111 HydrophobicContact CG2-CD1 3.64Å; V87-I111 HydrophobicContact CG2-CG1 3.96Å; V87-V137 HydrophobicContact CB-CB 4.02Å; V87-V137 HydrophobicContact CB-CG2 4.45Å; V87-V137 HydrophobicContact CG2-CB 3.84Å; V87-V137 HydrophobicContact CG2-CG1 3.97Å; V87-V137 HydrophobicContact CG2-CG2 4.17Å; V87-T138 CarbonylContact C-O 3.48Å; V87-T138 WeakPolarHBondContact CA-O 3.33Å; V87-T138 VanDerWaalsContact CB-O 3.31Å; V87-T138 WeakPolarHBondContact CB-O 3.43Å
88	K	82.2	Confident	65.7	Low	37 Å²	37	92.2 Å²	92.2	16%	0.161	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.3	176	-159.6	-169.8	-170	-174.2	0	109.7	A106 E107 E108 V137 T138 N140 I147	K88-A106 WeakPolarHBondContact CE-O 3.35Å; K88-E107 WeakPolarHBondContact CA-O 3.42Å; K88-E107 WeakPolarHBondContact CG-O 3.28Å; K88-E108 HydrophobicContact CG-CG 4.24Å; K88-V137 WeakPolarHBondContact O-CA 3.24Å; K88-T138 PolarHBondContact N-O 3.2Å; K88-T138 PolarHBondContact O-N 3.43Å; K88-N140 HydrophobicContact CB-CB 4.41Å; K88-I147 HydrophobicContact CB-CG2 4.19Å; K88-I147 HydrophobicContact CD-CB 3.76Å; K88-I147 HydrophobicContact CD-CG2 3.95Å; K88-I147 PolarHBondContact NZ-O 3.2Å
89	A	79.4	Confident	67.4	Low	4 Å²	4	90.1 Å²	90.1	3%	0.033	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.1	-179.5	0	0	0	0	0	112.4	L103 R104 A106 E107 Y109 Y136 V137	A89-L103 HydrophobicContact CB-CB 3.97Å; A89-L103 HydrophobicContact CB-CD2 4.37Å; A89-R104 VanDerWaalsContact CB-O 3.29Å; A89-R104 WeakPolarHBondContact CB-O 3.39Å; A89-A106 WeakPolarHBondContact O-CA 3.42Å; A89-A106 PolarHBondContact O-N 2.92Å; A89-E107 PolarHBondContact N-O 3.37Å; A89-Y109 HydrophobicContact CB-CD2 4.38Å; A89-Y109 HydrophobicContact CB-CE2 3.91Å; A89-Y136 WeakPolarHBondContact CA-O 3.21Å; A89-V137 HydrophobicContact CB-CG1 4.48Å
90	L	64.5	Low	69.5	Low	38 Å²	38	82.1 Å²	82.1	20%	0.199	43%	0.431	C	S	.	.	S	Bend	trans	-81	-31.7	175.3	-61.3	-178	0	0	0	112.3	R105 Y136 T138 E146	L90-R105 WeakPolarHBondContact O-CD 3.4Å; L90-R105 WeakPolarHBondContact O-CG 3.41Å; L90-Y136 PolarHBondContact N-O 3.47Å; L90-T138 HydrophobicContact CD2-CG2 3.65Å; L90-T138 HydrophobicContact CG-CG2 4.27Å; L90-E146 HydrophobicContact CD2-CB 4.2Å; L90-E146 WeakPolarHBondContact CD2-O 3.18Å
91	Y	65.1	Low	72	Confident	58 Å²	58	76.4 Å²	76.4	23%	0.227	40%	0.396	C	S	.	.	S	Bend	trans	-138.8	160.2	-177.2	-44.4	-83.2	0	0	0	110.4	Y136 L253 P254	Y91-Y136 HydrophobicContact CD2-CD1 4.26Å; Y91-Y136 HydrophobicContact CD2-CG 4.21Å; Y91-Y136 HydrophobicContact CG-CD1 4.5Å; Y91-L253 HydrophobicContact CG-CD2 4.34Å; Y91-P254 HydrophobicContact CD2-CG 3.74Å; Y91-P254 HydrophobicContact CE2-CG 3.5Å; Y91-P254 HydrophobicContact CG-CG 4.42Å
92	D	72.4	Confident	74.3	Confident	82 Å²	82	73.8 Å²	73.8	44%	0.439	38%	0.375	S	S	.	.			trans	-72.1	133.7	167.8	-57.8	-66.8	0	0	0	110.1	L103 R104 R105	D92-L103 WeakPolarHBondContact CA-O 2.98Å; D92-R104 WeakPolarHBondContact OD1-CA 3.44Å; D92-R105 PolarHBondContact OD1-N 3.02Å
93	F	76.9	Confident	76	Confident	9 Å²	9	65.6 Å²	65.6	4%	0.039	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-126	105.7	172	172.9	-113.4	0	0	0	108.3	N100 L101 A102 L103 W119 P133 Y136 T256	F93-N100 HydrophobicContact CE1-CB 3.99Å; F93-N100 HydrophobicContact CZ-CB 4.23Å; F93-L101 VanDerWaalsContact CD1-O 3.29Å; F93-L101 WeakPolarHBondContact CD1-O 3.3Å; F93-L101 WeakPolarHBondContact CE1-O 3.34Å; F93-A102 WeakPolarHBondContact O-CA 3.49Å; F93-L103 HydrophobicContact CB-CB 3.73Å; F93-L103 HydrophobicContact CB-CD1 3.94Å; F93-L103 HydrophobicContact CB-CG 3.94Å; F93-L103 HydrophobicContact CD1-CG 4.35Å; F93-L103 PolarHBondContact N-O 3.32Å; F93-L103 PolarHBondContact O-N 2.62Å; F93-W119 HydrophobicContact CE1-CH2 4.48Å; F93-W119 HydrophobicContact CE1-CZ3 4.27Å; F93-W119 HydrophobicContact CE2-CH2 4.17Å; F93-W119 AromaticContact CZ-CH2 3.69Å; F93-W119 HydrophobicContact CZ-CH2 3.69Å; F93-W119 AromaticContact CZ-CZ3 3.91Å; F93-W119 HydrophobicContact CZ-CZ3 3.91Å; F93-P133 HydrophobicContact CD1-CG 4.24Å; F93-P133 HydrophobicContact CD2-CG 3.89Å; F93-P133 HydrophobicContact CE1-CG 4.4Å; F93-P133 HydrophobicContact CE2-CG 4.08Å; F93-P133 HydrophobicContact CG-CG 3.99Å; F93-P133 HydrophobicContact CZ-CG 4.35Å; F93-Y136 HydrophobicContact CB-CD1 3.79Å; F93-Y136 HydrophobicContact CB-CE1 4.07Å; F93-Y136 HydrophobicContact CD2-CE1 4.32Å; F93-T256 HydrophobicContact CE2-CG2 4.37Å
94	L	76.6	Confident	77.2	Confident	141 Å²	141	63.8 Å²	63.8	74%	0.738	32%	0.322	S	S	*	.			trans	-75.7	120.1	171.2	-65.4	172.3	0	0	0	108.2	R96	L94-R96 WeakPolarHBondContact O-CG 3.27Å; L94-R96 PolarHBondContact O-N 3.47Å
95	P	71.3	Confident	77.2	Confident	57 Å²	57	61.8 Å²	61.8	37%	0.37	31%	0.31	S	S	.	.			trans	-68.1	132	-176.3	28.8	-32.8	0	0	0	109.4	N100 A102	P95-N100 HydrophobicContact CB-CB 3.53Å; P95-N100 WeakPolarHBondContact CB-O 3.39Å; P95-A102 HydrophobicContact CG-CB 3.94Å
96	R	64.6	Low	76.4	Confident	124 Å²	124	61.6 Å²	61.6	47%	0.468	32%	0.317	S	S	.	.			trans	-106	-17	-174.3	-61.2	-176.5	179.1	178	-4.1	113	L94 N100	L94-R96 WeakPolarHBondContact O-CG 3.27Å; L94-R96 PolarHBondContact O-N 3.47Å; R96-N100 PolarHBondContact N-OD1 2.86Å; R96-N100 VanDerWaalsContact N-OD1 3.12Å
97	E	65.6	Low	76.3	Confident	50 Å²	50	60 Å²	60	23%	0.234	31%	0.31	C	S	.	.	S	Bend	trans	-123.8	150.3	175.3	-51.6	-175.4	138.5	0	0	109.5	C99 N100 S260	E97-C99 PolarHBondContact O-N 3.03Å; E97-N100 PolarHBondContact N-OD1 3.38Å; E97-N100 VanDerWaalsContact N-OD1 3.1Å; E97-N100 WeakPolarHBondContact O-CB 3.44Å; E97-N100 PolarHBondContact O-N 2.82Å; E97-S260 VanDerWaalsContact OE1-CB 3.23Å; E97-S260 WeakPolarHBondContact OE1-CB 3.43Å; E97-S260 WeakPolarHBondContact OE2-CB 3.27Å
98	P	71.1	Confident	76.4	Confident	146 Å²	146	62.2 Å²	62.2	95%	0.948	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16	-179.5	-24.5	34.9	0	0	0	115.2
99	C	78.5	Confident	76.9	Confident	62 Å²	62	60.7 Å²	60.7	42%	0.419	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-6.1	174.6	61.4	0	0	0	0	113.6	E97 G130 L131	E97-C99 PolarHBondContact O-N 3.03Å; C99-G130 CarbonylContact O-C 3.58Å; C99-G130 WeakPolarHBondContact O-CA 3.4Å; C99-L131 PolarHBondContact O-N 2.83Å
100	N	83	Confident	77.4	Confident	14 Å²	14	62.4 Å²	62.4	8%	0.075	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-87.3	140.8	178.5	-60	170.6	0	0	0	110.4	F93 P95 R96 E97 L131	F93-N100 HydrophobicContact CE1-CB 3.99Å; F93-N100 HydrophobicContact CZ-CB 4.23Å; P95-N100 HydrophobicContact CB-CB 3.53Å; P95-N100 WeakPolarHBondContact CB-O 3.39Å; R96-N100 PolarHBondContact N-OD1 2.86Å; R96-N100 VanDerWaalsContact N-OD1 3.12Å; E97-N100 PolarHBondContact N-OD1 3.38Å; E97-N100 VanDerWaalsContact N-OD1 3.1Å; E97-N100 WeakPolarHBondContact O-CB 3.44Å; E97-N100 PolarHBondContact O-N 2.82Å; N100-L131 CarbonylContact C-O 3.5Å; N100-L131 WeakPolarHBondContact CA-O 3.33Å
101	L	87.6	Confident	78.7	Confident	10 Å²	10	61.1 Å²	61.1	5%	0.052	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-95.4	140.8	170.5	179.7	64.3	0	0	0	110.3	F93 L103 Y109 A122 D124 N128 L131 I132	F93-L101 VanDerWaalsContact CD1-O 3.29Å; F93-L101 WeakPolarHBondContact CD1-O 3.3Å; F93-L101 WeakPolarHBondContact CE1-O 3.34Å; L101-L103 PolarHBondContact O-N 3.3Å; L101-Y109 HydrophobicContact CD2-CD1 3.88Å; L101-Y109 HydrophobicContact CD2-CE1 4.19Å; L101-Y109 HydrophobicContact CG-CE1 4.46Å; L101-A122 HydrophobicContact CD2-CB 4.22Å; L101-D124 HydrophobicContact CD1-CB 4.24Å; L101-D124 HydrophobicContact CD2-CB 4.21Å; L101-N128 HydrophobicContact CD1-CB 3.81Å; L101-L131 PolarHBondContact N-O 3.22Å; L101-I132 HydrophobicContact CB-CG2 3.79Å; L101-I132 HydrophobicContact CD2-CG2 4.34Å; L101-I132 HydrophobicContact CG-CG2 4.36Å
102	A	86.9	Confident	79.8	Confident	38 Å²	38	61 Å²	61	31%	0.314	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-70.2	126.8	175.9	0	0	0	0	0	111.6	F93 P95 Y109	F93-A102 WeakPolarHBondContact O-CA 3.49Å; P95-A102 HydrophobicContact CG-CB 3.94Å; A102-Y109 VanDerWaalsContact O-CE1 3.3Å; A102-Y109 WeakPolarHBondContact O-CE1 3.39Å; A102-Y109 PolarHBondContact O-OH 2.8Å; A102-Y109 VanDerWaalsContact O-OH 3.05Å
103	L	83.8	Confident	80.4	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-93.9	138.1	162.7	-54.6	172.9	0	0	0	109.8	A89 D92 F93 L101 Y109 I132 Y136 V137	A89-L103 HydrophobicContact CB-CB 3.97Å; A89-L103 HydrophobicContact CB-CD2 4.37Å; D92-L103 WeakPolarHBondContact CA-O 2.98Å; F93-L103 HydrophobicContact CB-CB 3.73Å; F93-L103 HydrophobicContact CB-CD1 3.94Å; F93-L103 HydrophobicContact CB-CG 3.94Å; F93-L103 HydrophobicContact CD1-CG 4.35Å; F93-L103 PolarHBondContact N-O 3.32Å; F93-L103 PolarHBondContact O-N 2.62Å; L101-L103 PolarHBondContact O-N 3.3Å; L103-Y109 WeakPolarHBondContact CA-OH 3.39Å; L103-Y109 HydrophobicContact CD2-CD1 4.07Å; L103-Y109 HydrophobicContact CD2-CD2 3.71Å; L103-Y109 HydrophobicContact CD2-CE1 3.98Å; L103-Y109 HydrophobicContact CD2-CE2 3.64Å; L103-Y109 HydrophobicContact CD2-CG 3.96Å; L103-I132 HydrophobicContact CD1-CB 4.29Å; L103-I132 HydrophobicContact CD2-CB 4.12Å; L103-I132 HydrophobicContact CD2-CD1 4.02Å; L103-I132 HydrophobicContact CD2-CG2 3.73Å; L103-I132 HydrophobicContact CG-CB 4.31Å; L103-I132 HydrophobicContact CG-CG2 4.09Å; L103-Y136 VanDerWaalsContact CD1-CB 3.42Å; L103-Y136 HydrophobicContact CD1-CD1 4.45Å; L103-Y136 HydrophobicContact CD1-CG 4.33Å; L103-V137 HydrophobicContact CD1-CG1 3.79Å; L103-V137 HydrophobicContact CD2-CG1 3.89Å
104	R	81.1	Confident	80.5	Confident	146 Å²	146	64.9 Å²	64.9	55%	0.551	33%	0.332	S	S	*	.			trans	-119.6	133.7	167.9	-71.1	171.7	175.4	175.6	2	109	A89 D92 A106 E107 Y109	A89-R104 VanDerWaalsContact CB-O 3.29Å; A89-R104 WeakPolarHBondContact CB-O 3.39Å; D92-R104 WeakPolarHBondContact OD1-CA 3.44Å; R104-A106 PolarHBondContact O-N 2.69Å; R104-E107 HydrophobicContact CB-CB 4.24Å; R104-E107 HydrophobicContact CB-CG 3.87Å; R104-E107 VanDerWaalsContact CD-CD 3.45Å; R104-E107 WeakPolarHBondContact CD-OE1 3.36Å; R104-E107 IonicContact CZ-OE1 2.72Å; R104-E107 IonicContact NE-OE1 3.23Å; R104-E107 IonicContact NH1-OE1 3.95Å; R104-E107 PolarHBondContact NH1-OE1 3.48Å; R104-E107 WeakPolarHBondContact O-CB 3.32Å; R104-E107 PolarHBondContact O-N 2.81Å; R104-Y109 PolarHBondContact N-OH 3.35Å
105	R	72.4	Confident	79.9	Confident	125 Å²	125	62.9 Å²	62.9	47%	0.472	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	130.1	-173.4	-168.9	168.5	79	123.8	6.3	111.4	L90 D92 E107 E149	L90-R105 WeakPolarHBondContact O-CD 3.4Å; L90-R105 WeakPolarHBondContact O-CG 3.41Å; D92-R105 PolarHBondContact OD1-N 3.02Å; R105-E107 PolarHBondContact O-N 2.82Å; R105-E149 IonicContact CZ-OE1 2.72Å; R105-E149 VanDerWaalsContact CZ-OE1 3.26Å; R105-E149 IonicContact NH1-OE1 3.49Å; R105-E149 PolarHBondContact NH1-OE1 3.24Å; R105-E149 IonicContact NH2-OE1 3.63Å; R105-E149 PolarHBondContact NH2-OE1 2.94Å
106	A	69.1	Low	79.4	Confident	56 Å²	56	62.5 Å²	62.5	46%	0.463	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	3	-174.7	0	0	0	0	0	117.4	K88 A89 R104	K88-A106 WeakPolarHBondContact CE-O 3.35Å; A89-A106 WeakPolarHBondContact O-CA 3.42Å; A89-A106 PolarHBondContact O-N 2.92Å; R104-A106 PolarHBondContact O-N 2.69Å
107	E	84.7	Confident	79.1	Confident	61 Å²	61	61.3 Å²	61.3	29%	0.285	32%	0.318	S	S	.	.			trans	-73.3	162.4	163.3	-67.7	-168.5	-165.6	0	0	111.2	K88 A89 R104 R105 Y109	K88-E107 WeakPolarHBondContact CA-O 3.42Å; K88-E107 WeakPolarHBondContact CG-O 3.28Å; A89-E107 PolarHBondContact N-O 3.37Å; R104-E107 HydrophobicContact CB-CB 4.24Å; R104-E107 HydrophobicContact CB-CG 3.87Å; R104-E107 VanDerWaalsContact CD-CD 3.45Å; R104-E107 WeakPolarHBondContact CD-OE1 3.36Å; R104-E107 IonicContact CZ-OE1 2.72Å; R104-E107 IonicContact NE-OE1 3.23Å; R104-E107 IonicContact NH1-OE1 3.95Å; R104-E107 PolarHBondContact NH1-OE1 3.48Å; R104-E107 WeakPolarHBondContact O-CB 3.32Å; R104-E107 PolarHBondContact O-N 2.81Å; R105-E107 PolarHBondContact O-N 2.82Å; E107-Y109 HydrophobicContact CB-CE2 3.91Å
108	E	88.8	Confident	78.8	Confident	45 Å²	45	61 Å²	61	21%	0.21	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.2	-173.3	-66.6	173.8	167	0	0	111.6	Q86 V87 K88 R125 N140	Q86-E108 PolarHBondContact NE2-OE2 2.83Å; V87-E108 WeakPolarHBondContact O-CA 3.32Å; K88-E108 HydrophobicContact CG-CG 4.24Å; E108-R125 IonicContact OE1-NH2 3.49Å; E108-R125 IonicContact OE2-CZ 3.73Å; E108-R125 IonicContact OE2-NE 2.65Å; E108-R125 IonicContact OE2-NH2 3.99Å; E108-R125 PolarHBondContact OE2-NH2 3.36Å; E108-N140 VanDerWaalsContact CD-ND2 3.28Å; E108-N140 PolarHBondContact OE1-ND2 2.87Å
109	Y	90.6	Very high	79.1	Confident	5 Å²	5	54.4 Å²	54.4	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.2	-175.2	-59.1	-94.2	0	0	0	110.1	V87 A89 L101 A102 L103 R104 E107 R123 D124	V87-Y109 WeakPolarHBondContact CG2-O 3.43Å; V87-Y109 PolarHBondContact N-O 2.88Å; V87-Y109 PolarHBondContact O-N 3.19Å; A89-Y109 HydrophobicContact CB-CD2 4.38Å; A89-Y109 HydrophobicContact CB-CE2 3.91Å; L101-Y109 HydrophobicContact CD2-CD1 3.88Å; L101-Y109 HydrophobicContact CD2-CE1 4.19Å; L101-Y109 HydrophobicContact CG-CE1 4.46Å; A102-Y109 VanDerWaalsContact O-CE1 3.3Å; A102-Y109 WeakPolarHBondContact O-CE1 3.39Å; A102-Y109 PolarHBondContact O-OH 2.8Å; A102-Y109 VanDerWaalsContact O-OH 3.05Å; L103-Y109 WeakPolarHBondContact CA-OH 3.39Å; L103-Y109 HydrophobicContact CD2-CD1 4.07Å; L103-Y109 HydrophobicContact CD2-CD2 3.71Å; L103-Y109 HydrophobicContact CD2-CE1 3.98Å; L103-Y109 HydrophobicContact CD2-CE2 3.64Å; L103-Y109 HydrophobicContact CD2-CG 3.96Å; R104-Y109 PolarHBondContact N-OH 3.35Å; E107-Y109 HydrophobicContact CB-CE2 3.91Å; Y109-R123 WeakPolarHBondContact CA-O 3.2Å; Y109-D124 HydrophobicContact CD1-CB 3.9Å; Y109-D124 HydrophobicContact CE1-CB 3.71Å
110	L	91.4	Very high	79.3	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.209	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.2	172.8	172.5	58.9	0	0	0	109.1	K84 L112 A122 R123	K84-L110 HydrophobicContact CB-CD1 3.59Å; K84-L110 HydrophobicContact CD-CD2 4.36Å; K84-L110 HydrophobicContact CG-CD1 4Å; L110-L112 HydrophobicContact CD2-CD2 4.12Å; L110-L112 HydrophobicContact CG-CD2 4.12Å; L110-A122 CarbonylContact O-C 3.58Å; L110-A122 WeakPolarHBondContact O-CA 3.26Å; L110-R123 PolarHBondContact N-O 2.88Å; L110-R123 PolarHBondContact O-N 2.65Å
111	I	91.6	Very high	79.6	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.062	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	131.6	169.4	-55.2	-55	0	0	0	109.1	I85 V87 K114 W120 A122 I132	I85-I111 HydrophobicContact CB-CB 4.23Å; I85-I111 HydrophobicContact CG2-CG1 4.34Å; I85-I111 WeakPolarHBondContact O-CB 3.28Å; I85-I111 PolarHBondContact O-N 2.83Å; V87-I111 HydrophobicContact CB-CG1 4.46Å; V87-I111 HydrophobicContact CG1-CD1 4.1Å; V87-I111 HydrophobicContact CG1-CG1 3.64Å; V87-I111 HydrophobicContact CG2-CD1 3.64Å; V87-I111 HydrophobicContact CG2-CG1 3.96Å; I111-K114 HydrophobicContact CG2-CG 3.84Å; I111-W120 HydrophobicContact CD1-CB 4.25Å; I111-W120 HydrophobicContact CD1-CE3 3.77Å; I111-W120 HydrophobicContact CG1-CE3 4.11Å; I111-W120 HydrophobicContact CG2-CB 4.38Å; I111-A122 HydrophobicContact CD1-CB 3.99Å; I111-I132 HydrophobicContact CD1-CD1 3.89Å
112	L	88.4	Confident	79.8	Confident	54 Å²	54	54.3 Å²	54.3	28%	0.283	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-52.4	175	-56.8	178.7	0	0	0	110.2	L110 K121 R123 E129	L110-L112 HydrophobicContact CD2-CD2 4.12Å; L110-L112 HydrophobicContact CG-CD2 4.12Å; L112-K121 HydrophobicContact CB-CD 4.42Å; L112-K121 HydrophobicContact CB-CG 4.49Å; L112-K121 HydrophobicContact CD1-CD 4.34Å; L112-K121 HydrophobicContact CD1-CG 4.41Å; L112-K121 PolarHBondContact N-O 3.23Å; L112-R123 HydrophobicContact CD1-CB 4.18Å; L112-R123 HydrophobicContact CD2-CB 4.44Å; L112-R123 HydrophobicContact CG-CB 4.39Å; L112-E129 HydrophobicContact CD1-CG 3.76Å; L112-E129 WeakPolarHBondContact CD1-OE1 3.43Å; L112-E129 WeakPolarHBondContact CD1-OE2 3.34Å
113	E	84.6	Confident	80.1	Confident	79 Å²	79	56.7 Å²	56.7	37%	0.369	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	125.8	-171.6	-63.8	164	-110	0	0	109.9	Y115 K121	E113-Y115 HydrophobicContact CB-CD1 4.31Å; E113-Y115 HydrophobicContact CB-CE1 3.81Å; E113-Y115 HydrophobicContact CB-CE2 4.41Å; E113-Y115 HydrophobicContact CG-CE1 4.42Å; E113-Y115 PolarHBondContact O-N 3.02Å; E113-Y115 PolarHBondContact OE1-OH 3.32Å; E113-Y115 WeakPolarHBondContact OE2-CE1 3.39Å; E113-Y115 PolarHBondContact OE2-OH 2.75Å; E113-K121 HydrophobicContact CB-CB 4.04Å; E113-K121 HydrophobicContact CB-CD 4.49Å; E113-K121 HydrophobicContact CG-CD 4.49Å; E113-K121 PolarHBondContact N-O 3.1Å; E113-K121 PolarHBondContact O-N 2.79Å; E113-K121 WeakPolarHBondContact OE1-CD 3.36Å; E113-K121 IonicContact OE1-NZ 3.65Å; E113-K121 PolarHBondContact OE1-NZ 3.44Å
114	K	79.5	Confident	80.5	Confident	95 Å²	95	58 Å²	58	41%	0.413	27%	0.271	S	S	.	.			trans	-95	77.1	175.8	-69.6	-173.9	174.6	177.9	0	110.2	I111 N116 W120 E139	I111-K114 HydrophobicContact CG2-CG 3.84Å; K114-N116 PolarHBondContact O-N 2.84Å; K114-W120 HydrophobicContact CB-CG 4.4Å; K114-W120 HydrophobicContact CD-CD2 4.45Å; K114-W120 HydrophobicContact CD-CZ2 4.31Å; K114-W120 HydrophobicContact CG-CD2 4.06Å; K114-W120 HydrophobicContact CG-CG 4Å; K114-E139 IonicContact NZ-OE1 3.82Å
115	Y	62.8	Low	80.8	Confident	98 Å²	98	59.1 Å²	59.1	38%	0.384	28%	0.275	S	S	.	.			trans	-59.6	-42.5	-174.1	-66.6	-50.2	0	0	0	114.3	E113 K121 L131 Y261	E113-Y115 HydrophobicContact CB-CD1 4.31Å; E113-Y115 HydrophobicContact CB-CE1 3.81Å; E113-Y115 HydrophobicContact CB-CE2 4.41Å; E113-Y115 HydrophobicContact CG-CE1 4.42Å; E113-Y115 PolarHBondContact O-N 3.02Å; E113-Y115 PolarHBondContact OE1-OH 3.32Å; E113-Y115 WeakPolarHBondContact OE2-CE1 3.39Å; E113-Y115 PolarHBondContact OE2-OH 2.75Å; Y115-K121 HydrophobicContact CD2-CB 4.41Å; Y115-K121 HydrophobicContact CE2-CB 3.77Å; Y115-K121 HydrophobicContact CE2-CD 4.32Å; Y115-K121 HydrophobicContact CE2-CG 4.48Å; Y115-L131 HydrophobicContact CD2-CD2 3.72Å; Y115-L131 HydrophobicContact CE2-CD2 3.73Å; Y115-Y261 HydrophobicContact CD2-CE2 4.4Å; Y115-Y261 HydrophobicContact CG-CE2 4.38Å
116	N	61.4	Low	81.5	Confident	50 Å²	50	60.2 Å²	60.2	27%	0.267	29%	0.29	S	S	.	.	S	Bend	trans	-151.3	177.9	177.4	68.9	52.1	0	0	0	110.3	K114 H118 W119 W120	K114-N116 PolarHBondContact O-N 2.84Å; N116-H118 PolarHBondContact O-N 3.25Å; N116-H118 VanDerWaalsContact O-N 3.17Å; N116-H118 WeakPolarHBondContact OD1-CA 3.39Å; N116-H118 WeakPolarHBondContact OD1-CB 3.42Å; N116-H118 PolarHBondContact OD1-N 3Å; N116-W119 PolarHBondContact N-O 2.89Å; N116-W119 PolarHBondContact OD1-N 3.02Å; N116-W120 VanDerWaalsContact O-CD1 3.23Å; N116-W120 PolarHBondContact O-NE1 3.34Å
117	P	58.5	Low	82.3	Confident	98 Å²	98	59.6 Å²	59.6	64%	0.636	29%	0.288	S	S	*	.	S	Bend	trans	-63.7	-16.6	-179.3	-25	36.2	0	0	0	115.4	S134	P117-S134 WeakPolarHBondContact O-CB 3.36Å; P117-S134 PolarHBondContact O-OG 3.12Å
118	H	60.1	Low	82.6	Confident	45 Å²	45	60.8 Å²	60.8	21%	0.208	30%	0.297	C	S	.	.	S	Bend	trans	-112.5	-29.2	-167.4	-54.6	-58.2	0	0	0	114.2	N116 P133 S134 A257	N116-H118 PolarHBondContact O-N 3.25Å; N116-H118 VanDerWaalsContact O-N 3.17Å; N116-H118 WeakPolarHBondContact OD1-CA 3.39Å; N116-H118 WeakPolarHBondContact OD1-CB 3.42Å; N116-H118 PolarHBondContact OD1-N 3Å; H118-P133 CarbonylContact O-C 3.6Å; H118-P133 WeakPolarHBondContact O-CA 3.37Å; H118-S134 VanDerWaalsContact CA-OG 3.29Å; H118-S134 WeakPolarHBondContact CA-OG 3.3Å; H118-S134 PolarHBondContact O-N 3.07Å; H118-S134 PolarHBondContact O-OG 2.86Å; H118-A257 HydrophobicContact CB-CB 3.93Å; H118-A257 WeakPolarHBondContact ND1-CB 3.23Å
119	W	75.7	Confident	82.7	Confident	6 Å²	6	62.9 Å²	62.9	2%	0.023	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	123.4	-176.9	-72.6	93	0	0	0	111	F93 N116 L131 I132 P133 A257 G258	F93-W119 HydrophobicContact CE1-CH2 4.48Å; F93-W119 HydrophobicContact CE1-CZ3 4.27Å; F93-W119 HydrophobicContact CE2-CH2 4.17Å; F93-W119 AromaticContact CZ-CH2 3.69Å; F93-W119 HydrophobicContact CZ-CH2 3.69Å; F93-W119 AromaticContact CZ-CZ3 3.91Å; F93-W119 HydrophobicContact CZ-CZ3 3.91Å; N116-W119 PolarHBondContact N-O 2.89Å; N116-W119 PolarHBondContact OD1-N 3.02Å; W119-L131 HydrophobicContact CE3-CB 3.99Å; W119-L131 HydrophobicContact CZ3-CB 4.41Å; W119-I132 WeakPolarHBondContact CA-O 3.37Å; W119-P133 HydrophobicContact CE3-CB 4.46Å; W119-P133 HydrophobicContact CH2-CB 4.22Å; W119-P133 HydrophobicContact CH2-CG 4.38Å; W119-P133 HydrophobicContact CZ2-CB 4.36Å; W119-P133 HydrophobicContact CZ3-CB 4.27Å; W119-P133 HydrophobicContact CZ3-CG 4.37Å; W119-A257 PolarHBondContact NE1-O 3.22Å; W119-G258 VanDerWaalsContact CZ2-O 3.24Å; W119-G258 WeakPolarHBondContact CZ2-O 3.43Å; W119-G258 PolarHBondContact NE1-O 3.41Å
120	W	84.2	Confident	82.6	Confident	41 Å²	41	63 Å²	63	16%	0.155	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.8	178.7	-59.4	-18.2	0	0	0	109.8	I111 K114 N116 L131 I132 S134 V137	I111-W120 HydrophobicContact CD1-CB 4.25Å; I111-W120 HydrophobicContact CD1-CE3 3.77Å; I111-W120 HydrophobicContact CG1-CE3 4.11Å; I111-W120 HydrophobicContact CG2-CB 4.38Å; K114-W120 HydrophobicContact CB-CG 4.4Å; K114-W120 HydrophobicContact CD-CD2 4.45Å; K114-W120 HydrophobicContact CD-CZ2 4.31Å; K114-W120 HydrophobicContact CG-CD2 4.06Å; K114-W120 HydrophobicContact CG-CG 4Å; N116-W120 VanDerWaalsContact O-CD1 3.23Å; N116-W120 PolarHBondContact O-NE1 3.34Å; W120-L131 WeakPolarHBondContact O-CA 2.89Å; W120-I132 HydrophobicContact CB-CG1 4.45Å; W120-I132 PolarHBondContact N-O 2.83Å; W120-I132 WeakPolarHBondContact O-CG1 3.42Å; W120-I132 PolarHBondContact O-N 3.42Å; W120-S134 VanDerWaalsContact CE2-CB 3.5Å; W120-V137 HydrophobicContact CE3-CG2 3.99Å; W120-V137 HydrophobicContact CZ3-CG2 3.92Å
121	K	88.3	Confident	82.3	Confident	43 Å²	43	62 Å²	62	19%	0.187	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.3	169.4	-167.9	-174.2	170.8	-162.9	0	109.2	L112 E113 Y115 E129 G130 L131	L112-K121 HydrophobicContact CB-CD 4.42Å; L112-K121 HydrophobicContact CB-CG 4.49Å; L112-K121 HydrophobicContact CD1-CD 4.34Å; L112-K121 HydrophobicContact CD1-CG 4.41Å; L112-K121 PolarHBondContact N-O 3.23Å; E113-K121 HydrophobicContact CB-CB 4.04Å; E113-K121 HydrophobicContact CB-CD 4.49Å; E113-K121 HydrophobicContact CG-CD 4.49Å; E113-K121 PolarHBondContact N-O 3.1Å; E113-K121 PolarHBondContact O-N 2.79Å; E113-K121 WeakPolarHBondContact OE1-CD 3.36Å; E113-K121 IonicContact OE1-NZ 3.65Å; E113-K121 PolarHBondContact OE1-NZ 3.44Å; Y115-K121 HydrophobicContact CD2-CB 4.41Å; Y115-K121 HydrophobicContact CE2-CB 3.77Å; Y115-K121 HydrophobicContact CE2-CD 4.32Å; Y115-K121 HydrophobicContact CE2-CG 4.48Å; K121-E129 WeakPolarHBondContact CE-OE2 3.42Å; K121-E129 IonicContact NZ-OE2 2.72Å; K121-E129 PolarHBondContact NZ-OE2 2.94Å; K121-G130 WeakPolarHBondContact CA-O 3.48Å; K121-L131 HydrophobicContact CB-CD2 4.33Å
122	A	92.1	Very high	82	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	164.8	178.9	0	0	0	0	0	112	L101 L110 I111 E129 G130 I132	L101-A122 HydrophobicContact CD2-CB 4.22Å; L110-A122 CarbonylContact O-C 3.58Å; L110-A122 WeakPolarHBondContact O-CA 3.26Å; I111-A122 HydrophobicContact CD1-CB 3.99Å; A122-E129 WeakPolarHBondContact O-CA 3.14Å; A122-G130 PolarHBondContact N-O 3.14Å; A122-G130 PolarHBondContact O-N 3.3Å; A122-I132 HydrophobicContact CB-CD1 3.52Å; A122-I132 HydrophobicContact CB-CG1 3.75Å; A122-I132 HydrophobicContact CB-CG2 4.18Å
123	R	93.2	Very high	81.4	Confident	89 Å²	89	58.8 Å²	58.8	34%	0.336	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.5	170.6	-161.4	-176.8	-65.3	143.2	-3.1	110.1	Y109 L110 L112 N128 E129	Y109-R123 WeakPolarHBondContact CA-O 3.2Å; L110-R123 PolarHBondContact N-O 2.88Å; L110-R123 PolarHBondContact O-N 2.65Å; L112-R123 HydrophobicContact CD1-CB 4.18Å; L112-R123 HydrophobicContact CD2-CB 4.44Å; L112-R123 HydrophobicContact CG-CB 4.39Å; R123-N128 CarbonylContact C-O 3.55Å; R123-N128 VanDerWaalsContact CA-O 3.24Å; R123-N128 WeakPolarHBondContact CA-O 3.41Å; R123-N128 WeakPolarHBondContact CG-O 3.36Å; R123-E129 HydrophobicContact CB-CG 4.12Å; R123-E129 HydrophobicContact CG-CG 3.82Å; R123-E129 IonicContact CZ-OE1 3.91Å; R123-E129 IonicContact NE-OE1 3.02Å; R123-E129 PolarHBondContact NE-OE1 2.92Å; R123-E129 IonicContact NH2-OE1 3.89Å; R123-E129 PolarHBondContact NH2-OE1 3.43Å
124	D	91.8	Very high	80.8	Confident	29 Å²	29	55.8 Å²	55.8	16%	0.155	28%	0.275	C	S	.	.			trans	-82.7	-179.3	174.4	75.8	7.2	0	0	0	112.6	L101 Y109 L126 G127 N128	L101-D124 HydrophobicContact CD1-CB 4.24Å; L101-D124 HydrophobicContact CD2-CB 4.21Å; Y109-D124 HydrophobicContact CD1-CB 3.9Å; Y109-D124 HydrophobicContact CE1-CB 3.71Å; D124-L126 PolarHBondContact O-N 3.32Å; D124-L126 VanDerWaalsContact OD1-CA 3.32Å; D124-L126 WeakPolarHBondContact OD1-CA 3.49Å; D124-L126 WeakPolarHBondContact OD1-CB 3.29Å; D124-L126 PolarHBondContact OD1-N 2.84Å; D124-G127 PolarHBondContact O-N 2.91Å; D124-G127 PolarHBondContact OD1-N 3.38Å; D124-N128 PolarHBondContact N-O 2.86Å; D124-N128 PolarHBondContact OD1-N 3.27Å; D124-N128 PolarHBondContact OD1-ND2 2.97Å; D124-N128 PolarHBondContact OD2-ND2 2.78Å
125	R	87.8	Confident	80.1	Confident	170 Å²	170	53.8 Å²	53.8	64%	0.642	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.2	176.8	-70.9	177.4	165.8	-170.9	-5.6	114.6	E108	E108-R125 IonicContact OE1-NH2 3.49Å; E108-R125 IonicContact OE2-CZ 3.73Å; E108-R125 IonicContact OE2-NE 2.65Å; E108-R125 IonicContact OE2-NH2 3.99Å; E108-R125 PolarHBondContact OE2-NH2 3.36Å
126	L	87.6	Confident	80.5	Confident	149 Å²	149	49.6 Å²	49.6	78%	0.78	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-12.9	177.6	-59.1	175.3	0	0	0	112	D124	D124-L126 PolarHBondContact O-N 3.32Å; D124-L126 VanDerWaalsContact OD1-CA 3.32Å; D124-L126 WeakPolarHBondContact OD1-CA 3.49Å; D124-L126 WeakPolarHBondContact OD1-CB 3.29Å; D124-L126 PolarHBondContact OD1-N 2.84Å
127	G	85.9	Confident	81.1	Confident	42 Å²	42	47.6 Å²	47.6	43%	0.433	24%	0.243	S	C	.	.	S	Bend	trans	100.4	1.3	-178.7	0	0	0	0	0	114.5	D124	D124-G127 PolarHBondContact O-N 2.91Å; D124-G127 PolarHBondContact OD1-N 3.38Å
128	N	89.7	Confident	81.8	Confident	87 Å²	87	43.7 Å²	43.7	47%	0.465	22%	0.217	S	C	.	.			trans	-70.5	135.5	177.8	-54.5	-61.5	0	0	0	110.1	L101 R123 D124	L101-N128 HydrophobicContact CD1-CB 3.81Å; R123-N128 CarbonylContact C-O 3.55Å; R123-N128 VanDerWaalsContact CA-O 3.24Å; R123-N128 WeakPolarHBondContact CA-O 3.41Å; R123-N128 WeakPolarHBondContact CG-O 3.36Å; D124-N128 PolarHBondContact N-O 2.86Å; D124-N128 PolarHBondContact OD1-N 3.27Å; D124-N128 PolarHBondContact OD1-ND2 2.97Å; D124-N128 PolarHBondContact OD2-ND2 2.78Å
129	E	92.7	Very high	82.6	Confident	88 Å²	88	44.3 Å²	44.3	41%	0.411	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	149.3	175.7	-68.8	-173.1	-166.8	0	0	111.9	L112 K121 A122 R123	L112-E129 HydrophobicContact CD1-CG 3.76Å; L112-E129 WeakPolarHBondContact CD1-OE1 3.43Å; L112-E129 WeakPolarHBondContact CD1-OE2 3.34Å; K121-E129 WeakPolarHBondContact CE-OE2 3.42Å; K121-E129 IonicContact NZ-OE2 2.72Å; K121-E129 PolarHBondContact NZ-OE2 2.94Å; A122-E129 WeakPolarHBondContact O-CA 3.14Å; R123-E129 HydrophobicContact CB-CG 4.12Å; R123-E129 HydrophobicContact CG-CG 3.82Å; R123-E129 IonicContact CZ-OE1 3.91Å; R123-E129 IonicContact NE-OE1 3.02Å; R123-E129 PolarHBondContact NE-OE1 2.92Å; R123-E129 IonicContact NH2-OE1 3.89Å; R123-E129 PolarHBondContact NH2-OE1 3.43Å
130	G	88.4	Confident	82.3	Confident	8 Å²	8	46 Å²	46	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	178	169.8	0	0	0	0	0	112.8	C99 K121 A122	C99-G130 CarbonylContact O-C 3.58Å; C99-G130 WeakPolarHBondContact O-CA 3.4Å; K121-G130 WeakPolarHBondContact CA-O 3.48Å; A122-G130 PolarHBondContact N-O 3.14Å; A122-G130 PolarHBondContact O-N 3.3Å
131	L	85.2	Confident	81.4	Confident	18 Å²	18	49.5 Å²	49.5	9%	0.094	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	137.6	176.6	-64.3	177.3	0	0	0	111	C99 N100 L101 Y115 W119 W120 K121 Y261	C99-L131 PolarHBondContact O-N 2.83Å; N100-L131 CarbonylContact C-O 3.5Å; N100-L131 WeakPolarHBondContact CA-O 3.33Å; L101-L131 PolarHBondContact N-O 3.22Å; Y115-L131 HydrophobicContact CD2-CD2 3.72Å; Y115-L131 HydrophobicContact CE2-CD2 3.73Å; W119-L131 HydrophobicContact CE3-CB 3.99Å; W119-L131 HydrophobicContact CZ3-CB 4.41Å; W120-L131 WeakPolarHBondContact O-CA 2.89Å; K121-L131 HydrophobicContact CB-CD2 4.33Å; L131-Y261 HydrophobicContact CD1-CG 4.18Å
132	I	83.6	Confident	80	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.6	175.5	61.5	161.6	0	0	0	110.4	L101 L103 I111 W119 W120 A122 S134 V137	L101-I132 HydrophobicContact CB-CG2 3.79Å; L101-I132 HydrophobicContact CD2-CG2 4.34Å; L101-I132 HydrophobicContact CG-CG2 4.36Å; L103-I132 HydrophobicContact CD1-CB 4.29Å; L103-I132 HydrophobicContact CD2-CB 4.12Å; L103-I132 HydrophobicContact CD2-CD1 4.02Å; L103-I132 HydrophobicContact CD2-CG2 3.73Å; L103-I132 HydrophobicContact CG-CB 4.31Å; L103-I132 HydrophobicContact CG-CG2 4.09Å; I111-I132 HydrophobicContact CD1-CD1 3.89Å; W119-I132 WeakPolarHBondContact CA-O 3.37Å; W120-I132 HydrophobicContact CB-CG1 4.45Å; W120-I132 PolarHBondContact N-O 2.83Å; W120-I132 WeakPolarHBondContact O-CG1 3.42Å; W120-I132 PolarHBondContact O-N 3.42Å; A122-I132 HydrophobicContact CB-CD1 3.52Å; A122-I132 HydrophobicContact CB-CG1 3.75Å; A122-I132 HydrophobicContact CB-CG2 4.18Å; I132-S134 PolarHBondContact O-N 2.88Å; I132-V137 HydrophobicContact CD1-CB 4.43Å; I132-V137 HydrophobicContact CD1-CG1 3.71Å; I132-V137 HydrophobicContact CD1-CG2 3.9Å
133	P	75.6	Confident	78.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	126.1	174.5	26.6	-30.4	0	0	0	110.3	F93 H118 W119 N135 Y136 T256	F93-P133 HydrophobicContact CD1-CG 4.24Å; F93-P133 HydrophobicContact CD2-CG 3.89Å; F93-P133 HydrophobicContact CE1-CG 4.4Å; F93-P133 HydrophobicContact CE2-CG 4.08Å; F93-P133 HydrophobicContact CG-CG 3.99Å; F93-P133 HydrophobicContact CZ-CG 4.35Å; H118-P133 CarbonylContact O-C 3.6Å; H118-P133 WeakPolarHBondContact O-CA 3.37Å; W119-P133 HydrophobicContact CE3-CB 4.46Å; W119-P133 HydrophobicContact CH2-CB 4.22Å; W119-P133 HydrophobicContact CH2-CG 4.38Å; W119-P133 HydrophobicContact CZ2-CB 4.36Å; W119-P133 HydrophobicContact CZ3-CB 4.27Å; W119-P133 HydrophobicContact CZ3-CG 4.37Å; P133-N135 VanDerWaalsContact C-N 3.27Å; P133-N135 PolarHBondContact O-N 2.83Å; P133-Y136 HydrophobicContact CB-CD2 3.81Å; P133-Y136 HydrophobicContact CB-CE2 4.3Å; P133-Y136 HydrophobicContact CB-CG 4.36Å; P133-Y136 HydrophobicContact CG-CD1 4.22Å; P133-Y136 HydrophobicContact CG-CD2 3.56Å; P133-Y136 HydrophobicContact CG-CE2 4.08Å; P133-Y136 HydrophobicContact CG-CG 3.66Å; P133-Y136 PolarHBondContact O-N 2.97Å; P133-Y136 VanDerWaalsContact O-N 3.08Å; P133-T256 HydrophobicContact CB-CG2 3.66Å; P133-T256 HydrophobicContact CG-CG2 3.79Å
134	S	72.6	Confident	77.4	Confident	16 Å²	16	56.7 Å²	56.7	11%	0.112	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-62.4	-33.6	-174.2	65	0	0	0	0	112.7	P117 H118 W120 I132 Y136 V137	P117-S134 WeakPolarHBondContact O-CB 3.36Å; P117-S134 PolarHBondContact O-OG 3.12Å; H118-S134 VanDerWaalsContact CA-OG 3.29Å; H118-S134 WeakPolarHBondContact CA-OG 3.3Å; H118-S134 PolarHBondContact O-N 3.07Å; H118-S134 PolarHBondContact O-OG 2.86Å; W120-S134 VanDerWaalsContact CE2-CB 3.5Å; I132-S134 PolarHBondContact O-N 2.88Å; S134-Y136 PolarHBondContact O-N 3.05Å; S134-V137 WeakPolarHBondContact O-CG2 3.48Å; S134-V137 PolarHBondContact O-N 2.82Å; S134-V137 VanDerWaalsContact O-O 3.06Å
135	N	65.7	Low	76.5	Confident	53 Å²	53	55.8 Å²	55.8	28%	0.283	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-74.1	-0.6	178	65.4	-32.1	0	0	0	114.2	P133 A255	P133-N135 VanDerWaalsContact C-N 3.27Å; P133-N135 PolarHBondContact O-N 2.83Å; N135-A255 PolarHBondContact ND2-O 3.47Å
136	Y	70.8	Confident	75.7	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.035	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-100.7	-5.1	173.1	-75.2	-129.4	0	0	0	113	A89 L90 Y91 F93 L103 P133 S134 L253 P254 T256	A89-Y136 WeakPolarHBondContact CA-O 3.21Å; L90-Y136 PolarHBondContact N-O 3.47Å; Y91-Y136 HydrophobicContact CD2-CD1 4.26Å; Y91-Y136 HydrophobicContact CD2-CG 4.21Å; Y91-Y136 HydrophobicContact CG-CD1 4.5Å; F93-Y136 HydrophobicContact CB-CD1 3.79Å; F93-Y136 HydrophobicContact CB-CE1 4.07Å; F93-Y136 HydrophobicContact CD2-CE1 4.32Å; L103-Y136 VanDerWaalsContact CD1-CB 3.42Å; L103-Y136 HydrophobicContact CD1-CD1 4.45Å; L103-Y136 HydrophobicContact CD1-CG 4.33Å; P133-Y136 HydrophobicContact CB-CD2 3.81Å; P133-Y136 HydrophobicContact CB-CE2 4.3Å; P133-Y136 HydrophobicContact CB-CG 4.36Å; P133-Y136 HydrophobicContact CG-CD1 4.22Å; P133-Y136 HydrophobicContact CG-CD2 3.56Å; P133-Y136 HydrophobicContact CG-CE2 4.08Å; P133-Y136 HydrophobicContact CG-CG 3.66Å; P133-Y136 PolarHBondContact O-N 2.97Å; P133-Y136 VanDerWaalsContact O-N 3.08Å; S134-Y136 PolarHBondContact O-N 3.05Å; Y136-L253 HydrophobicContact CE1-CD2 4.09Å; Y136-P254 HydrophobicContact CD2-CG 4.18Å; Y136-P254 HydrophobicContact CE2-CG 3.81Å; Y136-P254 WeakPolarHBondContact CE2-O 3.24Å; Y136-P254 VanDerWaalsContact CZ-O 3.27Å; Y136-P254 PolarHBondContact OH-O 3.4Å; Y136-T256 HydrophobicContact CD2-CG2 4.27Å; Y136-T256 HydrophobicContact CE2-CG2 3.48Å; Y136-T256 VanDerWaalsContact CE2-CG2 3.48Å
137	V	73.5	Confident	74.7	Confident	9 Å²	9	43.8 Å²	43.8	6%	0.055	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	152.9	-178.9	-70.2	0	0	0	0	111.6	V87 K88 A89 L103 W120 I132 S134	V87-V137 HydrophobicContact CB-CB 4.02Å; V87-V137 HydrophobicContact CB-CG2 4.45Å; V87-V137 HydrophobicContact CG2-CB 3.84Å; V87-V137 HydrophobicContact CG2-CG1 3.97Å; V87-V137 HydrophobicContact CG2-CG2 4.17Å; K88-V137 WeakPolarHBondContact O-CA 3.24Å; A89-V137 HydrophobicContact CB-CG1 4.48Å; L103-V137 HydrophobicContact CD1-CG1 3.79Å; L103-V137 HydrophobicContact CD2-CG1 3.89Å; W120-V137 HydrophobicContact CE3-CG2 3.99Å; W120-V137 HydrophobicContact CZ3-CG2 3.92Å; I132-V137 HydrophobicContact CD1-CB 4.43Å; I132-V137 HydrophobicContact CD1-CG1 3.71Å; I132-V137 HydrophobicContact CD1-CG2 3.9Å; S134-V137 WeakPolarHBondContact O-CG2 3.48Å; S134-V137 PolarHBondContact O-N 2.82Å; S134-V137 VanDerWaalsContact O-O 3.06Å
138	T	73.1	Confident	74.1	Confident	15 Å²	15	44.9 Å²	44.9	9%	0.092	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.9	174.3	-157.7	0	0	0	0	110.2	V87 K88 L90 N140 N144 E146 I147	V87-T138 CarbonylContact C-O 3.48Å; V87-T138 WeakPolarHBondContact CA-O 3.33Å; V87-T138 VanDerWaalsContact CB-O 3.31Å; V87-T138 WeakPolarHBondContact CB-O 3.43Å; K88-T138 PolarHBondContact N-O 3.2Å; K88-T138 PolarHBondContact O-N 3.43Å; L90-T138 HydrophobicContact CD2-CG2 3.65Å; L90-T138 HydrophobicContact CG-CG2 4.27Å; T138-N140 PolarHBondContact O-N 2.85Å; T138-N144 WeakPolarHBondContact CG2-ND2 3.49Å; T138-N144 PolarHBondContact OG1-ND2 2.89Å; T138-E146 HydrophobicContact CG2-CB 3.82Å; T138-E146 PolarHBondContact OG1-OE2 2.91Å; T138-I147 HydrophobicContact CG2-CG2 3.6Å
139	E	77.3	Confident	73.3	Confident	59 Å²	59	45 Å²	45	28%	0.276	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	131.7	-175.3	-62.8	-168.4	164.5	0	0	111.8	I85 K114 K141 N144	I85-E139 HydrophobicContact CG2-CG 4.44Å; K114-E139 IonicContact NZ-OE1 3.82Å; E139-K141 HydrophobicContact CB-CD 4.31Å; E139-K141 HydrophobicContact CB-CG 4.49Å; E139-K141 PolarHBondContact O-N 2.91Å; E139-K141 WeakPolarHBondContact OE2-CE 3.41Å; E139-K141 IonicContact OE2-NZ 3.98Å; E139-K141 PolarHBondContact OE2-NZ 2.9Å; E139-N144 PolarHBondContact N-ND2 2.82Å; E139-N144 WeakPolarHBondContact O-CB 3.35Å; E139-N144 PolarHBondContact O-ND2 3.04Å
140	N	68.8	Low	72.9	Confident	41 Å²	41	41.7 Å²	41.7	22%	0.219	21%	0.212	C	C	.	.			trans	-79.9	55.3	-173.1	-161.9	36.2	0	0	0	112.3	Q86 K88 E108 T138	Q86-N140 HydrophobicContact CB-CB 4.43Å; Q86-N140 HydrophobicContact CG-CB 4.21Å; Q86-N140 PolarHBondContact O-N 2.89Å; K88-N140 HydrophobicContact CB-CB 4.41Å; E108-N140 VanDerWaalsContact CD-ND2 3.28Å; E108-N140 PolarHBondContact OE1-ND2 2.87Å; T138-N140 PolarHBondContact O-N 2.85Å
141	K	66.7	Low	72.6	Confident	114 Å²	114	42.5 Å²	42.5	50%	0.496	21%	0.213	S	C	.	.			trans	-103.6	140	179.6	-69.3	170.2	176.6	165.9	0	109.3	E139 T143 N144	E139-K141 HydrophobicContact CB-CD 4.31Å; E139-K141 HydrophobicContact CB-CG 4.49Å; E139-K141 PolarHBondContact O-N 2.91Å; E139-K141 WeakPolarHBondContact OE2-CE 3.41Å; E139-K141 IonicContact OE2-NZ 3.98Å; E139-K141 PolarHBondContact OE2-NZ 2.9Å; K141-T143 PolarHBondContact O-N 2.94Å; K141-T143 VanDerWaalsContact O-N 3.12Å; K141-N144 HydrophobicContact CB-CB 4.33Å; K141-N144 WeakPolarHBondContact O-CB 3.24Å; K141-N144 PolarHBondContact O-N 2.97Å
142	I	57.3	Low	71.9	Confident	131 Å²	131	42.1 Å²	42.1	67%	0.672	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.6	179.7	-62	172.6	0	0	0	112.1	N144	I142-N144 VanDerWaalsContact C-N 3.31Å
143	T	60.4	Low	71.4	Confident	122 Å²	122	48.3 Å²	48.3	75%	0.748	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-15.1	173.6	49.3	0	0	0	0	114.2	K141 L145	K141-T143 PolarHBondContact O-N 2.94Å; K141-T143 VanDerWaalsContact O-N 3.12Å; T143-L145 PolarHBondContact O-N 2.87Å
144	N	70.6	Confident	71.1	Confident	31 Å²	31	52.7 Å²	52.7	17%	0.166	26%	0.257	C	S	.	.			trans	-93	98.6	-175	-173.4	7	0	0	0	110.9	T138 E139 K141 I142 E146 I147	T138-N144 WeakPolarHBondContact CG2-ND2 3.49Å; T138-N144 PolarHBondContact OG1-ND2 2.89Å; E139-N144 PolarHBondContact N-ND2 2.82Å; E139-N144 WeakPolarHBondContact O-CB 3.35Å; E139-N144 PolarHBondContact O-ND2 3.04Å; K141-N144 HydrophobicContact CB-CB 4.33Å; K141-N144 WeakPolarHBondContact O-CB 3.24Å; K141-N144 PolarHBondContact O-N 2.97Å; I142-N144 VanDerWaalsContact C-N 3.31Å; N144-E146 PolarHBondContact O-N 3.25Å; N144-E146 PolarHBondContact OD1-N 2.94Å; N144-I147 WeakPolarHBondContact O-CG1 3.35Å; N144-I147 PolarHBondContact O-N 2.86Å
145	L	74.2	Confident	70.9	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.047	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-68.6	-15.4	-174.2	-56	179.8	0	0	0	113.8	T143 I147 Y148 W150 Y151 Y184 I224 P225	T143-L145 PolarHBondContact O-N 2.87Å; L145-I147 PolarHBondContact O-N 2.76Å; L145-I147 VanDerWaalsContact O-N 3.13Å; L145-Y148 WeakPolarHBondContact O-CD2 3.41Å; L145-Y148 PolarHBondContact O-N 2.81Å; L145-Y148 VanDerWaalsContact O-N 3.15Å; L145-W150 HydrophobicContact CD2-CH2 4.4Å; L145-Y151 VanDerWaalsContact C-CD1 3.45Å; L145-Y151 HydrophobicContact CB-CD1 3.63Å; L145-Y151 HydrophobicContact CB-CD2 3.55Å; L145-Y151 HydrophobicContact CB-CE1 3.77Å; L145-Y151 HydrophobicContact CB-CE2 3.7Å; L145-Y151 HydrophobicContact CB-CG 3.48Å; L145-Y151 VanDerWaalsContact CB-CG 3.48Å; L145-Y151 HydrophobicContact CD1-CD2 3.81Å; L145-Y151 HydrophobicContact CD1-CE2 3.51Å; L145-Y151 HydrophobicContact CG-CD2 4.34Å; L145-Y151 HydrophobicContact CG-CE2 4.23Å; L145-Y151 VanDerWaalsContact O-CB 3.22Å; L145-Y151 WeakPolarHBondContact O-CB 2.92Å; L145-Y184 HydrophobicContact CD1-CD1 3.98Å; L145-Y184 HydrophobicContact CD1-CE1 3.61Å; L145-Y184 HydrophobicContact CD1-CE2 4.46Å; L145-I224 HydrophobicContact CD1-CD1 3.92Å; L145-I224 HydrophobicContact CD1-CG2 4.34Å; L145-I224 HydrophobicContact CD2-CB 4.05Å; L145-I224 HydrophobicContact CD2-CG2 4.25Å; L145-P225 HydrophobicContact CD2-CG 4.15Å
146	E	69.5	Low	71.3	Confident	45 Å²	45	51.5 Å²	51.5	21%	0.21	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-61.8	-20.8	179.4	-65.6	-178.8	167.1	0	0	113.7	L90 T138 N144 Y148 Y151 R153	L90-E146 HydrophobicContact CD2-CB 4.2Å; L90-E146 WeakPolarHBondContact CD2-O 3.18Å; T138-E146 HydrophobicContact CG2-CB 3.82Å; T138-E146 PolarHBondContact OG1-OE2 2.91Å; N144-E146 PolarHBondContact O-N 3.25Å; N144-E146 PolarHBondContact OD1-N 2.94Å; E146-Y148 PolarHBondContact O-N 2.89Å; E146-Y148 VanDerWaalsContact O-N 3.08Å; E146-Y151 HydrophobicContact CG-CD1 4.08Å; E146-Y151 HydrophobicContact CG-CE1 3.87Å; E146-R153 IonicContact OE1-CZ 2.75Å; E146-R153 IonicContact OE1-NE 3.51Å; E146-R153 PolarHBondContact OE1-NE 2.95Å; E146-R153 IonicContact OE1-NH2 3.54Å; E146-R153 PolarHBondContact OE1-NH2 3.49Å; E146-R153 IonicContact OE2-NH2 3.96Å
147	I	67.8	Low	71.8	Confident	22 Å²	22	54.1 Å²	54.1	11%	0.113	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-68.7	-2.2	175.8	72.2	-174.8	0	0	0	114.3	K88 T138 N144 L145	K88-I147 HydrophobicContact CB-CG2 4.19Å; K88-I147 HydrophobicContact CD-CB 3.76Å; K88-I147 HydrophobicContact CD-CG2 3.95Å; K88-I147 PolarHBondContact NZ-O 3.2Å; T138-I147 HydrophobicContact CG2-CG2 3.6Å; N144-I147 WeakPolarHBondContact O-CG1 3.35Å; N144-I147 PolarHBondContact O-N 2.86Å; L145-I147 PolarHBondContact O-N 2.76Å; L145-I147 VanDerWaalsContact O-N 3.13Å
148	Y	72.2	Confident	71.9	Confident	66 Å²	66	54.5 Å²	54.5	26%	0.259	26%	0.261	S	S	.	.	S	Bend	trans	-116.5	125.7	-177	-60.1	-78.6	0	0	0	112.2	L145 E146 W150 Y151 P225	L145-Y148 WeakPolarHBondContact O-CD2 3.41Å; L145-Y148 PolarHBondContact O-N 2.81Å; L145-Y148 VanDerWaalsContact O-N 3.15Å; E146-Y148 PolarHBondContact O-N 2.89Å; E146-Y148 VanDerWaalsContact O-N 3.08Å; Y148-W150 VanDerWaalsContact CB-CE2 3.46Å; Y148-W150 AromaticContact CD1-CE2 3.96Å; Y148-W150 AromaticContact CD1-CZ2 3.78Å; Y148-W150 HydrophobicContact CD1-CZ2 3.78Å; Y148-W150 AromaticContact CD1-NE1 3.86Å; Y148-W150 AromaticContact CD2-CH2 3.96Å; Y148-W150 HydrophobicContact CD2-CH2 3.96Å; Y148-W150 AromaticContact CD2-CZ2 3.77Å; Y148-W150 HydrophobicContact CD2-CZ2 3.77Å; Y148-W150 HydrophobicContact CE1-CZ2 4.38Å; Y148-W150 HydrophobicContact CE2-CZ2 4.39Å; Y148-W150 AromaticContact CG-CE2 3.71Å; Y148-W150 HydrophobicContact CG-CH2 4.04Å; Y148-W150 AromaticContact CG-CZ2 3.45Å; Y148-W150 HydrophobicContact CG-CZ2 3.45Å; Y148-W150 VanDerWaalsContact CG-CZ2 3.45Å; Y148-W150 PolarHBondContact O-N 3.02Å; Y148-Y151 PolarHBondContact O-N 2.64Å; Y148-P225 HydrophobicContact CD2-CG 4.17Å; Y148-P225 HydrophobicContact CE1-CB 4.19Å; Y148-P225 HydrophobicContact CE1-CG 4.41Å; Y148-P225 HydrophobicContact CE2-CB 3.99Å; Y148-P225 HydrophobicContact CE2-CG 3.31Å; Y148-P225 VanDerWaalsContact CZ-CG 3.46Å; Y148-P225 WeakPolarHBondContact OH-CB 3.16Å; Y148-P225 WeakPolarHBondContact OH-CG 3.49Å
149	E	72.6	Confident	71.9	Confident	89 Å²	89	55.1 Å²	55.1	42%	0.416	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.1	179	-178.6	172.5	-124.9	0	0	114.4	R105 G247	R105-E149 IonicContact CZ-OE1 2.72Å; R105-E149 VanDerWaalsContact CZ-OE1 3.26Å; R105-E149 IonicContact NH1-OE1 3.49Å; R105-E149 PolarHBondContact NH1-OE1 3.24Å; R105-E149 IonicContact NH2-OE1 3.63Å; R105-E149 PolarHBondContact NH2-OE1 2.94Å; E149-G247 WeakPolarHBondContact O-CA 3.43Å
150	W	84.4	Confident	72.1	Confident	18 Å²	18	52.3 Å²	52.3	7%	0.068	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.3	176.2	48.4	-105.3	0	0	0	114.5	L145 Y148 F173 I174 V175 I224 P225 I228 P245	L145-W150 HydrophobicContact CD2-CH2 4.4Å; Y148-W150 VanDerWaalsContact CB-CE2 3.46Å; Y148-W150 AromaticContact CD1-CE2 3.96Å; Y148-W150 AromaticContact CD1-CZ2 3.78Å; Y148-W150 HydrophobicContact CD1-CZ2 3.78Å; Y148-W150 AromaticContact CD1-NE1 3.86Å; Y148-W150 AromaticContact CD2-CH2 3.96Å; Y148-W150 HydrophobicContact CD2-CH2 3.96Å; Y148-W150 AromaticContact CD2-CZ2 3.77Å; Y148-W150 HydrophobicContact CD2-CZ2 3.77Å; Y148-W150 HydrophobicContact CE1-CZ2 4.38Å; Y148-W150 HydrophobicContact CE2-CZ2 4.39Å; Y148-W150 AromaticContact CG-CE2 3.71Å; Y148-W150 HydrophobicContact CG-CH2 4.04Å; Y148-W150 AromaticContact CG-CZ2 3.45Å; Y148-W150 HydrophobicContact CG-CZ2 3.45Å; Y148-W150 VanDerWaalsContact CG-CZ2 3.45Å; Y148-W150 PolarHBondContact O-N 3.02Å; W150-F173 HydrophobicContact CB-CD2 4.21Å; W150-F173 HydrophobicContact CB-CE2 3.48Å; W150-F173 VanDerWaalsContact CB-CE2 3.48Å; W150-F173 HydrophobicContact CB-CZ 3.77Å; W150-F173 AromaticContact CD1-CZ 3.91Å; W150-F173 HydrophobicContact CD2-CE2 4.32Å; W150-F173 AromaticContact CG-CE2 3.7Å; W150-F173 HydrophobicContact CG-CE2 3.7Å; W150-F173 AromaticContact CG-CZ 3.92Å; W150-F173 HydrophobicContact CG-CZ 3.92Å; W150-I174 CarbonylContact O-C 3.56Å; W150-I174 WeakPolarHBondContact O-CA 3.37Å; W150-V175 HydrophobicContact CD2-CG2 4.27Å; W150-V175 HydrophobicContact CE3-CB 3.66Å; W150-V175 HydrophobicContact CE3-CG2 3.37Å; W150-V175 HydrophobicContact CZ3-CB 3.84Å; W150-V175 HydrophobicContact CZ3-CG1 4.32Å; W150-V175 HydrophobicContact CZ3-CG2 3.68Å; W150-V175 PolarHBondContact O-N 2.92Å; W150-I224 HydrophobicContact CH2-CG2 4.12Å; W150-I224 HydrophobicContact CZ3-CG2 4.33Å; W150-P225 HydrophobicContact CH2-CG 4.38Å; W150-P225 HydrophobicContact CZ2-CB 4.46Å; W150-P225 HydrophobicContact CZ2-CG 4.46Å; W150-I228 HydrophobicContact CD2-CG2 4.13Å; W150-I228 HydrophobicContact CE3-CG1 4.39Å; W150-I228 HydrophobicContact CG-CG2 4.41Å; W150-I228 HydrophobicContact CH2-CB 4.41Å; W150-I228 HydrophobicContact CH2-CG1 3.92Å; W150-I228 HydrophobicContact CZ2-CB 4.03Å; W150-I228 HydrophobicContact CZ2-CG1 4.03Å; W150-I228 HydrophobicContact CZ2-CG2 4.09Å; W150-I228 HydrophobicContact CZ3-CG1 4.1Å; W150-P245 HydrophobicContact CB-CB 3.8Å; W150-P245 HydrophobicContact CG-CB 4.48Å
151	Y	82.6	Confident	72.9	Confident	26 Å²	26	51.8 Å²	51.8	10%	0.102	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-99.1	126.6	-177.2	179.7	-102.8	0	0	0	112.5	L145 E146 Y148 R153 V175 D177 Y184	L145-Y151 VanDerWaalsContact C-CD1 3.45Å; L145-Y151 HydrophobicContact CB-CD1 3.63Å; L145-Y151 HydrophobicContact CB-CD2 3.55Å; L145-Y151 HydrophobicContact CB-CE1 3.77Å; L145-Y151 HydrophobicContact CB-CE2 3.7Å; L145-Y151 HydrophobicContact CB-CG 3.48Å; L145-Y151 VanDerWaalsContact CB-CG 3.48Å; L145-Y151 HydrophobicContact CD1-CD2 3.81Å; L145-Y151 HydrophobicContact CD1-CE2 3.51Å; L145-Y151 HydrophobicContact CG-CD2 4.34Å; L145-Y151 HydrophobicContact CG-CE2 4.23Å; L145-Y151 VanDerWaalsContact O-CB 3.22Å; L145-Y151 WeakPolarHBondContact O-CB 2.92Å; E146-Y151 HydrophobicContact CG-CD1 4.08Å; E146-Y151 HydrophobicContact CG-CE1 3.87Å; Y148-Y151 PolarHBondContact O-N 2.64Å; Y151-R153 HydrophobicContact CE1-CB 3.77Å; Y151-R153 HydrophobicContact CE1-CG 4.37Å; Y151-V175 CarbonylContact C-O 3.58Å; Y151-V175 WeakPolarHBondContact CA-O 3.44Å; Y151-V175 HydrophobicContact CD2-CB 4.35Å; Y151-V175 HydrophobicContact CD2-CG1 4.32Å; Y151-D177 PolarHBondContact OH-OD1 3.41Å; Y151-Y184 AromaticContact CE2-CD1 3.98Å; Y151-Y184 HydrophobicContact CE2-CD1 3.98Å; Y151-Y184 AromaticContact CE2-CE1 3.98Å; Y151-Y184 HydrophobicContact CE2-CE1 3.98Å
152	H	71.7	Confident	73.4	Confident	10 Å²	10	50 Å²	50	5%	0.046	24%	0.236	C	C	.	.			trans	-131.1	83.9	-177.4	-70.4	-129.5	0	0	0	108.8	N154 I155 I174 V175 R176 V246 G247 L248	H152-N154 PolarHBondContact O-N 2.83Å; H152-I155 HydrophobicContact CB-CB 4.28Å; H152-I155 HydrophobicContact CB-CD1 3.58Å; H152-I155 HydrophobicContact CB-CG1 3.62Å; H152-I155 HydrophobicContact CB-CG2 3.79Å; H152-I155 PolarHBondContact O-N 2.92Å; H152-I174 HydrophobicContact CB-CG2 3.78Å; H152-I174 VanDerWaalsContact CD2-CG2 3.46Å; H152-I174 WeakPolarHBondContact CD2-CG2 3.47Å; H152-V175 PolarHBondContact N-O 2.99Å; H152-R176 WeakPolarHBondContact O-CA 3.38Å; H152-R176 WeakPolarHBondContact O-CB 3.22Å; H152-V246 PolarHBondContact NE2-O 3.22Å; H152-G247 VanDerWaalsContact CE1-C 3.44Å; H152-G247 PolarHBondContact CE1-O 3.28Å; H152-L248 PolarHBondContact CE1-N 2.89Å
153	R	73.3	Confident	74.3	Confident	129 Å²	129	45.1 Å²	45.1	49%	0.487	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-31.8	-82.3	-173.8	-170.1	-159.2	-80.4	-131.5	4.5	114.3	E146 Y151 I155 D177	E146-R153 IonicContact OE1-CZ 2.75Å; E146-R153 IonicContact OE1-NE 3.51Å; E146-R153 PolarHBondContact OE1-NE 2.95Å; E146-R153 IonicContact OE1-NH2 3.54Å; E146-R153 PolarHBondContact OE1-NH2 3.49Å; E146-R153 IonicContact OE2-NH2 3.96Å; Y151-R153 HydrophobicContact CE1-CB 3.77Å; Y151-R153 HydrophobicContact CE1-CG 4.37Å; R153-I155 PolarHBondContact O-N 2.68Å; R153-D177 VanDerWaalsContact CG-OD2 3.27Å; R153-D177 WeakPolarHBondContact CG-OD2 3.45Å; R153-D177 VanDerWaalsContact O-CB 3.26Å; R153-D177 WeakPolarHBondContact O-CB 3.34Å; R153-D177 VanDerWaalsContact O-CG 3.28Å; R153-D177 PolarHBondContact O-N 3.02Å
154	N	67.3	Low	75.3	Confident	92 Å²	92	39.3 Å²	39.3	49%	0.492	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	13.6	-171.1	-76.7	11.5	0	0	0	115	H152 T156 E376	H152-N154 PolarHBondContact O-N 2.83Å; N154-T156 PolarHBondContact O-N 2.91Å; N154-E376 PolarHBondContact ND2-OE1 2.75Å
155	I	70.2	Confident	75.8	Confident	31 Å²	31	43 Å²	43	16%	0.159	19%	0.187	C	C	.	.			trans	-71.6	137.1	-176.6	73.8	167	0	0	0	111.8	H152 R153 Q159 A160 L163 I174 R176	H152-I155 HydrophobicContact CB-CB 4.28Å; H152-I155 HydrophobicContact CB-CD1 3.58Å; H152-I155 HydrophobicContact CB-CG1 3.62Å; H152-I155 HydrophobicContact CB-CG2 3.79Å; H152-I155 PolarHBondContact O-N 2.92Å; R153-I155 PolarHBondContact O-N 2.68Å; I155-Q159 HydrophobicContact CB-CB 4.17Å; I155-A160 HydrophobicContact CD1-CB 3.66Å; I155-A160 HydrophobicContact CG1-CB 4.31Å; I155-L163 HydrophobicContact CD1-CD1 4.12Å; I155-I174 HydrophobicContact CD1-CD1 4.08Å; I155-I174 HydrophobicContact CD1-CG2 3.8Å; I155-R176 HydrophobicContact CG1-CB 3.81Å; I155-R176 WeakPolarHBondContact O-CD 3.46Å
156	T	73.9	Confident	75.9	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.08	21%	0.209	C	C	.	.			trans	-72.7	160.6	179.4	75.1	0	0	0	0	111.1	N154 N158 Q159 A160	N154-T156 PolarHBondContact O-N 2.91Å; T156-N158 PolarHBondContact O-N 2.84Å; T156-N158 VanDerWaalsContact O-N 3.13Å; T156-N158 PolarHBondContact OG1-N 2.91Å; T156-Q159 PolarHBondContact O-N 2.78Å; T156-Q159 VanDerWaalsContact O-N 3.13Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.29Å; T156-Q159 PolarHBondContact OG1-N 3.05Å; T156-Q159 VanDerWaalsContact OG1-N 3.14Å; T156-A160 PolarHBondContact O-N 3.15Å
157	R	81.8	Confident	76.2	Confident	64 Å²	64	48.2 Å²	48.2	24%	0.242	21%	0.211	C	C	.	.	H	α-helix	trans	-48.2	-41.5	172.1	-173.8	-179.4	162.9	-152.5	-27.5	111.8	E161 H202 E525 W527	R157-E161 IonicContact NE-OE1 2.64Å; R157-E161 IonicContact NH2-OE1 2.66Å; R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.5Å; R157-H202 VanDerWaalsContact CG-CE1 3.44Å; R157-H202 WeakPolarHBondContact CG-CE1 3.36Å; R157-E525 PolarHBondContact NH1-O 2.77Å; R157-W527 PolarHBondContact NH1-O 2.92Å; R157-W527 PolarHBondContact NH2-O 3.36Å; R157-W527 VanDerWaalsContact NH2-O 3.12Å
158	N	75.6	Confident	76.8	Confident	17 Å²	17	50.9 Å²	50.9	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-77	-35	-176.9	-62.1	-25.3	0	0	0	112.8	T156 E161 R162 E365	T156-N158 PolarHBondContact O-N 2.84Å; T156-N158 VanDerWaalsContact O-N 3.13Å; T156-N158 PolarHBondContact OG1-N 2.91Å; N158-E161 PolarHBondContact O-N 3.4Å; N158-R162 WeakPolarHBondContact O-CG 3.14Å; N158-R162 PolarHBondContact O-N 2.79Å; N158-E365 HydrophobicContact CB-CB 4.3Å
159	Q	72.3	Confident	77.2	Confident	29 Å²	29	52.1 Å²	52.1	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-44.1	171.7	-74.3	164	-12	0	0	110.8	I155 T156 E161 R162 L163 D373	I155-Q159 HydrophobicContact CB-CB 4.17Å; T156-Q159 PolarHBondContact O-N 2.78Å; T156-Q159 VanDerWaalsContact O-N 3.13Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.29Å; T156-Q159 PolarHBondContact OG1-N 3.05Å; T156-Q159 VanDerWaalsContact OG1-N 3.14Å; Q159-E161 VanDerWaalsContact C-N 3.33Å; Q159-E161 PolarHBondContact O-N 3.19Å; Q159-R162 PolarHBondContact O-N 2.86Å; Q159-L163 WeakPolarHBondContact O-CG 3.4Å; Q159-L163 PolarHBondContact O-N 2.66Å; Q159-D373 PolarHBondContact NE2-OD1 3.08Å
160	A	81.8	Confident	77.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-43.7	173	0	0	0	0	0	111.7	I155 T156 R162 L163 L164	I155-A160 HydrophobicContact CD1-CB 3.66Å; I155-A160 HydrophobicContact CG1-CB 4.31Å; T156-A160 PolarHBondContact O-N 3.15Å; A160-R162 PolarHBondContact O-N 3.44Å; A160-L163 PolarHBondContact O-N 3.13Å; A160-L164 VanDerWaalsContact O-CB 3.31Å; A160-L164 WeakPolarHBondContact O-CB 3.49Å; A160-L164 WeakPolarHBondContact O-CD1 3.2Å; A160-L164 WeakPolarHBondContact O-CG 3.26Å; A160-L164 PolarHBondContact O-N 2.99Å
161	E	84.5	Confident	77.8	Confident	29 Å²	29	49.5 Å²	49.5	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-33.1	176.2	-74.1	-155.1	-147.6	0	0	114.1	R157 N158 Q159 R165 I200 H202	R157-E161 IonicContact NE-OE1 2.64Å; R157-E161 IonicContact NH2-OE1 2.66Å; R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.5Å; N158-E161 PolarHBondContact O-N 3.4Å; Q159-E161 VanDerWaalsContact C-N 3.33Å; Q159-E161 PolarHBondContact O-N 3.19Å; E161-R165 WeakPolarHBondContact O-CB 3.43Å; E161-R165 WeakPolarHBondContact O-CD 3.42Å; E161-R165 WeakPolarHBondContact O-CG 3.4Å; E161-R165 PolarHBondContact O-N 2.98Å; E161-R165 VanDerWaalsContact O-N 3.14Å; E161-R165 IonicContact OE2-CZ 2.94Å; E161-R165 IonicContact OE2-NE 3.79Å; E161-R165 IonicContact OE2-NH2 3.79Å; E161-R165 PolarHBondContact OE2-NH2 2.81Å; E161-I200 HydrophobicContact CB-CD1 3.88Å; E161-I200 HydrophobicContact CG-CB 4.13Å; E161-I200 HydrophobicContact CG-CD1 3.74Å; E161-I200 HydrophobicContact CG-CG2 3.99Å; E161-H202 IonicContact OE1-CD2 2.91Å; E161-H202 IonicContact OE1-CE1 3.26Å; E161-H202 IonicContact OE1-NE2 2.68Å; E161-H202 PolarHBondContact OE1-NE2 3.25Å
162	R	77.1	Confident	78	Confident	76 Å²	76	48.2 Å²	48.2	29%	0.287	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-54.8	172.2	-76.5	176.6	58.6	-156.7	-14.8	111	N158 Q159 A160 L164 R165 Q166 M366 T401 C402	N158-R162 WeakPolarHBondContact O-CG 3.14Å; N158-R162 PolarHBondContact O-N 2.79Å; Q159-R162 PolarHBondContact O-N 2.86Å; A160-R162 PolarHBondContact O-N 3.44Å; R162-L164 PolarHBondContact O-N 3.46Å; R162-R165 PolarHBondContact O-N 2.92Å; R162-R165 VanDerWaalsContact O-N 3.16Å; R162-Q166 WeakPolarHBondContact O-CG 3.4Å; R162-Q166 PolarHBondContact O-N 3.05Å; R162-Q166 PolarHBondContact O-OE1 2.78Å; R162-M366 PolarHBondContact NH1-SD 3.43Å; R162-M366 VanDerWaalsContact NH1-SD 3.39Å; R162-T401 PolarHBondContact NH2-O 3.36Å; R162-C402 PolarHBondContact NH1-O 2.83Å
163	L	75.7	Confident	79	Confident	30 Å²	30	47.8 Å²	47.8	16%	0.157	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-47.1	-178.7	-68.3	169.1	0	0	0	112	I155 Q159 A160 R165 Q166 E167 I174 V246 M249	I155-L163 HydrophobicContact CD1-CD1 4.12Å; Q159-L163 WeakPolarHBondContact O-CG 3.4Å; Q159-L163 PolarHBondContact O-N 2.66Å; A160-L163 PolarHBondContact O-N 3.13Å; L163-R165 VanDerWaalsContact C-N 3.34Å; L163-R165 PolarHBondContact O-N 2.92Å; L163-Q166 PolarHBondContact O-N 2.67Å; L163-E167 PolarHBondContact O-N 2.86Å; L163-E167 VanDerWaalsContact O-N 3.08Å; L163-I174 HydrophobicContact CB-CD1 3.84Å; L163-I174 HydrophobicContact CD1-CD1 3.91Å; L163-V246 HydrophobicContact CB-CG1 4.31Å; L163-M249 HydrophobicContact CD2-CB 4.45Å; L163-M249 HydrophobicContact CD2-CG 4.13Å
164	L	83.1	Confident	79.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-35.1	178.6	-73.2	170	0	0	0	113.2	A160 R162 S168 A172 I174 F189 I200 V246	A160-L164 VanDerWaalsContact O-CB 3.31Å; A160-L164 WeakPolarHBondContact O-CB 3.49Å; A160-L164 WeakPolarHBondContact O-CD1 3.2Å; A160-L164 WeakPolarHBondContact O-CG 3.26Å; A160-L164 PolarHBondContact O-N 2.99Å; R162-L164 PolarHBondContact O-N 3.46Å; L164-S168 PolarHBondContact O-N 2.88Å; L164-A172 HydrophobicContact CD2-CB 4.09Å; L164-A172 WeakPolarHBondContact CD2-O 3.47Å; L164-I174 HydrophobicContact CD2-CD1 4.42Å; L164-I174 HydrophobicContact CD2-CG1 4.22Å; L164-I174 HydrophobicContact CG-CD1 4.12Å; L164-I174 HydrophobicContact CG-CG1 4.38Å; L164-F189 HydrophobicContact CB-CB 4.36Å; L164-F189 HydrophobicContact CD2-CB 4.39Å; L164-F189 WeakPolarHBondContact O-CD2 3.33Å; L164-I200 HydrophobicContact CB-CD1 3.53Å; L164-I200 HydrophobicContact CB-CG1 4.4Å; L164-I200 HydrophobicContact CD1-CD1 4.06Å; L164-I200 HydrophobicContact CD1-CG2 3.88Å; L164-I200 HydrophobicContact CG-CD1 4.46Å; L164-V246 HydrophobicContact CD2-CG2 3.93Å
165	R	81.4	Confident	80.9	Confident	107 Å²	107	37.2 Å²	37.2	40%	0.404	17%	0.174	S	C	.	.	H	α-helix	trans	-75.4	-27.5	175.5	-71.3	171	-165	-80	2.8	112.9	E161 R162 L163 F189 I200	E161-R165 WeakPolarHBondContact O-CB 3.43Å; E161-R165 WeakPolarHBondContact O-CD 3.42Å; E161-R165 WeakPolarHBondContact O-CG 3.4Å; E161-R165 PolarHBondContact O-N 2.98Å; E161-R165 VanDerWaalsContact O-N 3.14Å; E161-R165 IonicContact OE2-CZ 2.94Å; E161-R165 IonicContact OE2-NE 3.79Å; E161-R165 IonicContact OE2-NH2 3.79Å; E161-R165 PolarHBondContact OE2-NH2 2.81Å; R162-R165 PolarHBondContact O-N 2.92Å; R162-R165 VanDerWaalsContact O-N 3.16Å; L163-R165 VanDerWaalsContact C-N 3.34Å; L163-R165 PolarHBondContact O-N 2.92Å; R165-F189 HydrophobicContact CG-CE2 4.27Å; R165-I200 HydrophobicContact CG-CD1 3.86Å
166	Q	75	Confident	81.7	Confident	110 Å²	110	36 Å²	36	51%	0.514	17%	0.167	S	C	.	.	H	α-helix	trans	-71.1	-37.9	172.6	-68.2	171	-88.5	0	0	111.4	R162 L163 M249	R162-Q166 WeakPolarHBondContact O-CG 3.4Å; R162-Q166 PolarHBondContact O-N 3.05Å; R162-Q166 PolarHBondContact O-OE1 2.78Å; L163-Q166 PolarHBondContact O-N 2.67Å; Q166-M249 HydrophobicContact CB-CE 3.48Å; Q166-M249 VanDerWaalsContact CB-CE 3.48Å; Q166-M249 HydrophobicContact CB-SD 3.84Å; Q166-M249 HydrophobicContact CG-SD 4.48Å
167	E	76.3	Confident	82.2	Confident	54 Å²	54	37.6 Å²	37.6	25%	0.252	18%	0.175	S	C	.	.	H	α-helix	trans	-72.2	-37.6	175.2	-83	-68.1	121.1	0	0	113.9	L163 K169 A172 V246 M249	L163-E167 PolarHBondContact O-N 2.86Å; L163-E167 VanDerWaalsContact O-N 3.08Å; E167-K169 WeakPolarHBondContact O-CG 3.32Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 IonicContact OE1-NZ 2.65Å; E167-K169 WeakPolarHBondContact OE2-CD 3.28Å; E167-K169 WeakPolarHBondContact OE2-CE 3.28Å; E167-K169 IonicContact OE2-NZ 3.75Å; E167-K169 PolarHBondContact OE2-NZ 2.63Å; E167-A172 HydrophobicContact CB-CB 4.4Å; E167-V246 HydrophobicContact CB-CG2 4.13Å; E167-V246 HydrophobicContact CG-CB 4.35Å; E167-V246 HydrophobicContact CG-CG1 3.75Å; E167-V246 HydrophobicContact CG-CG2 3.76Å; E167-M249 HydrophobicContact CG-CE 3.95Å; E167-M249 WeakPolarHBondContact OE1-CE 3.39Å
168	S	80.1	Confident	82	Confident	79 Å²	79	35.6 Å²	35.6	55%	0.552	17%	0.171	S	C	*	.			trans	56.7	20	170	-148.5	0	0	0	0	116.9	L164	L164-S168 PolarHBondContact O-N 2.88Å
169	K	80.1	Confident	81.4	Confident	92 Å²	92	40.3 Å²	40.3	40%	0.4	19%	0.187	S	C	.	.			trans	-98.6	133.9	180	-65	145.7	-170.4	170.1	0	111.2	E167 G171 A172 F189 Y244	E167-K169 WeakPolarHBondContact O-CG 3.32Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 IonicContact OE1-NZ 2.65Å; E167-K169 WeakPolarHBondContact OE2-CD 3.28Å; E167-K169 WeakPolarHBondContact OE2-CE 3.28Å; E167-K169 IonicContact OE2-NZ 3.75Å; E167-K169 PolarHBondContact OE2-NZ 2.63Å; K169-G171 PolarHBondContact O-N 2.89Å; K169-A172 HydrophobicContact CB-CB 4.26Å; K169-A172 WeakPolarHBondContact O-CB 3.36Å; K169-A172 PolarHBondContact O-N 2.82Å; K169-F189 VanDerWaalsContact O-CD1 3.26Å; K169-F189 WeakPolarHBondContact O-CD1 3.26Å; K169-Y244 HydrophobicContact CB-CD2 3.59Å; K169-Y244 HydrophobicContact CB-CE2 3.93Å; K169-Y244 HydrophobicContact CB-CG 4.29Å; K169-Y244 HydrophobicContact CD-CD2 4.45Å; K169-Y244 HydrophobicContact CD-CG 4.36Å; K169-Y244 HydrophobicContact CG-CD2 4.44Å
170	E	86.6	Confident	81.1	Confident	51 Å²	51	44.2 Å²	44.2	24%	0.238	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	125.4	174.8	-171.6	-168.4	136.5	0	0	110.3	A172 R193 T240 R243 Y244	E170-A172 VanDerWaalsContact C-N 3.33Å; E170-R193 IonicContact OE1-CZ 3.59Å; E170-R193 IonicContact OE1-NE 2.88Å; E170-R193 IonicContact OE1-NH2 3.68Å; E170-R193 PolarHBondContact OE1-NH2 2.89Å; E170-R193 IonicContact OE2-CZ 2.69Å; E170-R193 IonicContact OE2-NE 3.18Å; E170-R193 IonicContact OE2-NH2 3.86Å; E170-T240 HydrophobicContact CG-CG2 4.38Å; E170-T240 PolarHBondContact OE1-OG1 3.36Å; E170-R243 WeakPolarHBondContact O-CD 3.07Å; E170-R243 IonicContact OE1-NH2 3.85Å; E170-Y244 WeakPolarHBondContact O-CE2 3.46Å
171	G	83	Confident	80.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	12.1	-175.7	0	0	0	0	0	114.1	K169 F189 R241 R243 Y244	K169-G171 PolarHBondContact O-N 2.89Å; G171-F189 PolarHBondContact N-O 3.38Å; G171-R241 WeakPolarHBondContact CA-O 3.37Å; G171-R243 PolarHBondContact O-N 2.87Å; G171-Y244 PolarHBondContact O-N 3.35Å; G171-Y244 VanDerWaalsContact O-N 3.1Å
172	A	87.1	Confident	79.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	133.8	161.7	0	0	0	0	0	109.7	L164 E167 K169 E170 V188 F189 Y244 V246	L164-A172 HydrophobicContact CD2-CB 4.09Å; L164-A172 WeakPolarHBondContact CD2-O 3.47Å; E167-A172 HydrophobicContact CB-CB 4.4Å; K169-A172 HydrophobicContact CB-CB 4.26Å; K169-A172 WeakPolarHBondContact O-CB 3.36Å; K169-A172 PolarHBondContact O-N 2.82Å; E170-A172 VanDerWaalsContact C-N 3.33Å; A172-V188 CarbonylContact O-C 3.55Å; A172-V188 WeakPolarHBondContact O-CA 3.31Å; A172-V188 WeakPolarHBondContact O-CG2 3.41Å; A172-F189 HydrophobicContact CB-CB 4.14Å; A172-F189 PolarHBondContact O-N 2.83Å; A172-Y244 CarbonylContact C-O 3.52Å; A172-Y244 VanDerWaalsContact CA-O 3.28Å; A172-Y244 WeakPolarHBondContact CA-O 3.49Å; A172-V246 HydrophobicContact CB-CG2 3.77Å
173	F	92.6	Very high	79.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	154.3	-173.2	79.1	-78.4	0	0	0	114.5	W150 I186 S187 V188 I228 Q232 L242 Y244 P245 V246	W150-F173 HydrophobicContact CB-CD2 4.21Å; W150-F173 HydrophobicContact CB-CE2 3.48Å; W150-F173 VanDerWaalsContact CB-CE2 3.48Å; W150-F173 HydrophobicContact CB-CZ 3.77Å; W150-F173 AromaticContact CD1-CZ 3.91Å; W150-F173 HydrophobicContact CD2-CE2 4.32Å; W150-F173 AromaticContact CG-CE2 3.7Å; W150-F173 HydrophobicContact CG-CE2 3.7Å; W150-F173 AromaticContact CG-CZ 3.92Å; W150-F173 HydrophobicContact CG-CZ 3.92Å; F173-I186 HydrophobicContact CD2-CG2 4.41Å; F173-S187 CarbonylContact C-O 3.51Å; F173-S187 VanDerWaalsContact CA-O 3.26Å; F173-S187 WeakPolarHBondContact CA-O 3.42Å; F173-V188 HydrophobicContact CB-CB 4.09Å; F173-V188 HydrophobicContact CB-CG2 4.1Å; F173-I228 HydrophobicContact CE2-CG2 3.64Å; F173-I228 HydrophobicContact CZ-CG2 3.86Å; F173-Q232 HydrophobicContact CZ-CG 4.38Å; F173-L242 HydrophobicContact CB-CD2 3.78Å; F173-L242 HydrophobicContact CD1-CB 3.68Å; F173-L242 HydrophobicContact CD1-CD2 4.36Å; F173-L242 HydrophobicContact CD1-CG 4.47Å; F173-L242 HydrophobicContact CD2-CB 4.32Å; F173-L242 HydrophobicContact CD2-CD1 4.01Å; F173-L242 HydrophobicContact CD2-CD2 4.13Å; F173-L242 HydrophobicContact CD2-CG 4.37Å; F173-L242 HydrophobicContact CE1-CB 3.77Å; F173-L242 HydrophobicContact CE2-CB 4.4Å; F173-L242 HydrophobicContact CE2-CD1 4.07Å; F173-L242 HydrophobicContact CG-CB 3.97Å; F173-L242 HydrophobicContact CG-CD1 4.41Å; F173-L242 HydrophobicContact CG-CD2 3.83Å; F173-L242 HydrophobicContact CG-CG 4.27Å; F173-L242 HydrophobicContact CZ-CB 4.15Å; F173-Y244 VanDerWaalsContact CD1-O 3.28Å; F173-Y244 WeakPolarHBondContact CD1-O 3.29Å; F173-Y244 PolarHBondContact N-O 3.07Å; F173-P245 HydrophobicContact CE1-CB 3.98Å; F173-P245 HydrophobicContact CZ-CB 4.06Å; F173-V246 PolarHBondContact O-N 3.05Å
174	I	90.2	Very high	80.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.4	173.1	-59.6	172.1	0	0	0	108.4	W150 H152 I155 L163 L164 I186 S187 V246	W150-I174 CarbonylContact O-C 3.56Å; W150-I174 WeakPolarHBondContact O-CA 3.37Å; H152-I174 HydrophobicContact CB-CG2 3.78Å; H152-I174 VanDerWaalsContact CD2-CG2 3.46Å; H152-I174 WeakPolarHBondContact CD2-CG2 3.47Å; I155-I174 HydrophobicContact CD1-CD1 4.08Å; I155-I174 HydrophobicContact CD1-CG2 3.8Å; L163-I174 HydrophobicContact CB-CD1 3.84Å; L163-I174 HydrophobicContact CD1-CD1 3.91Å; L164-I174 HydrophobicContact CD2-CD1 4.42Å; L164-I174 HydrophobicContact CD2-CG1 4.22Å; L164-I174 HydrophobicContact CG-CD1 4.12Å; L164-I174 HydrophobicContact CG-CG1 4.38Å; I174-I186 CarbonylContact O-C 3.57Å; I174-I186 WeakPolarHBondContact O-CA 3.37Å; I174-S187 PolarHBondContact N-O 3.08Å; I174-S187 PolarHBondContact O-N 3Å; I174-V246 HydrophobicContact CD1-CB 4.13Å; I174-V246 HydrophobicContact CD1-CG1 4.09Å; I174-V246 HydrophobicContact CG1-CB 3.75Å; I174-V246 HydrophobicContact CG1-CG1 4.27Å
175	V	90.5	Very high	80.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.3	163.4	-170.9	0	0	0	0	108.5	W150 Y151 H152 T185 I186 I205 I228	W150-V175 HydrophobicContact CD2-CG2 4.27Å; W150-V175 HydrophobicContact CE3-CB 3.66Å; W150-V175 HydrophobicContact CE3-CG2 3.37Å; W150-V175 HydrophobicContact CZ3-CB 3.84Å; W150-V175 HydrophobicContact CZ3-CG1 4.32Å; W150-V175 HydrophobicContact CZ3-CG2 3.68Å; W150-V175 PolarHBondContact O-N 2.92Å; Y151-V175 CarbonylContact C-O 3.58Å; Y151-V175 WeakPolarHBondContact CA-O 3.44Å; Y151-V175 HydrophobicContact CD2-CB 4.35Å; Y151-V175 HydrophobicContact CD2-CG1 4.32Å; H152-V175 PolarHBondContact N-O 2.99Å; V175-T185 WeakPolarHBondContact CA-O 3.4Å; V175-I186 HydrophobicContact CG2-CG1 4.3Å; V175-I205 HydrophobicContact CG1-CD1 3.99Å; V175-I228 HydrophobicContact CG2-CD1 3.48Å; V175-I228 VanDerWaalsContact CG2-CD1 3.48Å; V175-I228 HydrophobicContact CG2-CG1 4.01Å
176	R	87.6	Confident	81.3	Confident	6 Å²	6	47.5 Å²	47.5	2%	0.023	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	167.6	-179.1	58.4	172.8	-178	88.1	-6.7	110.4	H152 I155 Y184 T185 S187 E525	H152-R176 WeakPolarHBondContact O-CA 3.38Å; H152-R176 WeakPolarHBondContact O-CB 3.22Å; I155-R176 HydrophobicContact CG1-CB 3.81Å; I155-R176 WeakPolarHBondContact O-CD 3.46Å; R176-Y184 CarbonylContact O-C 3.46Å; R176-Y184 WeakPolarHBondContact O-CA 3.08Å; R176-T185 WeakPolarHBondContact CG-O 3.47Å; R176-T185 PolarHBondContact N-O 3.28Å; R176-T185 PolarHBondContact O-N 3.48Å; R176-S187 PolarHBondContact NE-OG 2.81Å; R176-E525 IonicContact CZ-OE1 2.67Å; R176-E525 IonicContact NH1-OE1 3.42Å; R176-E525 PolarHBondContact NH1-OE1 2.67Å; R176-E525 IonicContact NH2-OE1 3.95Å; R176-E525 PolarHBondContact NH2-OE1 3.4Å; R176-E525 VanDerWaalsContact NH2-OE1 3.11Å
177	D	83.1	Confident	82.1	Confident	46 Å²	46	42.2 Å²	42.2	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	158.3	170.9	-65.2	-15.5	0	0	0	111.2	Y151 R153 Y184	Y151-D177 PolarHBondContact OH-OD1 3.41Å; R153-D177 VanDerWaalsContact CG-OD2 3.27Å; R153-D177 WeakPolarHBondContact CG-OD2 3.45Å; R153-D177 VanDerWaalsContact O-CB 3.26Å; R153-D177 WeakPolarHBondContact O-CB 3.34Å; R153-D177 VanDerWaalsContact O-CG 3.28Å; R153-D177 PolarHBondContact O-N 3.02Å; D177-Y184 WeakPolarHBondContact OD1-CD1 3.49Å; D177-Y184 WeakPolarHBondContact OD1-CE1 3.4Å
178	S	78.4	Confident	82.9	Confident	21 Å²	21	39.7 Å²	39.7	15%	0.147	21%	0.21	C	C	.	.			trans	-115.8	169.2	-179.4	-165.4	0	0	0	0	110.7	H180 S183 T185	S178-H180 PolarHBondContact O-N 2.81Å; S178-S183 WeakPolarHBondContact CB-O 3.5Å; S178-S183 PolarHBondContact N-O 3.41Å; S178-T185 WeakPolarHBondContact CB-OG1 3.29Å; S178-T185 PolarHBondContact OG-OG1 3.35Å
179	R	63.2	Low	83.4	Confident	117 Å²	117	36.3 Å²	36.3	44%	0.442	19%	0.186	S	C	.	.	S	Bend	trans	-49.4	-23.6	177.6	-105.4	178	-66	167.3	0.4	115.5	E522 E525	R179-E522 HydrophobicContact CG-CG 4.13Å; R179-E525 HydrophobicContact CG-CG 4.24Å; R179-E525 IonicContact CZ-OE2 3.71Å; R179-E525 VanDerWaalsContact CZ-OE2 3.23Å; R179-E525 IonicContact NE-OE2 3.82Å; R179-E525 PolarHBondContact NE-OE2 3.1Å; R179-E525 IonicContact NH2-OE2 2.89Å; R179-E525 PolarHBondContact NH2-OE2 2.82Å
180	H	65.8	Low	83.8	Confident	111 Å²	111	32.7 Å²	32.7	51%	0.514	17%	0.171	S	C	.	.	S	Bend	trans	-109.4	129.4	-177.9	-53.6	-60.3	0	0	0	110.3	S178 G182 S183	S178-H180 PolarHBondContact O-N 2.81Å; H180-G182 PolarHBondContact O-N 3.22Å; H180-S183 VanDerWaalsContact O-CB 3.32Å; H180-S183 WeakPolarHBondContact O-CB 3.36Å; H180-S183 PolarHBondContact O-N 3.29Å
181	L	62.8	Low	83.3	Confident	188 Å²	188	31 Å²	31	98%	0.984	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	125.8	174.3	-83.7	150.8	0	0	0	111.2	S183	L181-S183 VanDerWaalsContact C-N 3.31Å; L181-S183 PolarHBondContact O-N 2.77Å
182	G	68.4	Low	82.6	Confident	46 Å²	46	34.2 Å²	34.2	47%	0.474	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	10.1	-177.4	0	0	0	0	0	115.5	H180 W213	H180-G182 PolarHBondContact O-N 3.22Å; G182-W213 WeakPolarHBondContact O-CH2 3.46Å; G182-W213 WeakPolarHBondContact O-CZ3 3.47Å
183	S	81.2	Confident	81.3	Confident	27 Å²	27	41.2 Å²	41.2	19%	0.189	22%	0.22	C	C	.	.			trans	-108.4	147.3	168.4	-59.6	0	0	0	0	110.9	S178 H180 L181	S178-S183 WeakPolarHBondContact CB-O 3.5Å; S178-S183 PolarHBondContact N-O 3.41Å; H180-S183 VanDerWaalsContact O-CB 3.32Å; H180-S183 WeakPolarHBondContact O-CB 3.36Å; H180-S183 PolarHBondContact O-N 3.29Å; L181-S183 VanDerWaalsContact C-N 3.31Å; L181-S183 PolarHBondContact O-N 2.77Å
184	Y	90.1	Very high	79.3	Confident	42 Å²	42	54 Å²	54	17%	0.165	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	164.3	-174.1	-56.3	-87.1	0	0	0	111	L145 Y151 R176 D177 I205 W213 I224	L145-Y184 HydrophobicContact CD1-CD1 3.98Å; L145-Y184 HydrophobicContact CD1-CE1 3.61Å; L145-Y184 HydrophobicContact CD1-CE2 4.46Å; Y151-Y184 AromaticContact CE2-CD1 3.98Å; Y151-Y184 HydrophobicContact CE2-CD1 3.98Å; Y151-Y184 AromaticContact CE2-CE1 3.98Å; Y151-Y184 HydrophobicContact CE2-CE1 3.98Å; R176-Y184 CarbonylContact O-C 3.46Å; R176-Y184 WeakPolarHBondContact O-CA 3.08Å; D177-Y184 WeakPolarHBondContact OD1-CD1 3.49Å; D177-Y184 WeakPolarHBondContact OD1-CE1 3.4Å; Y184-I205 PolarHBondContact O-N 3.1Å; Y184-W213 HydrophobicContact CD2-CH2 4.24Å; Y184-W213 AromaticContact CD2-CZ3 3.99Å; Y184-W213 HydrophobicContact CD2-CZ3 3.99Å; Y184-W213 AromaticContact CE2-CH2 3.79Å; Y184-W213 HydrophobicContact CE2-CH2 3.79Å; Y184-W213 HydrophobicContact CE2-CZ3 4.03Å; Y184-I224 HydrophobicContact CD2-CD1 3.26Å; Y184-I224 HydrophobicContact CE2-CD1 3.4Å; Y184-I224 VanDerWaalsContact CE2-CD1 3.4Å; Y184-I224 HydrophobicContact CG-CD1 3.95Å
185	T	91.7	Very high	77.4	Confident	7 Å²	7	59.5 Å²	59.5	4%	0.043	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	125.3	179.9	-55.3	0	0	0	0	111.3	V175 R176 S178 H202 Y203	V175-T185 WeakPolarHBondContact CA-O 3.4Å; R176-T185 WeakPolarHBondContact CG-O 3.47Å; R176-T185 PolarHBondContact N-O 3.28Å; R176-T185 PolarHBondContact O-N 3.48Å; S178-T185 WeakPolarHBondContact CB-OG1 3.29Å; S178-T185 PolarHBondContact OG-OG1 3.35Å; T185-H202 HydrophobicContact CG2-CB 3.87Å; T185-Y203 CarbonylContact C-O 3.49Å; T185-Y203 WeakPolarHBondContact CA-O 3.38Å
186	I	93.3	Very high	75.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.8	167.6	-44.9	-179.4	0	0	0	108.7	F173 I174 V175 H202 Y203 I205 V215 L227 I228 L242	F173-I186 HydrophobicContact CD2-CG2 4.41Å; I174-I186 CarbonylContact O-C 3.57Å; I174-I186 WeakPolarHBondContact O-CA 3.37Å; V175-I186 HydrophobicContact CG2-CG1 4.3Å; I186-H202 CarbonylContact O-C 3.56Å; I186-H202 WeakPolarHBondContact O-CA 3.22Å; I186-Y203 PolarHBondContact N-O 3.21Å; I186-Y203 PolarHBondContact O-N 3.08Å; I186-I205 HydrophobicContact CD1-CD1 4.2Å; I186-I205 HydrophobicContact CD1-CG1 4.24Å; I186-I205 HydrophobicContact CG1-CD1 3.77Å; I186-I205 HydrophobicContact CG1-CG1 3.78Å; I186-V215 HydrophobicContact CD1-CG2 3.83Å; I186-V215 HydrophobicContact CG1-CG2 4.48Å; I186-L227 HydrophobicContact CD1-CD2 3.84Å; I186-I228 HydrophobicContact CD1-CD1 3.55Å; I186-I228 HydrophobicContact CG1-CD1 4.02Å; I186-L242 HydrophobicContact CD1-CD1 4.48Å; I186-L242 HydrophobicContact CG2-CD1 4.48Å; I186-L242 HydrophobicContact CG2-CD2 4Å
187	S	92.4	Very high	74.8	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121	172.2	-47	0	0	0	0	107.9	F173 I174 R176 H202	F173-S187 CarbonylContact C-O 3.51Å; F173-S187 VanDerWaalsContact CA-O 3.26Å; F173-S187 WeakPolarHBondContact CA-O 3.42Å; I174-S187 PolarHBondContact N-O 3.08Å; I174-S187 PolarHBondContact O-N 3Å; R176-S187 PolarHBondContact NE-OG 2.81Å; S187-H202 PolarHBondContact OG-ND1 2.96Å
188	V	92.6	Very high	74.6	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	135.4	-175.9	61	0	0	0	0	112.7	A172 F173 I200 K201 Y203 T240 L242	A172-V188 CarbonylContact O-C 3.55Å; A172-V188 WeakPolarHBondContact O-CA 3.31Å; A172-V188 WeakPolarHBondContact O-CG2 3.41Å; F173-V188 HydrophobicContact CB-CB 4.09Å; F173-V188 HydrophobicContact CB-CG2 4.1Å; V188-I200 WeakPolarHBondContact O-CA 3.13Å; V188-K201 PolarHBondContact N-O 2.67Å; V188-K201 PolarHBondContact O-N 2.81Å; V188-Y203 HydrophobicContact CG1-CD2 3.99Å; V188-Y203 HydrophobicContact CG1-CE2 3.5Å; V188-Y203 VanDerWaalsContact CG1-CE2 3.5Å; V188-T240 HydrophobicContact CG2-CG2 4.16Å; V188-L242 HydrophobicContact CB-CD2 4.31Å; V188-L242 HydrophobicContact CG2-CD2 4.1Å
189	F	90.8	Very high	74.9	Confident	8 Å²	8	72.4 Å²	72.4	4%	0.035	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.4	177.6	-172.1	-88.9	0	0	0	111.9	L164 R165 K169 G171 A172 A198 I200	L164-F189 HydrophobicContact CB-CB 4.36Å; L164-F189 HydrophobicContact CD2-CB 4.39Å; L164-F189 WeakPolarHBondContact O-CD2 3.33Å; R165-F189 HydrophobicContact CG-CE2 4.27Å; K169-F189 VanDerWaalsContact O-CD1 3.26Å; K169-F189 WeakPolarHBondContact O-CD1 3.26Å; G171-F189 PolarHBondContact N-O 3.38Å; A172-F189 HydrophobicContact CB-CB 4.14Å; A172-F189 PolarHBondContact O-N 2.83Å; F189-A198 HydrophobicContact CE1-CB 4.39Å; F189-A198 HydrophobicContact CE2-CB 4.38Å; F189-A198 HydrophobicContact CZ-CB 3.8Å; F189-I200 HydrophobicContact CB-CG1 4.48Å; F189-I200 HydrophobicContact CD2-CD1 4.19Å; F189-I200 HydrophobicContact CD2-CG1 3.92Å
190	I	87.6	Confident	76.1	Confident	17 Å²	17	67.6 Å²	67.6	9%	0.087	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.3	-179.2	-52.9	176.3	0	0	0	107.7	A198 A199 K201 M239 T240	I190-A198 WeakPolarHBondContact O-CA 3.18Å; I190-A199 WeakPolarHBondContact CA-O 3.32Å; I190-A199 WeakPolarHBondContact CB-O 3.33Å; I190-A199 PolarHBondContact N-O 3.48Å; I190-A199 PolarHBondContact O-N 2.97Å; I190-A199 VanDerWaalsContact O-N 3.07Å; I190-K201 HydrophobicContact CD1-CB 4.06Å; I190-K201 HydrophobicContact CD1-CG 3.46Å; I190-K201 VanDerWaalsContact CD1-CG 3.46Å; I190-M239 HydrophobicContact CD1-CB 3.52Å; I190-M239 HydrophobicContact CD1-CE 3.71Å; I190-M239 HydrophobicContact CD1-CG 3.9Å; I190-M239 HydrophobicContact CG1-CB 4.47Å; I190-T240 HydrophobicContact CG1-CG2 4.47Å
191	G	76.4	Confident	77.3	Confident	16 Å²	16	67.1 Å²	67.1	17%	0.165	36%	0.362	C	S	.	.			trans	-64.1	148.9	177.8	0	0	0	0	0	112.4	R193	G191-R193 PolarHBondContact O-N 2.97Å
192	A	69.3	Low	78.6	Confident	66 Å²	66	60.6 Å²	60.6	55%	0.545	33%	0.326	S	S	.	.			trans	-62.9	114.2	179.4	0	0	0	0	0	111.6	T196 A198	A192-T196 VanDerWaalsContact CA-O 3.29Å; A192-T196 WeakPolarHBondContact CA-O 3.39Å; A192-T196 WeakPolarHBondContact CB-O 3.49Å; A192-A198 HydrophobicContact CB-CB 4.38Å
193	R	59.6	Low	79.7	Confident	148 Å²	148	60.2 Å²	60.2	56%	0.558	31%	0.311	S	S	*	.			trans	-103.3	90.4	179.2	-72.2	-168.7	179.1	-175	5.5	111.5	E170 G191 S195	E170-R193 IonicContact OE1-CZ 3.59Å; E170-R193 IonicContact OE1-NE 2.88Å; E170-R193 IonicContact OE1-NH2 3.68Å; E170-R193 PolarHBondContact OE1-NH2 2.89Å; E170-R193 IonicContact OE2-CZ 2.69Å; E170-R193 IonicContact OE2-NE 3.18Å; E170-R193 IonicContact OE2-NH2 3.86Å; G191-R193 PolarHBondContact O-N 2.97Å; R193-S195 PolarHBondContact O-N 3.47Å
194	R	50.8	Low	80.2	Confident	267 Å²	267	62.5 Å²	62.5	100%	1.008	32%	0.318	S	S	*	.	S	Bend	trans	56.2	-19	168.4	-74.2	-174.2	171.3	176.9	-2.9	119.3
195	S	49.8	Very low	80.2	Confident	116 Å²	116	60.5 Å²	60.5	81%	0.811	31%	0.31	S	S	*	.	S	Bend	trans	-150.3	-1.9	176.3	58.3	0	0	0	0	115.2	R193	R193-S195 PolarHBondContact O-N 3.47Å
196	T	58.1	Low	80.1	Confident	89 Å²	89	64.4 Å²	64.4	55%	0.546	33%	0.327	S	S	.	.	S	Bend	trans	-122.4	143.5	177.5	64.7	0	0	0	0	111.6	A192	A192-T196 VanDerWaalsContact CA-O 3.29Å; A192-T196 WeakPolarHBondContact CA-O 3.39Å; A192-T196 WeakPolarHBondContact CB-O 3.49Å
197	E	66.6	Low	79.9	Confident	179 Å²	179	69.8 Å²	69.8	84%	0.836	35%	0.35	S	S	*	.			trans	-60.6	161.9	172.8	-62.3	-171	153	0	0	113	A199	E197-A199 PolarHBondContact O-N 3.46Å
198	A	76.9	Confident	79.7	Confident	37 Å²	37	71.8 Å²	71.8	31%	0.306	36%	0.361	S	S	.	.			trans	-72.6	117.4	175.4	0	0	0	0	0	110.7	F189 I190 A192	F189-A198 HydrophobicContact CE1-CB 4.39Å; F189-A198 HydrophobicContact CE2-CB 4.38Å; F189-A198 HydrophobicContact CZ-CB 3.8Å; I190-A198 WeakPolarHBondContact O-CA 3.18Å; A192-A198 HydrophobicContact CB-CB 4.38Å
199	A	85.4	Confident	79.4	Confident	39 Å²	39	80.3 Å²	80.3	32%	0.322	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	155.4	-169.8	0	0	0	0	0	111.6	I190 E197	I190-A199 WeakPolarHBondContact CA-O 3.32Å; I190-A199 WeakPolarHBondContact CB-O 3.33Å; I190-A199 PolarHBondContact N-O 3.48Å; I190-A199 PolarHBondContact O-N 2.97Å; I190-A199 VanDerWaalsContact O-N 3.07Å; E197-A199 PolarHBondContact O-N 3.46Å
200	I	89.8	Confident	79.2	Confident	16 Å²	16	84.6 Å²	84.6	8%	0.082	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.6	169	-64.2	175.2	0	0	0	108.4	E161 L164 R165 V188 F189	E161-I200 HydrophobicContact CB-CD1 3.88Å; E161-I200 HydrophobicContact CG-CB 4.13Å; E161-I200 HydrophobicContact CG-CD1 3.74Å; E161-I200 HydrophobicContact CG-CG2 3.99Å; L164-I200 HydrophobicContact CB-CD1 3.53Å; L164-I200 HydrophobicContact CB-CG1 4.4Å; L164-I200 HydrophobicContact CD1-CD1 4.06Å; L164-I200 HydrophobicContact CD1-CG2 3.88Å; L164-I200 HydrophobicContact CG-CD1 4.46Å; R165-I200 HydrophobicContact CG-CD1 3.86Å; V188-I200 WeakPolarHBondContact O-CA 3.13Å; F189-I200 HydrophobicContact CB-CG1 4.48Å; F189-I200 HydrophobicContact CD2-CD1 4.19Å; F189-I200 HydrophobicContact CD2-CG1 3.92Å
201	K	89.9	Confident	79.1	Confident	101 Å²	101	85.2 Å²	85.2	44%	0.439	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.5	173.3	-69.2	-66.5	-176.6	-177.7	0	109.9	V188 I190 Y203	V188-K201 PolarHBondContact N-O 2.67Å; V188-K201 PolarHBondContact O-N 2.81Å; I190-K201 HydrophobicContact CD1-CB 4.06Å; I190-K201 HydrophobicContact CD1-CG 3.46Å; I190-K201 VanDerWaalsContact CD1-CG 3.46Å; K201-Y203 HydrophobicContact CB-CD2 4.26Å; K201-Y203 HydrophobicContact CB-CE2 3.47Å; K201-Y203 VanDerWaalsContact CB-CE2 3.47Å
202	H	90.7	Very high	79.8	Confident	52 Å²	52	86.4 Å²	86.4	24%	0.241	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	121	179.2	-60.8	-89.5	0	0	0	107.7	R157 E161 T185 I186 S187	R157-H202 VanDerWaalsContact CG-CE1 3.44Å; R157-H202 WeakPolarHBondContact CG-CE1 3.36Å; E161-H202 IonicContact OE1-CD2 2.91Å; E161-H202 IonicContact OE1-CE1 3.26Å; E161-H202 IonicContact OE1-NE2 2.68Å; E161-H202 PolarHBondContact OE1-NE2 3.25Å; T185-H202 HydrophobicContact CG2-CB 3.87Å; I186-H202 CarbonylContact O-C 3.56Å; I186-H202 WeakPolarHBondContact O-CA 3.22Å; S187-H202 PolarHBondContact OG-ND1 2.96Å
203	Y	91.4	Very high	80.8	Confident	38 Å²	38	84.8 Å²	84.8	15%	0.149	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.2	-179.2	-60.6	-98.7	0	0	0	109	T185 I186 V188 K201 I205 V215 L238 M239	T185-Y203 CarbonylContact C-O 3.49Å; T185-Y203 WeakPolarHBondContact CA-O 3.38Å; I186-Y203 PolarHBondContact N-O 3.21Å; I186-Y203 PolarHBondContact O-N 3.08Å; V188-Y203 HydrophobicContact CG1-CD2 3.99Å; V188-Y203 HydrophobicContact CG1-CE2 3.5Å; V188-Y203 VanDerWaalsContact CG1-CE2 3.5Å; K201-Y203 HydrophobicContact CB-CD2 4.26Å; K201-Y203 HydrophobicContact CB-CE2 3.47Å; K201-Y203 VanDerWaalsContact CB-CE2 3.47Å; Y203-I205 PolarHBondContact O-N 3.3Å; Y203-V215 HydrophobicContact CD1-CG1 4.04Å; Y203-V215 HydrophobicContact CG-CG1 4.25Å; Y203-L238 HydrophobicContact CD1-CD2 3.54Å; Y203-L238 HydrophobicContact CD2-CD2 3.88Å; Y203-L238 HydrophobicContact CE1-CD2 3.65Å; Y203-L238 HydrophobicContact CE2-CD2 3.99Å; Y203-L238 HydrophobicContact CG-CD2 3.65Å; Y203-M239 WeakPolarHBondContact OH-CB 3.12Å; Y203-M239 WeakPolarHBondContact OH-CG 3.43Å; Y203-M239 PolarHBondContact OH-N 3.17Å
204	Q	90.6	Very high	82.3	Confident	74 Å²	74	79.3 Å²	79.3	35%	0.346	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.1	176.6	-169.1	-178.2	27.6	0	0	109.8	K206	Q204-K206 HydrophobicContact CG-CG 4.21Å; Q204-K206 VanDerWaalsContact OE1-CE 3.32Å
205	I	91.4	Very high	84.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	118.7	164.2	-47.7	-175.6	0	0	0	107	V175 Y184 I186 Y203 W213 Y214 V215 I224 L227	V175-I205 HydrophobicContact CG1-CD1 3.99Å; Y184-I205 PolarHBondContact O-N 3.1Å; I186-I205 HydrophobicContact CD1-CD1 4.2Å; I186-I205 HydrophobicContact CD1-CG1 4.24Å; I186-I205 HydrophobicContact CG1-CD1 3.77Å; I186-I205 HydrophobicContact CG1-CG1 3.78Å; Y203-I205 PolarHBondContact O-N 3.3Å; I205-W213 HydrophobicContact CG2-CB 4.19Å; I205-W213 HydrophobicContact CG2-CE3 4.07Å; I205-Y214 WeakPolarHBondContact CA-O 3.49Å; I205-V215 HydrophobicContact CB-CG2 4.44Å; I205-V215 HydrophobicContact CG1-CG2 3.93Å; I205-I224 HydrophobicContact CD1-CG2 3.87Å; I205-I224 HydrophobicContact CG2-CG1 4.4Å; I205-L227 HydrophobicContact CD1-CD2 4.34Å; I205-L227 HydrophobicContact CG2-CD1 3.74Å
206	K	88.5	Confident	85.7	Confident	89 Å²	89	64 Å²	64	39%	0.387	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	165.7	177.5	-65.3	-176.8	-179.7	-177.5	0	110.4	Q204 W213 Y214	Q204-K206 HydrophobicContact CG-CG 4.21Å; Q204-K206 VanDerWaalsContact OE1-CE 3.32Å; K206-W213 CarbonylContact O-C 3.59Å; K206-W213 WeakPolarHBondContact O-CA 3.36Å; K206-Y214 HydrophobicContact CB-CD1 4.3Å; K206-Y214 HydrophobicContact CB-CD2 4.32Å; K206-Y214 HydrophobicContact CB-CE1 3.76Å; K206-Y214 HydrophobicContact CB-CE2 3.78Å; K206-Y214 VanDerWaalsContact CB-CZ 3.47Å; K206-Y214 HydrophobicContact CD-CE2 3.94Å; K206-Y214 WeakPolarHBondContact CD-OH 3.49Å; K206-Y214 HydrophobicContact CG-CE2 4.4Å; K206-Y214 PolarHBondContact N-O 3Å; K206-Y214 PolarHBondContact O-N 2.75Å
207	K	88.6	Confident	86.8	Confident	114 Å²	114	67.1 Å²	67.1	50%	0.496	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141	173.3	-152	175.9	-170.2	179	0	109	G211 Q212 W213	K207-G211 WeakPolarHBondContact CE-O 3.31Å; K207-Q212 CarbonylContact C-O 3.53Å; K207-Q212 VanDerWaalsContact CA-O 3.26Å; K207-Q212 WeakPolarHBondContact CA-O 3.38Å; K207-W213 HydrophobicContact CB-CE3 4.04Å; K207-W213 HydrophobicContact CB-CZ3 4.01Å; K207-W213 HydrophobicContact CD-CE3 4.41Å; K207-W213 HydrophobicContact CD-CH2 3.83Å; K207-W213 HydrophobicContact CD-CZ2 3.94Å; K207-W213 HydrophobicContact CD-CZ3 4.07Å; K207-W213 HydrophobicContact CG-CD2 4.23Å; K207-W213 HydrophobicContact CG-CE3 4.08Å; K207-W213 HydrophobicContact CG-CH2 4.39Å; K207-W213 HydrophobicContact CG-CZ3 4.16Å
208	N	88.1	Confident	87.5	Confident	42 Å²	42	69.3 Å²	69.3	23%	0.225	35%	0.349	C	S	.	.			trans	-91.4	172	173	74.8	4.6	0	0	0	111.2	S210 G211 Q212 Y214	N208-S210 PolarHBondContact O-N 2.82Å; N208-S210 WeakPolarHBondContact OD1-CA 3.43Å; N208-S210 WeakPolarHBondContact OD1-CB 3.43Å; N208-S210 PolarHBondContact OD1-N 3.46Å; N208-S210 VanDerWaalsContact OD1-N 3.14Å; N208-G211 WeakPolarHBondContact O-CA 3.21Å; N208-G211 PolarHBondContact O-N 2.99Å; N208-G211 PolarHBondContact OD1-N 2.83Å; N208-G211 VanDerWaalsContact OD1-N 3.07Å; N208-Q212 PolarHBondContact N-O 3.42Å; N208-Q212 PolarHBondContact ND2-OE1 3.5Å; N208-Q212 WeakPolarHBondContact OD1-CB 3.4Å; N208-Q212 PolarHBondContact OD1-N 3.05Å; N208-Y214 HydrophobicContact CB-CD1 4.32Å; N208-Y214 HydrophobicContact CB-CE1 3.98Å
209	D	87.1	Confident	88	Confident	178 Å²	178	70.2 Å²	70.2	95%	0.952	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.6	-179.1	-51.1	-50	0	0	0	112.7	G211	D209-G211 PolarHBondContact O-N 3.12Å
210	S	86.7	Confident	88.3	Confident	99 Å²	99	71.3 Å²	71.3	69%	0.692	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	3.3	172.2	-48.1	0	0	0	0	113.8	N208	N208-S210 PolarHBondContact O-N 2.82Å; N208-S210 WeakPolarHBondContact OD1-CA 3.43Å; N208-S210 WeakPolarHBondContact OD1-CB 3.43Å; N208-S210 PolarHBondContact OD1-N 3.46Å; N208-S210 VanDerWaalsContact OD1-N 3.14Å
211	G	85.9	Confident	88.4	Confident	30 Å²	30	71.8 Å²	71.8	31%	0.309	35%	0.351	S	S	.	.	S	Bend	trans	82.3	5.3	176.8	0	0	0	0	0	116	K207 N208 D209	K207-G211 WeakPolarHBondContact CE-O 3.31Å; N208-G211 WeakPolarHBondContact O-CA 3.21Å; N208-G211 PolarHBondContact O-N 2.99Å; N208-G211 PolarHBondContact OD1-N 2.83Å; N208-G211 VanDerWaalsContact OD1-N 3.07Å; D209-G211 PolarHBondContact O-N 3.12Å
212	Q	90.3	Very high	88.4	Confident	40 Å²	40	73 Å²	73	19%	0.187	36%	0.359	C	S	.	.			trans	-87.4	151	-178.3	-54.7	173.8	-62.7	0	0	111.8	K207 N208 V220 F221 Q222	K207-Q212 CarbonylContact C-O 3.53Å; K207-Q212 VanDerWaalsContact CA-O 3.26Å; K207-Q212 WeakPolarHBondContact CA-O 3.38Å; N208-Q212 PolarHBondContact N-O 3.42Å; N208-Q212 PolarHBondContact ND2-OE1 3.5Å; N208-Q212 WeakPolarHBondContact OD1-CB 3.4Å; N208-Q212 PolarHBondContact OD1-N 3.05Å; Q212-V220 HydrophobicContact CB-CB 4.16Å; Q212-F221 CarbonylContact C-O 3.57Å; Q212-F221 WeakPolarHBondContact CA-O 3.32Å; Q212-F221 WeakPolarHBondContact CB-O 3.07Å; Q212-Q222 VanDerWaalsContact NE2-NE2 3.19Å
213	W	90.4	Very high	88.3	Confident	32 Å²	32	71.4 Å²	71.4	12%	0.121	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.5	-177.5	-56.8	96.4	0	0	0	112.2	G182 Y184 I205 K206 K207 V220 F221 I224 L227	G182-W213 WeakPolarHBondContact O-CH2 3.46Å; G182-W213 WeakPolarHBondContact O-CZ3 3.47Å; Y184-W213 HydrophobicContact CD2-CH2 4.24Å; Y184-W213 AromaticContact CD2-CZ3 3.99Å; Y184-W213 HydrophobicContact CD2-CZ3 3.99Å; Y184-W213 AromaticContact CE2-CH2 3.79Å; Y184-W213 HydrophobicContact CE2-CH2 3.79Å; Y184-W213 HydrophobicContact CE2-CZ3 4.03Å; I205-W213 HydrophobicContact CG2-CB 4.19Å; I205-W213 HydrophobicContact CG2-CE3 4.07Å; K206-W213 CarbonylContact O-C 3.59Å; K206-W213 WeakPolarHBondContact O-CA 3.36Å; K207-W213 HydrophobicContact CB-CE3 4.04Å; K207-W213 HydrophobicContact CB-CZ3 4.01Å; K207-W213 HydrophobicContact CD-CE3 4.41Å; K207-W213 HydrophobicContact CD-CH2 3.83Å; K207-W213 HydrophobicContact CD-CZ2 3.94Å; K207-W213 HydrophobicContact CD-CZ3 4.07Å; K207-W213 HydrophobicContact CG-CD2 4.23Å; K207-W213 HydrophobicContact CG-CE3 4.08Å; K207-W213 HydrophobicContact CG-CH2 4.39Å; K207-W213 HydrophobicContact CG-CZ3 4.16Å; W213-V220 CarbonylContact O-C 3.48Å; W213-V220 WeakPolarHBondContact O-CA 3.47Å; W213-F221 PolarHBondContact N-O 2.81Å; W213-F221 PolarHBondContact O-N 3.14Å; W213-I224 HydrophobicContact CB-CG1 4.23Å; W213-I224 HydrophobicContact CD2-CD1 3.94Å; W213-I224 HydrophobicContact CD2-CG1 3.75Å; W213-I224 HydrophobicContact CE3-CD1 4.04Å; W213-I224 HydrophobicContact CE3-CG1 4.19Å; W213-I224 HydrophobicContact CG-CD1 4.47Å; W213-I224 HydrophobicContact CG-CG1 3.76Å; W213-I224 HydrophobicContact CH2-CD1 4.3Å; W213-I224 HydrophobicContact CZ2-CD1 4.22Å; W213-I224 HydrophobicContact CZ3-CD1 4.22Å; W213-L227 HydrophobicContact CB-CD1 4.06Å
214	Y	90.6	Very high	88.2	Confident	33 Å²	33	69.9 Å²	69.9	13%	0.129	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	157.4	175.9	67.1	-86.4	0	0	0	112.9	I205 K206 N208 E217 H219 V220	I205-Y214 WeakPolarHBondContact CA-O 3.49Å; K206-Y214 HydrophobicContact CB-CD1 4.3Å; K206-Y214 HydrophobicContact CB-CD2 4.32Å; K206-Y214 HydrophobicContact CB-CE1 3.76Å; K206-Y214 HydrophobicContact CB-CE2 3.78Å; K206-Y214 VanDerWaalsContact CB-CZ 3.47Å; K206-Y214 HydrophobicContact CD-CE2 3.94Å; K206-Y214 WeakPolarHBondContact CD-OH 3.49Å; K206-Y214 HydrophobicContact CG-CE2 4.4Å; K206-Y214 PolarHBondContact N-O 3Å; K206-Y214 PolarHBondContact O-N 2.75Å; N208-Y214 HydrophobicContact CB-CD1 4.32Å; N208-Y214 HydrophobicContact CB-CE1 3.98Å; Y214-E217 HydrophobicContact CD2-CG 4.07Å; Y214-E217 HydrophobicContact CE2-CG 3.55Å; Y214-H219 VanDerWaalsContact CB-O 3.24Å; Y214-H219 WeakPolarHBondContact CB-O 3.38Å; Y214-V220 HydrophobicContact CD1-CG1 4.45Å
215	V	89.3	Confident	88.1	Confident	23 Å²	23	67.1 Å²	67.1	14%	0.139	34%	0.336	C	S	.	.	S	Bend	trans	-109.6	-31.5	164.3	168.3	0	0	0	0	111.3	I186 Y203 I205 L227 L238	I186-V215 HydrophobicContact CD1-CG2 3.83Å; I186-V215 HydrophobicContact CG1-CG2 4.48Å; Y203-V215 HydrophobicContact CD1-CG1 4.04Å; Y203-V215 HydrophobicContact CG-CG1 4.25Å; I205-V215 HydrophobicContact CB-CG2 4.44Å; I205-V215 HydrophobicContact CG1-CG2 3.93Å; V215-L227 HydrophobicContact CG2-CD1 4.34Å; V215-L227 HydrophobicContact CG2-CD2 4.05Å; V215-L238 HydrophobicContact CG1-CD2 3.86Å
216	T	83	Confident	87.9	Confident	40 Å²	40	71 Å²	71	25%	0.245	35%	0.354	C	S	.	.	S	Bend	trans	-126.1	137.8	166.5	65.5	0	0	0	0	108.6	R218 H219 A236	T216-R218 PolarHBondContact O-N 3.21Å; T216-H219 PolarHBondContact O-N 3.16Å; T216-H219 PolarHBondContact OG1-ND1 3.4Å; T216-A236 PolarHBondContact OG1-O 2.64Å
217	E	80.6	Confident	88.1	Confident	153 Å²	153	66.8 Å²	66.8	72%	0.715	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-14	-173.9	-67.5	159.5	-161.3	0	0	113.8	Y214 H219	Y214-E217 HydrophobicContact CD2-CG 4.07Å; Y214-E217 HydrophobicContact CE2-CG 3.55Å; E217-H219 VanDerWaalsContact C-N 3.33Å
218	R	82.8	Confident	88.2	Confident	226 Å²	226	61.4 Å²	61.4	85%	0.853	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-16.6	174.9	-61.3	-177.1	-177.9	-174	0	114.1	T216	T216-R218 PolarHBondContact O-N 3.21Å
219	H	86.9	Confident	88.1	Confident	55 Å²	55	66.9 Å²	66.9	26%	0.255	33%	0.33	S	S	.	.			trans	-137.5	104.3	-175.1	-53.7	105.2	0	0	0	110.1	Y214 T216 E217 F221 Y230 A236	Y214-H219 VanDerWaalsContact CB-O 3.24Å; Y214-H219 WeakPolarHBondContact CB-O 3.38Å; T216-H219 PolarHBondContact O-N 3.16Å; T216-H219 PolarHBondContact OG1-ND1 3.4Å; E217-H219 VanDerWaalsContact C-N 3.33Å; H219-F221 HydrophobicContact CB-CE2 3.81Å; H219-F221 HydrophobicContact CB-CZ 3.82Å; H219-F221 VanDerWaalsContact O-CE2 3.28Å; H219-F221 WeakPolarHBondContact O-CE2 3.43Å; H219-Y230 PolarHBondContact NE2-OH 2.75Å; H219-A236 PolarHBondContact ND1-O 2.91Å
220	V	91.7	Very high	88.3	Confident	62 Å²	62	61.1 Å²	61.1	38%	0.376	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	145.2	179.6	-65.2	0	0	0	0	110.9	Q212 W213 Y214	Q212-V220 HydrophobicContact CB-CB 4.16Å; W213-V220 CarbonylContact O-C 3.48Å; W213-V220 WeakPolarHBondContact O-CA 3.47Å; Y214-V220 HydrophobicContact CD1-CG1 4.45Å
221	F	91.5	Very high	88.5	Confident	26 Å²	26	56.4 Å²	56.4	11%	0.114	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.3	-172.6	-54.5	-85.1	0	0	0	110.8	Q212 W213 H219 S223 E226 L227 Y230	Q212-F221 CarbonylContact C-O 3.57Å; Q212-F221 WeakPolarHBondContact CA-O 3.32Å; Q212-F221 WeakPolarHBondContact CB-O 3.07Å; W213-F221 PolarHBondContact N-O 2.81Å; W213-F221 PolarHBondContact O-N 3.14Å; H219-F221 HydrophobicContact CB-CE2 3.81Å; H219-F221 HydrophobicContact CB-CZ 3.82Å; H219-F221 VanDerWaalsContact O-CE2 3.28Å; H219-F221 WeakPolarHBondContact O-CE2 3.43Å; F221-S223 VanDerWaalsContact C-N 3.34Å; F221-E226 HydrophobicContact CB-CB 4.06Å; F221-E226 HydrophobicContact CD1-CB 4.16Å; F221-E226 HydrophobicContact CG-CB 4.47Å; F221-L227 HydrophobicContact CB-CB 4.03Å; F221-L227 HydrophobicContact CD2-CB 3.51Å; F221-L227 HydrophobicContact CD2-CD1 3.83Å; F221-L227 HydrophobicContact CD2-CG 3.58Å; F221-L227 HydrophobicContact CE2-CB 4.11Å; F221-L227 HydrophobicContact CE2-CD1 4.37Å; F221-L227 HydrophobicContact CE2-CG 3.87Å; F221-L227 HydrophobicContact CG-CB 3.76Å; F221-L227 HydrophobicContact CG-CG 4.35Å; F221-Y230 VanDerWaalsContact CE1-CB 3.46Å; F221-Y230 AromaticContact CE1-CD1 3.91Å; F221-Y230 HydrophobicContact CE1-CD1 3.91Å; F221-Y230 HydrophobicContact CE1-CD2 4.12Å; F221-Y230 AromaticContact CE1-CG 3.56Å; F221-Y230 HydrophobicContact CE1-CG 3.56Å; F221-Y230 HydrophobicContact CE2-CD1 4.43Å; F221-Y230 AromaticContact CZ-CD1 3.38Å; F221-Y230 HydrophobicContact CZ-CD1 3.38Å; F221-Y230 HydrophobicContact CZ-CD2 4.36Å; F221-Y230 HydrophobicContact CZ-CE1 4.02Å; F221-Y230 AromaticContact CZ-CG 3.57Å; F221-Y230 HydrophobicContact CZ-CG 3.57Å
222	Q	89.7	Confident	88.5	Confident	128 Å²	128	57.3 Å²	57.3	60%	0.598	26%	0.258	S	S	*	.	S	Bend	trans	-76.4	-27.7	179	-57.5	-62.7	-10.8	0	0	111.5	Q212 E226	Q212-Q222 VanDerWaalsContact NE2-NE2 3.19Å; Q222-E226 WeakPolarHBondContact CB-OE2 3.46Å; Q222-E226 PolarHBondContact N-OE2 3.48Å
223	S	88	Confident	88.1	Confident	18 Å²	18	59.4 Å²	59.4	13%	0.126	27%	0.268	C	S	.	.	S	Bend	trans	-136	156.7	178.5	73.8	0	0	0	0	113.1	F221 E226 L227	F221-S223 VanDerWaalsContact C-N 3.34Å; S223-E226 VanDerWaalsContact CB-OE1 3.3Å; S223-E226 WeakPolarHBondContact CB-OE1 3.45Å; S223-E226 PolarHBondContact N-OE1 3.47Å; S223-E226 PolarHBondContact N-OE2 3.42Å; S223-E226 WeakPolarHBondContact O-CB 3.46Å; S223-E226 PolarHBondContact O-N 3.39Å; S223-E226 WeakPolarHBondContact OG-CG 3.41Å; S223-E226 PolarHBondContact OG-N 3.01Å; S223-E226 PolarHBondContact OG-OE1 3.06Å; S223-L227 PolarHBondContact O-N 3.11Å
224	I	89.7	Confident	87.8	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-37.8	174.7	-66.6	164.8	0	0	0	111.6	L145 W150 Y184 I205 W213 E226 L227 I228	L145-I224 HydrophobicContact CD1-CD1 3.92Å; L145-I224 HydrophobicContact CD1-CG2 4.34Å; L145-I224 HydrophobicContact CD2-CB 4.05Å; L145-I224 HydrophobicContact CD2-CG2 4.25Å; W150-I224 HydrophobicContact CH2-CG2 4.12Å; W150-I224 HydrophobicContact CZ3-CG2 4.33Å; Y184-I224 HydrophobicContact CD2-CD1 3.26Å; Y184-I224 HydrophobicContact CE2-CD1 3.4Å; Y184-I224 VanDerWaalsContact CE2-CD1 3.4Å; Y184-I224 HydrophobicContact CG-CD1 3.95Å; I205-I224 HydrophobicContact CD1-CG2 3.87Å; I205-I224 HydrophobicContact CG2-CG1 4.4Å; W213-I224 HydrophobicContact CB-CG1 4.23Å; W213-I224 HydrophobicContact CD2-CD1 3.94Å; W213-I224 HydrophobicContact CD2-CG1 3.75Å; W213-I224 HydrophobicContact CE3-CD1 4.04Å; W213-I224 HydrophobicContact CE3-CG1 4.19Å; W213-I224 HydrophobicContact CG-CD1 4.47Å; W213-I224 HydrophobicContact CG-CG1 3.76Å; W213-I224 HydrophobicContact CH2-CD1 4.3Å; W213-I224 HydrophobicContact CZ2-CD1 4.22Å; W213-I224 HydrophobicContact CZ3-CD1 4.22Å; I224-E226 PolarHBondContact O-N 2.96Å; I224-L227 WeakPolarHBondContact O-CB 3.32Å; I224-L227 PolarHBondContact O-N 2.93Å; I224-I228 HydrophobicContact CG2-CG1 4.25Å; I224-I228 WeakPolarHBondContact O-CG1 3.15Å; I224-I228 PolarHBondContact O-N 3.13Å
225	P	89.1	Confident	87.3	Confident	16 Å²	16	61.3 Å²	61.3	10%	0.104	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-39.6	171.3	-29.5	38.7	0	0	0	114.6	L145 Y148 W150 I228 W229	L145-P225 HydrophobicContact CD2-CG 4.15Å; Y148-P225 HydrophobicContact CD2-CG 4.17Å; Y148-P225 HydrophobicContact CE1-CB 4.19Å; Y148-P225 HydrophobicContact CE1-CG 4.41Å; Y148-P225 HydrophobicContact CE2-CB 3.99Å; Y148-P225 HydrophobicContact CE2-CG 3.31Å; Y148-P225 VanDerWaalsContact CZ-CG 3.46Å; Y148-P225 WeakPolarHBondContact OH-CB 3.16Å; Y148-P225 WeakPolarHBondContact OH-CG 3.49Å; W150-P225 HydrophobicContact CH2-CG 4.38Å; W150-P225 HydrophobicContact CZ2-CB 4.46Å; W150-P225 HydrophobicContact CZ2-CG 4.46Å; P225-I228 PolarHBondContact O-N 3.2Å; P225-W229 VanDerWaalsContact O-CB 3.27Å; P225-W229 WeakPolarHBondContact O-CB 3.34Å; P225-W229 PolarHBondContact O-N 3.23Å
226	E	87.7	Confident	86.9	Confident	81 Å²	81	61.6 Å²	61.6	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-45.5	172.1	-75	151.9	-125.8	0	0	111.8	F221 Q222 S223 I224 I228 W229 Y230	F221-E226 HydrophobicContact CB-CB 4.06Å; F221-E226 HydrophobicContact CD1-CB 4.16Å; F221-E226 HydrophobicContact CG-CB 4.47Å; Q222-E226 WeakPolarHBondContact CB-OE2 3.46Å; Q222-E226 PolarHBondContact N-OE2 3.48Å; S223-E226 VanDerWaalsContact CB-OE1 3.3Å; S223-E226 WeakPolarHBondContact CB-OE1 3.45Å; S223-E226 PolarHBondContact N-OE1 3.47Å; S223-E226 PolarHBondContact N-OE2 3.42Å; S223-E226 WeakPolarHBondContact O-CB 3.46Å; S223-E226 PolarHBondContact O-N 3.39Å; S223-E226 WeakPolarHBondContact OG-CG 3.41Å; S223-E226 PolarHBondContact OG-N 3.01Å; S223-E226 PolarHBondContact OG-OE1 3.06Å; I224-E226 PolarHBondContact O-N 2.96Å; E226-I228 PolarHBondContact O-N 3.43Å; E226-W229 PolarHBondContact O-N 2.85Å; E226-Y230 WeakPolarHBondContact O-CB 3.44Å; E226-Y230 PolarHBondContact O-N 2.72Å
227	L	92.2	Very high	86.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-46.8	178.3	-176.8	159.6	0	0	0	111.1	I186 I205 W213 V215 F221 S223 I224 H231	I186-L227 HydrophobicContact CD1-CD2 3.84Å; I205-L227 HydrophobicContact CD1-CD2 4.34Å; I205-L227 HydrophobicContact CG2-CD1 3.74Å; W213-L227 HydrophobicContact CB-CD1 4.06Å; V215-L227 HydrophobicContact CG2-CD1 4.34Å; V215-L227 HydrophobicContact CG2-CD2 4.05Å; F221-L227 HydrophobicContact CB-CB 4.03Å; F221-L227 HydrophobicContact CD2-CB 3.51Å; F221-L227 HydrophobicContact CD2-CD1 3.83Å; F221-L227 HydrophobicContact CD2-CG 3.58Å; F221-L227 HydrophobicContact CE2-CB 4.11Å; F221-L227 HydrophobicContact CE2-CD1 4.37Å; F221-L227 HydrophobicContact CE2-CG 3.87Å; F221-L227 HydrophobicContact CG-CB 3.76Å; F221-L227 HydrophobicContact CG-CG 4.35Å; S223-L227 PolarHBondContact O-N 3.11Å; I224-L227 WeakPolarHBondContact O-CB 3.32Å; I224-L227 PolarHBondContact O-N 2.93Å; L227-H231 WeakPolarHBondContact O-CB 3.46Å; L227-H231 PolarHBondContact O-CD2 3.03Å; L227-H231 VanDerWaalsContact O-CD2 3.3Å; L227-H231 PolarHBondContact O-N 3.43Å
228	I	91.6	Very high	86.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-44.9	177.5	-63.8	-60	0	0	0	111	W150 F173 V175 I186 I224 P225 E226 Y230 H231 Q232 L242	W150-I228 HydrophobicContact CD2-CG2 4.13Å; W150-I228 HydrophobicContact CE3-CG1 4.39Å; W150-I228 HydrophobicContact CG-CG2 4.41Å; W150-I228 HydrophobicContact CH2-CB 4.41Å; W150-I228 HydrophobicContact CH2-CG1 3.92Å; W150-I228 HydrophobicContact CZ2-CB 4.03Å; W150-I228 HydrophobicContact CZ2-CG1 4.03Å; W150-I228 HydrophobicContact CZ2-CG2 4.09Å; W150-I228 HydrophobicContact CZ3-CG1 4.1Å; F173-I228 HydrophobicContact CE2-CG2 3.64Å; F173-I228 HydrophobicContact CZ-CG2 3.86Å; V175-I228 HydrophobicContact CG2-CD1 3.48Å; V175-I228 VanDerWaalsContact CG2-CD1 3.48Å; V175-I228 HydrophobicContact CG2-CG1 4.01Å; I186-I228 HydrophobicContact CD1-CD1 3.55Å; I186-I228 HydrophobicContact CG1-CD1 4.02Å; I224-I228 HydrophobicContact CG2-CG1 4.25Å; I224-I228 WeakPolarHBondContact O-CG1 3.15Å; I224-I228 PolarHBondContact O-N 3.13Å; P225-I228 PolarHBondContact O-N 3.2Å; E226-I228 PolarHBondContact O-N 3.43Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.13Å; I228-H231 CarbonylContact O-C 3.48Å; I228-H231 PolarHBondContact O-N 3.32Å; I228-Q232 HydrophobicContact CG2-CG 4.44Å; I228-Q232 WeakPolarHBondContact O-CG 3.37Å; I228-Q232 PolarHBondContact O-N 3.28Å; I228-L242 HydrophobicContact CD1-CD1 3.81Å; I228-L242 HydrophobicContact CG2-CD1 4.15Å
229	W	86.1	Confident	86.9	Confident	158 Å²	158	50.4 Å²	50.4	60%	0.598	26%	0.264	S	S	*	.	H	α-helix	trans	-60.5	-42.1	177.2	-177.4	89.4	0	0	0	111.9	P225 E226 Q232 H233	P225-W229 VanDerWaalsContact O-CB 3.27Å; P225-W229 WeakPolarHBondContact O-CB 3.34Å; P225-W229 PolarHBondContact O-N 3.23Å; E226-W229 PolarHBondContact O-N 2.85Å; W229-Q232 WeakPolarHBondContact O-CB 3.39Å; W229-Q232 PolarHBondContact O-N 2.93Å; W229-H233 AromaticContact CD2-ND1 3.91Å; W229-H233 AromaticContact CE2-CE1 3.54Å; W229-H233 AromaticContact CE2-ND1 3.76Å; W229-H233 AromaticContact CZ2-CE1 3.79Å; W229-H233 AromaticContact NE1-CE1 3.55Å; W229-H233 PolarHBondContact O-N 3.23Å; W229-H233 PolarHBondContact O-ND1 3.49Å
230	Y	90.3	Very high	86.8	Confident	57 Å²	57	48.2 Å²	48.2	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-44.5	174.4	176.6	-93.4	0	0	0	111.7	H219 F221 E226 I228 Q232 H233 N234 A236	H219-Y230 PolarHBondContact NE2-OH 2.75Å; F221-Y230 VanDerWaalsContact CE1-CB 3.46Å; F221-Y230 AromaticContact CE1-CD1 3.91Å; F221-Y230 HydrophobicContact CE1-CD1 3.91Å; F221-Y230 HydrophobicContact CE1-CD2 4.12Å; F221-Y230 AromaticContact CE1-CG 3.56Å; F221-Y230 HydrophobicContact CE1-CG 3.56Å; F221-Y230 HydrophobicContact CE2-CD1 4.43Å; F221-Y230 AromaticContact CZ-CD1 3.38Å; F221-Y230 HydrophobicContact CZ-CD1 3.38Å; F221-Y230 HydrophobicContact CZ-CD2 4.36Å; F221-Y230 HydrophobicContact CZ-CE1 4.02Å; F221-Y230 AromaticContact CZ-CG 3.57Å; F221-Y230 HydrophobicContact CZ-CG 3.57Å; E226-Y230 WeakPolarHBondContact O-CB 3.44Å; E226-Y230 PolarHBondContact O-N 2.72Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.13Å; Y230-Q232 VanDerWaalsContact C-N 3.29Å; Y230-Q232 PolarHBondContact O-N 3.31Å; Y230-H233 CarbonylContact O-C 3.54Å; Y230-H233 PolarHBondContact O-N 2.71Å; Y230-N234 HydrophobicContact CD1-CB 4.41Å; Y230-N234 HydrophobicContact CE1-CB 3.93Å; Y230-N234 HydrophobicContact CE2-CB 4.29Å; Y230-N234 VanDerWaalsContact CE2-ND2 3.33Å; Y230-N234 WeakPolarHBondContact CE2-ND2 3.44Å; Y230-N234 PolarHBondContact O-N 2.75Å; Y230-N234 PolarHBondContact O-ND2 2.87Å; Y230-A236 HydrophobicContact CE1-CB 3.48Å; Y230-A236 VanDerWaalsContact CE1-CB 3.48Å
231	H	90.4	Very high	86.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-74.8	-14.2	179.1	-80.6	-63.4	0	0	0	114.6	L227 I228 N234 A235 L238 L242	L227-H231 WeakPolarHBondContact O-CB 3.46Å; L227-H231 PolarHBondContact O-CD2 3.03Å; L227-H231 VanDerWaalsContact O-CD2 3.3Å; L227-H231 PolarHBondContact O-N 3.43Å; I228-H231 CarbonylContact O-C 3.48Å; I228-H231 PolarHBondContact O-N 3.32Å; H231-N234 CarbonylContact C-O 3.57Å; H231-N234 VanDerWaalsContact CA-O 3.28Å; H231-N234 WeakPolarHBondContact CA-O 3.34Å; H231-N234 PolarHBondContact ND1-O 2.93Å; H231-A235 PolarHBondContact ND1-O 3.26Å; H231-L238 HydrophobicContact CB-CD1 3.8Å; H231-L242 HydrophobicContact CB-CD1 3.65Å; H231-L242 HydrophobicContact CB-CG 3.99Å; H231-L242 PolarHBondContact O-N 3.26Å
232	Q	85.6	Confident	86.5	Confident	48 Å²	48	49.4 Å²	49.4	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-69.7	-34.9	164.1	-74.8	171.8	-26.6	0	0	111.9	F173 I228 W229 Y230 R241 L242	F173-Q232 HydrophobicContact CZ-CG 4.38Å; I228-Q232 HydrophobicContact CG2-CG 4.44Å; I228-Q232 WeakPolarHBondContact O-CG 3.37Å; I228-Q232 PolarHBondContact O-N 3.28Å; W229-Q232 WeakPolarHBondContact O-CB 3.39Å; W229-Q232 PolarHBondContact O-N 2.93Å; Y230-Q232 VanDerWaalsContact C-N 3.29Å; Y230-Q232 PolarHBondContact O-N 3.31Å; Q232-R241 PolarHBondContact O-NE 2.86Å; Q232-R241 PolarHBondContact O-NH2 2.65Å; Q232-L242 WeakPolarHBondContact CA-O 2.98Å; Q232-L242 HydrophobicContact CG-CB 3.85Å
233	H	83.4	Confident	86.2	Confident	85 Å²	85	49.3 Å²	49.3	39%	0.394	25%	0.246	S	C	.	.	H	α-helix	trans	-88.1	-29.8	179.4	-66.9	86.3	0	0	0	113.2	W229 Y230 R241	W229-H233 AromaticContact CD2-ND1 3.91Å; W229-H233 AromaticContact CE2-CE1 3.54Å; W229-H233 AromaticContact CE2-ND1 3.76Å; W229-H233 AromaticContact CZ2-CE1 3.79Å; W229-H233 AromaticContact NE1-CE1 3.55Å; W229-H233 PolarHBondContact O-N 3.23Å; W229-H233 PolarHBondContact O-ND1 3.49Å; Y230-H233 CarbonylContact O-C 3.54Å; Y230-H233 PolarHBondContact O-N 2.71Å; H233-R241 WeakPolarHBondContact O-CD 3.22Å; H233-R241 PolarHBondContact O-NE 2.97Å; H233-R241 VanDerWaalsContact O-NE 3.09Å; H233-R241 PolarHBondContact O-NH1 3.12Å; H233-R241 VanDerWaalsContact O-NH1 3.14Å
234	N	84	Confident	85.9	Confident	67 Å²	67	53.7 Å²	53.7	36%	0.358	26%	0.26	S	S	.	.			trans	-135.8	133.2	-170.9	-56.8	-75.7	0	0	0	112.1	Y230 H231 A236	Y230-N234 HydrophobicContact CD1-CB 4.41Å; Y230-N234 HydrophobicContact CE1-CB 3.93Å; Y230-N234 HydrophobicContact CE2-CB 4.29Å; Y230-N234 VanDerWaalsContact CE2-ND2 3.33Å; Y230-N234 WeakPolarHBondContact CE2-ND2 3.44Å; Y230-N234 PolarHBondContact O-N 2.75Å; Y230-N234 PolarHBondContact O-ND2 2.87Å; H231-N234 CarbonylContact C-O 3.57Å; H231-N234 VanDerWaalsContact CA-O 3.28Å; H231-N234 WeakPolarHBondContact CA-O 3.34Å; H231-N234 PolarHBondContact ND1-O 2.93Å; N234-A236 HydrophobicContact CB-CB 3.99Å
235	A	79.5	Confident	85.4	Confident	38 Å²	38	55.5 Å²	55.5	31%	0.314	27%	0.273	S	S	.	.			trans	-66.3	-49.2	175.1	0	0	0	0	0	110.8	H231 G237 L238 R241	H231-A235 PolarHBondContact ND1-O 3.26Å; A235-G237 PolarHBondContact O-N 3.5Å; A235-L238 WeakPolarHBondContact O-CB 3.26Å; A235-L238 PolarHBondContact O-N 3.28Å; A235-R241 HydrophobicContact CB-CG 4.18Å
236	A	80.6	Confident	84.7	Confident	29 Å²	29	54.9 Å²	54.9	24%	0.24	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	34.9	163.6	0	0	0	0	0	116.4	T216 H219 Y230 N234	T216-A236 PolarHBondContact OG1-O 2.64Å; H219-A236 PolarHBondContact ND1-O 2.91Å; Y230-A236 HydrophobicContact CE1-CB 3.48Å; Y230-A236 VanDerWaalsContact CE1-CB 3.48Å; N234-A236 HydrophobicContact CB-CB 3.99Å
237	G	76.4	Confident	83.5	Confident	56 Å²	56	51.8 Å²	51.8	58%	0.577	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	117	-19.5	-178.3	0	0	0	0	0	114.2	A235	A235-G237 PolarHBondContact O-N 3.5Å
238	L	86.2	Confident	81.7	Confident	10 Å²	10	57.1 Å²	57.1	5%	0.052	29%	0.286	C	S	.	.	S	Bend	trans	-77.1	148.1	166.6	-54.4	-179.1	0	0	0	110.7	Y203 V215 H231 A235 T240 L242	Y203-L238 HydrophobicContact CD1-CD2 3.54Å; Y203-L238 HydrophobicContact CD2-CD2 3.88Å; Y203-L238 HydrophobicContact CE1-CD2 3.65Å; Y203-L238 HydrophobicContact CE2-CD2 3.99Å; Y203-L238 HydrophobicContact CG-CD2 3.65Å; V215-L238 HydrophobicContact CG1-CD2 3.86Å; H231-L238 HydrophobicContact CB-CD1 3.8Å; A235-L238 WeakPolarHBondContact O-CB 3.26Å; A235-L238 PolarHBondContact O-N 3.28Å; L238-T240 WeakPolarHBondContact CB-O 3.27Å; L238-T240 PolarHBondContact O-N 2.82Å; L238-L242 HydrophobicContact CD1-CD1 4.45Å; L238-L242 HydrophobicContact CD1-CD2 3.86Å; L238-L242 HydrophobicContact CD1-CG 4Å
239	M	83.8	Confident	79.2	Confident	118 Å²	118	60.1 Å²	60.1	58%	0.581	30%	0.301	S	S	*	.	S	Bend	trans	-60.6	-25.7	175	-69.7	-98.7	-68	0	0	114	I190 Y203	I190-M239 HydrophobicContact CD1-CB 3.52Å; I190-M239 HydrophobicContact CD1-CE 3.71Å; I190-M239 HydrophobicContact CD1-CG 3.9Å; I190-M239 HydrophobicContact CG1-CB 4.47Å; Y203-M239 WeakPolarHBondContact OH-CB 3.12Å; Y203-M239 WeakPolarHBondContact OH-CG 3.43Å; Y203-M239 PolarHBondContact OH-N 3.17Å
240	T	85.6	Confident	76.8	Confident	8 Å²	8	55.4 Å²	55.4	5%	0.049	30%	0.302	C	S	.	.	S	Bend	trans	-151.9	164	172.8	-164.9	0	0	0	0	109.7	E170 V188 I190 L238	E170-T240 HydrophobicContact CG-CG2 4.38Å; E170-T240 PolarHBondContact OE1-OG1 3.36Å; V188-T240 HydrophobicContact CG2-CG2 4.16Å; I190-T240 HydrophobicContact CG1-CG2 4.47Å; L238-T240 WeakPolarHBondContact CB-O 3.27Å; L238-T240 PolarHBondContact O-N 2.82Å
241	R	87.8	Confident	74.2	Confident	111 Å²	111	58.8 Å²	58.8	42%	0.419	33%	0.334	S	S	.	.			trans	-68.8	149.8	174.1	-81.5	172.5	57.2	173.1	-3.3	110.6	G171 Q232 H233 A235 R243	G171-R241 WeakPolarHBondContact CA-O 3.37Å; Q232-R241 PolarHBondContact O-NE 2.86Å; Q232-R241 PolarHBondContact O-NH2 2.65Å; H233-R241 WeakPolarHBondContact O-CD 3.22Å; H233-R241 PolarHBondContact O-NE 2.97Å; H233-R241 VanDerWaalsContact O-NE 3.09Å; H233-R241 PolarHBondContact O-NH1 3.12Å; H233-R241 VanDerWaalsContact O-NH1 3.14Å; A235-R241 HydrophobicContact CB-CG 4.18Å; R241-R243 HydrophobicContact CB-CG 4.45Å; R241-R243 PolarHBondContact O-N 3.41Å
242	L	88.8	Confident	71.6	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	36%	0.357	C	S	.	.			trans	-72.3	115.3	168.3	-52.5	-178.4	0	0	0	107.9	F173 I186 V188 I228 H231 Q232 L238	F173-L242 HydrophobicContact CB-CD2 3.78Å; F173-L242 HydrophobicContact CD1-CB 3.68Å; F173-L242 HydrophobicContact CD1-CD2 4.36Å; F173-L242 HydrophobicContact CD1-CG 4.47Å; F173-L242 HydrophobicContact CD2-CB 4.32Å; F173-L242 HydrophobicContact CD2-CD1 4.01Å; F173-L242 HydrophobicContact CD2-CD2 4.13Å; F173-L242 HydrophobicContact CD2-CG 4.37Å; F173-L242 HydrophobicContact CE1-CB 3.77Å; F173-L242 HydrophobicContact CE2-CB 4.4Å; F173-L242 HydrophobicContact CE2-CD1 4.07Å; F173-L242 HydrophobicContact CG-CB 3.97Å; F173-L242 HydrophobicContact CG-CD1 4.41Å; F173-L242 HydrophobicContact CG-CD2 3.83Å; F173-L242 HydrophobicContact CG-CG 4.27Å; F173-L242 HydrophobicContact CZ-CB 4.15Å; I186-L242 HydrophobicContact CD1-CD1 4.48Å; I186-L242 HydrophobicContact CG2-CD1 4.48Å; I186-L242 HydrophobicContact CG2-CD2 4Å; V188-L242 HydrophobicContact CB-CD2 4.31Å; V188-L242 HydrophobicContact CG2-CD2 4.1Å; I228-L242 HydrophobicContact CD1-CD1 3.81Å; I228-L242 HydrophobicContact CG2-CD1 4.15Å; H231-L242 HydrophobicContact CB-CD1 3.65Å; H231-L242 HydrophobicContact CB-CG 3.99Å; H231-L242 PolarHBondContact O-N 3.26Å; Q232-L242 WeakPolarHBondContact CA-O 2.98Å; Q232-L242 HydrophobicContact CG-CB 3.85Å; L238-L242 HydrophobicContact CD1-CD1 4.45Å; L238-L242 HydrophobicContact CD1-CD2 3.86Å; L238-L242 HydrophobicContact CD1-CG 4Å
243	R	83	Confident	69.6	Low	127 Å²	127	64.2 Å²	64.2	48%	0.479	37%	0.369	S	S	.	.			trans	-114.4	-46.7	-172.7	-63.3	-170.9	-164.4	-132.2	9	113.1	E170 G171 R241	E170-R243 WeakPolarHBondContact O-CD 3.07Å; E170-R243 IonicContact OE1-NH2 3.85Å; G171-R243 PolarHBondContact O-N 2.87Å; R241-R243 HydrophobicContact CB-CG 4.45Å; R241-R243 PolarHBondContact O-N 3.41Å
244	Y	81.3	Confident	67.7	Low	109 Å²	109	61.8 Å²	61.8	43%	0.427	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	105.6	-171.9	-52	-73.5	0	0	0	108.5	K169 E170 G171 A172 F173 V246	K169-Y244 HydrophobicContact CB-CD2 3.59Å; K169-Y244 HydrophobicContact CB-CE2 3.93Å; K169-Y244 HydrophobicContact CB-CG 4.29Å; K169-Y244 HydrophobicContact CD-CD2 4.45Å; K169-Y244 HydrophobicContact CD-CG 4.36Å; K169-Y244 HydrophobicContact CG-CD2 4.44Å; E170-Y244 WeakPolarHBondContact O-CE2 3.46Å; G171-Y244 PolarHBondContact O-N 3.35Å; G171-Y244 VanDerWaalsContact O-N 3.1Å; A172-Y244 CarbonylContact C-O 3.52Å; A172-Y244 VanDerWaalsContact CA-O 3.28Å; A172-Y244 WeakPolarHBondContact CA-O 3.49Å; F173-Y244 VanDerWaalsContact CD1-O 3.28Å; F173-Y244 WeakPolarHBondContact CD1-O 3.29Å; F173-Y244 PolarHBondContact N-O 3.07Å; Y244-V246 PolarHBondContact O-N 2.73Å
245	P	81.2	Confident	66.1	Low	45 Å²	45	59.3 Å²	59.3	29%	0.292	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	124.6	171	29.1	-33.3	0	0	0	107.6	W150 F173 G247	W150-P245 HydrophobicContact CB-CB 3.8Å; W150-P245 HydrophobicContact CG-CB 4.48Å; F173-P245 HydrophobicContact CE1-CB 3.98Å; F173-P245 HydrophobicContact CZ-CB 4.06Å; P245-G247 PolarHBondContact O-N 2.96Å
246	V	74.2	Confident	64.7	Low	3 Å²	3	57.5 Å²	57.5	2%	0.018	33%	0.334	C	S	.	.			trans	-91.1	105.7	174.9	179	0	0	0	0	107.4	H152 L163 L164 E167 A172 F173 I174 Y244	H152-V246 PolarHBondContact NE2-O 3.22Å; L163-V246 HydrophobicContact CB-CG1 4.31Å; L164-V246 HydrophobicContact CD2-CG2 3.93Å; E167-V246 HydrophobicContact CB-CG2 4.13Å; E167-V246 HydrophobicContact CG-CB 4.35Å; E167-V246 HydrophobicContact CG-CG1 3.75Å; E167-V246 HydrophobicContact CG-CG2 3.76Å; A172-V246 HydrophobicContact CB-CG2 3.77Å; F173-V246 PolarHBondContact O-N 3.05Å; I174-V246 HydrophobicContact CD1-CB 4.13Å; I174-V246 HydrophobicContact CD1-CG1 4.09Å; I174-V246 HydrophobicContact CG1-CB 3.75Å; I174-V246 HydrophobicContact CG1-CG1 4.27Å; Y244-V246 PolarHBondContact O-N 2.73Å
247	G	61.9	Low	63	Low	16 Å²	16	56.8 Å²	56.8	17%	0.165	33%	0.328	C	S	.	.			trans	-66.2	177.5	169	0	0	0	0	0	112.2	E149 H152 P245 M249	E149-G247 WeakPolarHBondContact O-CA 3.43Å; H152-G247 VanDerWaalsContact CE1-C 3.44Å; H152-G247 PolarHBondContact CE1-O 3.28Å; P245-G247 PolarHBondContact O-N 2.96Å; G247-M249 PolarHBondContact O-N 3.49Å
248	L	54.6	Low	61.8	Low	112 Å²	112	55.2 Å²	55.2	59%	0.586	31%	0.312	S	S	*	.	S	Bend	trans	-56.5	129.3	158.3	-79.2	112.1	0	0	0	108.1	H152	H152-L248 PolarHBondContact CE1-N 2.89Å
249	M	39.5	Very low	59.9	Low	63 Å²	63	56.1 Å²	56.1	31%	0.31	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-58.2	145.4	176.9	-84.6	-156.8	152.7	0	0	110.5	L163 Q166 E167 G247	L163-M249 HydrophobicContact CD2-CB 4.45Å; L163-M249 HydrophobicContact CD2-CG 4.13Å; Q166-M249 HydrophobicContact CB-CE 3.48Å; Q166-M249 VanDerWaalsContact CB-CE 3.48Å; Q166-M249 HydrophobicContact CB-SD 3.84Å; Q166-M249 HydrophobicContact CG-SD 4.48Å; E167-M249 HydrophobicContact CG-CE 3.95Å; E167-M249 WeakPolarHBondContact OE1-CE 3.39Å; G247-M249 PolarHBondContact O-N 3.49Å
250	G	35.6	Very low	57.8	Low	60 Å²	60	51.4 Å²	51.4	62%	0.619	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	157.5	-157.5	0	0	0	0	0	116.2	C252	G250-C252 PolarHBondContact O-N 3.25Å
251	S	34.7	Very low	55.6	Low	127 Å²	127	56.4 Å²	56.4	89%	0.888	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	17.1	161.3	48.4	0	0	0	0	118.9
252	C	37.1	Very low	53.3	Low	73 Å²	73	58.6 Å²	58.6	49%	0.493	33%	0.329	S	S	.	.			trans	-99.6	77.4	151.7	-63.9	0	0	0	0	109.4	G250	G250-C252 PolarHBondContact O-N 3.25Å
253	L	42.2	Very low	51.5	Low	89 Å²	89	63.9 Å²	63.9	47%	0.466	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-55.5	134	166.4	-75.9	177.3	0	0	0	108.6	Y91 Y136 A255	Y91-L253 HydrophobicContact CG-CD2 4.34Å; Y136-L253 HydrophobicContact CE1-CD2 4.09Å; L253-A255 PolarHBondContact O-N 3.14Å
254	P	44.4	Very low	50.7	Low	35 Å²	35	62.5 Å²	62.5	23%	0.227	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-61.1	133.6	175.3	26.7	-33	0	0	0	108.8	Y91 Y136 T256	Y91-P254 HydrophobicContact CD2-CG 3.74Å; Y91-P254 HydrophobicContact CE2-CG 3.5Å; Y91-P254 HydrophobicContact CG-CG 4.42Å; Y136-P254 HydrophobicContact CD2-CG 4.18Å; Y136-P254 HydrophobicContact CE2-CG 3.81Å; Y136-P254 WeakPolarHBondContact CE2-O 3.24Å; Y136-P254 VanDerWaalsContact CZ-O 3.27Å; Y136-P254 PolarHBondContact OH-O 3.4Å; P254-T256 PolarHBondContact O-N 3.17Å
255	A	49.6	Very low	50.3	Low	14 Å²	14	60 Å²	60	12%	0.116	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-55.7	127.1	179	0	0	0	0	0	110.4	N135 L253 A257 Q328 Y330	N135-A255 PolarHBondContact ND2-O 3.47Å; L253-A255 PolarHBondContact O-N 3.14Å; A255-A257 PolarHBondContact O-N 3.27Å; A255-Q328 HydrophobicContact CB-CB 3.61Å; A255-Q328 HydrophobicContact CB-CG 3.58Å; A255-Y330 HydrophobicContact CB-CE1 3.89Å
256	T	50.3	Low	50.1	Low	1 Å²	1	58.3 Å²	58.3	1%	0.006	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-70.8	128	171.4	51.4	0	0	0	0	108.5	F93 P133 Y136 P254 G258 F259	F93-T256 HydrophobicContact CE2-CG2 4.37Å; P133-T256 HydrophobicContact CB-CG2 3.66Å; P133-T256 HydrophobicContact CG-CG2 3.79Å; Y136-T256 HydrophobicContact CD2-CG2 4.27Å; Y136-T256 HydrophobicContact CE2-CG2 3.48Å; Y136-T256 VanDerWaalsContact CE2-CG2 3.48Å; P254-T256 PolarHBondContact O-N 3.17Å; T256-G258 PolarHBondContact O-N 2.88Å; T256-F259 WeakPolarHBondContact OG1-CD1 3.38Å; T256-F259 WeakPolarHBondContact OG1-CE1 3.05Å; T256-F259 WeakPolarHBondContact OG1-CZ 3.43Å
257	A	44.7	Very low	50.3	Low	13 Å²	13	60.8 Å²	60.8	11%	0.107	34%	0.34	C	S	.	.	S	Bend	trans	-72.9	95.2	-177.5	0	0	0	0	0	110.7	H118 W119 A255 S322	H118-A257 HydrophobicContact CB-CB 3.93Å; H118-A257 WeakPolarHBondContact ND1-CB 3.23Å; W119-A257 PolarHBondContact NE1-O 3.22Å; A255-A257 PolarHBondContact O-N 3.27Å; A257-S322 WeakPolarHBondContact CB-OG 3.47Å
258	G	50.5	Low	51.4	Low	24 Å²	24	61.5 Å²	61.5	25%	0.247	34%	0.342	C	S	.	.	S	Bend	trans	70.2	131.3	-163.4	0	0	0	0	0	111.2	W119 T256 S260	W119-G258 VanDerWaalsContact CZ2-O 3.24Å; W119-G258 WeakPolarHBondContact CZ2-O 3.43Å; W119-G258 PolarHBondContact NE1-O 3.41Å; T256-G258 PolarHBondContact O-N 2.88Å; G258-S260 VanDerWaalsContact C-N 3.32Å; G258-S260 PolarHBondContact O-N 2.78Å
259	F	46.3	Very low	52.7	Low	28 Å²	28	61 Å²	61	12%	0.123	35%	0.348	C	S	.	.	S	Bend	trans	-84.3	-1	-178.7	-83	-80.3	0	0	0	114.6	T256 W290 Y330	T256-F259 WeakPolarHBondContact OG1-CD1 3.38Å; T256-F259 WeakPolarHBondContact OG1-CE1 3.05Å; T256-F259 WeakPolarHBondContact OG1-CZ 3.43Å; F259-W290 HydrophobicContact CB-CH2 3.73Å; F259-W290 HydrophobicContact CB-CZ3 4Å; F259-W290 HydrophobicContact CD1-CZ3 4.4Å; F259-W290 HydrophobicContact CD2-CE3 4.37Å; F259-W290 AromaticContact CD2-CH2 3.96Å; F259-W290 HydrophobicContact CD2-CH2 3.96Å; F259-W290 AromaticContact CD2-CZ3 3.37Å; F259-W290 HydrophobicContact CD2-CZ3 3.37Å; F259-W290 AromaticContact CE2-CZ3 3.83Å; F259-W290 HydrophobicContact CE2-CZ3 3.83Å; F259-W290 AromaticContact CG-CH2 3.95Å; F259-W290 HydrophobicContact CG-CH2 3.95Å; F259-W290 AromaticContact CG-CZ3 3.68Å; F259-W290 HydrophobicContact CG-CZ3 3.68Å; F259-Y330 HydrophobicContact CD2-CD1 4.13Å; F259-Y330 HydrophobicContact CD2-CG 4.28Å; F259-Y330 AromaticContact CE2-CD1 3.49Å; F259-Y330 HydrophobicContact CE2-CD1 3.49Å; F259-Y330 VanDerWaalsContact CE2-CD1 3.49Å; F259-Y330 HydrophobicContact CE2-CD2 4.27Å; F259-Y330 AromaticContact CE2-CE1 3.67Å; F259-Y330 HydrophobicContact CE2-CE1 3.67Å; F259-Y330 HydrophobicContact CE2-CE2 4.43Å; F259-Y330 AromaticContact CE2-CG 3.79Å; F259-Y330 HydrophobicContact CE2-CG 3.79Å; F259-Y330 HydrophobicContact CZ-CD1 4.47Å; F259-Y330 HydrophobicContact CZ-CE1 4.24Å
260	S	40.8	Very low	54.7	Low	20 Å²	20	60.1 Å²	60.1	14%	0.14	34%	0.343	C	S	.	.	S	Bend	trans	-146.8	164.4	174.6	78.1	0	0	0	0	111.2	E97 G258 K263	E97-S260 VanDerWaalsContact OE1-CB 3.23Å; E97-S260 WeakPolarHBondContact OE1-CB 3.43Å; E97-S260 WeakPolarHBondContact OE2-CB 3.27Å; G258-S260 VanDerWaalsContact C-N 3.32Å; G258-S260 PolarHBondContact O-N 2.78Å; S260-K263 WeakPolarHBondContact OG-CA 3.49Å; S260-K263 WeakPolarHBondContact OG-CB 3.23Å; S260-K263 PolarHBondContact OG-N 3.41Å; S260-K263 PolarHBondContact OG-O 3.44Å
261	Y	38.4	Very low	57.1	Low	112 Å²	112	58 Å²	58	44%	0.439	32%	0.317	S	S	.	.	S	Bend	trans	-73.3	-28.2	-178.9	173.5	-111.8	0	0	0	114	Y115 L131	Y115-Y261 HydrophobicContact CD2-CE2 4.4Å; Y115-Y261 HydrophobicContact CG-CE2 4.38Å; L131-Y261 HydrophobicContact CD1-CG 4.18Å
262	E	39.9	Very low	59.7	Low	158 Å²	158	54 Å²	54	74%	0.738	29%	0.292	S	S	*	.	S	Bend	trans	-130.5	-18.9	-171	-82.1	169.1	-175.5	0	0	114.8
263	K	51.3	Low	62.4	Low	112 Å²	112	54.6 Å²	54.6	49%	0.487	29%	0.287	S	S	.	.			trans	-113.3	91.5	-170.9	-154.6	-173.3	-179.4	-167.8	0	111.9	S260 E265	S260-K263 WeakPolarHBondContact OG-CA 3.49Å; S260-K263 WeakPolarHBondContact OG-CB 3.23Å; S260-K263 PolarHBondContact OG-N 3.41Å; S260-K263 PolarHBondContact OG-O 3.44Å; K263-E265 VanDerWaalsContact CE-O 3.31Å; K263-E265 WeakPolarHBondContact CE-O 2.87Å; K263-E265 WeakPolarHBondContact CG-O 3.29Å
264	W	67.3	Low	64.8	Low	99 Å²	99	54.5 Å²	54.5	38%	0.375	29%	0.286	S	S	.	.			trans	-87.3	-14.7	169.3	53.4	-91	0	0	0	112.9	M319 G331 V332 T334	W264-M319 HydrophobicContact CB-CE 3.63Å; W264-M319 HydrophobicContact CB-SD 4.11Å; W264-M319 HydrophobicContact CD2-CE 4.42Å; W264-M319 HydrophobicContact CD2-SD 4.34Å; W264-M319 HydrophobicContact CG-CE 3.63Å; W264-M319 HydrophobicContact CG-SD 4.07Å; W264-G331 VanDerWaalsContact O-CA 3.28Å; W264-G331 WeakPolarHBondContact O-CA 3.44Å; W264-V332 HydrophobicContact CE3-CG2 3.48Å; W264-V332 VanDerWaalsContact CE3-CG2 3.48Å; W264-V332 HydrophobicContact CZ3-CG2 3.55Å; W264-V332 PolarHBondContact O-N 3.18Å; W264-T334 HydrophobicContact CH2-CG2 4.5Å; W264-T334 HydrophobicContact CZ3-CG2 4.03Å
265	E	72.3	Confident	67.1	Low	57 Å²	57	59.4 Å²	59.4	27%	0.266	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-78.8	114.7	169.9	-64.6	-164.6	156.1	0	0	110.7	K263 V332 T334 Q335	K263-E265 VanDerWaalsContact CE-O 3.31Å; K263-E265 WeakPolarHBondContact CE-O 2.87Å; K263-E265 WeakPolarHBondContact CG-O 3.29Å; E265-V332 CarbonylContact C-O 3.57Å; E265-V332 WeakPolarHBondContact CA-O 3.44Å; E265-T334 WeakPolarHBondContact CG-OG1 3.38Å; E265-T334 PolarHBondContact OE1-OG1 3.17Å; E265-Q335 PolarHBondContact OE2-NE2 3.38Å
266	I	77.7	Confident	69.3	Low	8 Å²	8	63.2 Å²	63.2	4%	0.041	32%	0.319	C	S	.	.			trans	-85.4	132.6	170.2	-66.2	171	0	0	0	108.1	E270 L271 W290 V332 C333 V342	I266-E270 HydrophobicContact CG2-CB 4.38Å; I266-L271 HydrophobicContact CG2-CD1 4.07Å; I266-L271 HydrophobicContact CG2-CD2 4.22Å; I266-L271 HydrophobicContact CG2-CG 3.93Å; I266-W290 HydrophobicContact CD1-CD2 4.44Å; I266-W290 HydrophobicContact CD1-CZ2 4.42Å; I266-W290 HydrophobicContact CG1-CZ2 4.3Å; I266-V332 PolarHBondContact N-O 2.96Å; I266-C333 PolarHBondContact O-SG 3.32Å; I266-V342 HydrophobicContact CD1-CB 3.85Å; I266-V342 HydrophobicContact CD1-CG1 4.05Å; I266-V342 HydrophobicContact CD1-CG2 3.93Å
267	D	77.9	Confident	71.2	Confident	55 Å²	55	66.8 Å²	66.8	29%	0.294	34%	0.337	S	S	.	.			trans	-72.1	126.7	170.6	-173.9	-51.5	0	0	0	108.8	S269 E270	D267-S269 VanDerWaalsContact CG-OG 3.3Å; D267-S269 PolarHBondContact O-N 2.56Å; D267-S269 VanDerWaalsContact OD1-CB 3.3Å; D267-S269 WeakPolarHBondContact OD1-CB 3.44Å; D267-S269 PolarHBondContact OD1-N 3.29Å; D267-S269 PolarHBondContact OD1-OG 2.98Å; D267-E270 HydrophobicContact CB-CG 4.22Å; D267-E270 WeakPolarHBondContact O-CB 3.47Å; D267-E270 PolarHBondContact O-N 3.45Å
268	P	83.6	Confident	73	Confident	31 Å²	31	67.6 Å²	67.6	20%	0.201	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-56.4	-23.5	-179.2	-27.4	35.9	0	0	0	114.8	E270 L271 C333	P268-E270 PolarHBondContact O-N 2.7Å; P268-L271 PolarHBondContact O-N 3Å; P268-C333 HydrophobicContact CG-CB 4.18Å
269	S	83.5	Confident	74.6	Confident	103 Å²	103	69.3 Å²	69.3	72%	0.72	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-70.6	-15.6	174.9	66.4	0	0	0	0	114	D267 L271	D267-S269 VanDerWaalsContact CG-OG 3.3Å; D267-S269 PolarHBondContact O-N 2.56Å; D267-S269 VanDerWaalsContact OD1-CB 3.3Å; D267-S269 WeakPolarHBondContact OD1-CB 3.44Å; D267-S269 PolarHBondContact OD1-N 3.29Å; D267-S269 PolarHBondContact OD1-OG 2.98Å; S269-L271 VanDerWaalsContact C-N 3.29Å
270	E	79.9	Confident	75.8	Confident	44 Å²	44	70 Å²	70	21%	0.206	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-81.1	-6.2	171.4	-60.3	-178.6	-174.6	0	0	112.9	I266 D267 P268 W290 R291	I266-E270 HydrophobicContact CG2-CB 4.38Å; D267-E270 HydrophobicContact CB-CG 4.22Å; D267-E270 WeakPolarHBondContact O-CB 3.47Å; D267-E270 PolarHBondContact O-N 3.45Å; P268-E270 PolarHBondContact O-N 2.7Å; E270-W290 WeakPolarHBondContact O-CA 3.11Å; E270-W290 PolarHBondContact OE2-NE1 3.35Å; E270-R291 HydrophobicContact CB-CG 4.17Å; E270-R291 VanDerWaalsContact CD-NE 3.35Å; E270-R291 VanDerWaalsContact CD-NH2 3.27Å; E270-R291 HydrophobicContact CG-CG 4.44Å; E270-R291 PolarHBondContact O-N 3.39Å; E270-R291 IonicContact OE1-CZ 2.81Å; E270-R291 IonicContact OE1-NE 2.67Å; E270-R291 IonicContact OE1-NH2 3.57Å; E270-R291 PolarHBondContact OE1-NH2 2.82Å; E270-R291 IonicContact OE2-CZ 3.15Å; E270-R291 VanDerWaalsContact OE2-CZ 3.26Å; E270-R291 IonicContact OE2-NE 3.92Å; E270-R291 PolarHBondContact OE2-NE 3.41Å; E270-R291 IonicContact OE2-NH2 2.75Å; E270-R291 PolarHBondContact OE2-NH2 3.31Å
271	L	87	Confident	77.1	Confident	14 Å²	14	75 Å²	75	7%	0.073	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.6	-175.4	-65	172.6	0	0	0	112.4	I266 P268 S269 F273 W290 V296 I298 V342	I266-L271 HydrophobicContact CG2-CD1 4.07Å; I266-L271 HydrophobicContact CG2-CD2 4.22Å; I266-L271 HydrophobicContact CG2-CG 3.93Å; P268-L271 PolarHBondContact O-N 3Å; S269-L271 VanDerWaalsContact C-N 3.29Å; L271-F273 HydrophobicContact CB-CE2 4.34Å; L271-W290 HydrophobicContact CD2-CB 3.85Å; L271-W290 HydrophobicContact CD2-CG 3.98Å; L271-V296 HydrophobicContact CD2-CG2 4.35Å; L271-I298 HydrophobicContact CB-CD1 4.17Å; L271-I298 HydrophobicContact CD1-CD1 4.38Å; L271-I298 HydrophobicContact CD2-CD1 4.06Å; L271-I298 HydrophobicContact CG-CD1 4.45Å; L271-V342 HydrophobicContact CD1-CG2 3.88Å; L271-V342 HydrophobicContact CD2-CG1 4.24Å; L271-V342 HydrophobicContact CD2-CG2 4.2Å
272	A	89.5	Confident	78.6	Confident	45 Å²	45	72.3 Å²	72.3	37%	0.372	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.9	168.9	0	0	0	0	0	110.4	G288 E289	A272-G288 CarbonylContact O-C 3.54Å; A272-G288 WeakPolarHBondContact O-CA 3.28Å; A272-E289 HydrophobicContact CB-CB 4.4Å; A272-E289 PolarHBondContact N-O 3.06Å; A272-E289 PolarHBondContact O-N 3.23Å
273	F	93.1	Very high	80.5	Confident	85 Å²	85	65.1 Å²	65.1	37%	0.373	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.8	175.7	-69.9	-104	0	0	0	109.8	L271 H286 I298 Y340	L271-F273 HydrophobicContact CB-CE2 4.34Å; F273-H286 HydrophobicContact CD1-CB 3.88Å; F273-H286 AromaticContact CD1-CG 3.75Å; F273-H286 HydrophobicContact CE1-CB 4.41Å; F273-I298 HydrophobicContact CD1-CD1 4.26Å; F273-I298 HydrophobicContact CE1-CB 4.2Å; F273-I298 HydrophobicContact CE1-CD1 4.08Å; F273-I298 HydrophobicContact CE1-CG2 3.75Å; F273-I298 HydrophobicContact CE2-CD1 4.41Å; F273-I298 HydrophobicContact CZ-CD1 4.15Å; F273-I298 HydrophobicContact CZ-CG2 3.87Å; F273-Y340 HydrophobicContact CE1-CD1 4.47Å; F273-Y340 HydrophobicContact CE1-CE1 4.06Å; F273-Y340 HydrophobicContact CZ-CD1 4.1Å; F273-Y340 HydrophobicContact CZ-CD2 4.46Å; F273-Y340 AromaticContact CZ-CE1 3.65Å; F273-Y340 HydrophobicContact CZ-CE1 3.65Å; F273-Y340 HydrophobicContact CZ-CE2 4.07Å; F273-Y340 AromaticContact CZ-CZ 3.67Å
274	I	92.8	Very high	82.2	Confident	87 Å²	87	61.4 Å²	61.4	45%	0.446	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-48.5	-174.8	-62.1	170.1	0	0	0	111.1	L287 E289	I274-L287 WeakPolarHBondContact CA-O 3.37Å; I274-L287 HydrophobicContact CB-CG 4.35Å; I274-L287 WeakPolarHBondContact CB-O 3.38Å; I274-L287 HydrophobicContact CD1-CG 4.47Å; I274-L287 HydrophobicContact CG2-CD2 4.46Å; I274-L287 PolarHBondContact N-O 2.98Å; I274-E289 HydrophobicContact CD1-CB 4.14Å; I274-E289 HydrophobicContact CD1-CG 3.74Å
275	K	93.7	Very high	83.4	Confident	138 Å²	138	58.9 Å²	58.9	60%	0.6	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162.3	140.7	-174.5	-165.4	-154.9	167.6	-171.1	0	112	I277 H286 L287	K275-I277 PolarHBondContact O-N 2.65Å; K275-H286 CarbonylContact O-C 3.56Å; K275-H286 VanDerWaalsContact O-CA 3.24Å; K275-H286 WeakPolarHBondContact O-CA 3.41Å; K275-L287 PolarHBondContact N-O 2.91Å; K275-L287 VanDerWaalsContact N-O 3.12Å; K275-L287 PolarHBondContact O-N 2.67Å
276	E	94.1	Very high	84.4	Confident	94 Å²	94	58.2 Å²	58.2	44%	0.439	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	131.2	161.1	-177.2	177.5	164.8	0	0	110.2	S279 V284	E276-S279 VanDerWaalsContact OE1-CB 3.29Å; E276-S279 WeakPolarHBondContact OE1-CB 3.46Å; E276-S279 PolarHBondContact OE1-OG 3.2Å; E276-V284 HydrophobicContact CG-CG1 3.63Å
277	I	90.3	Very high	85.2	Confident	76 Å²	76	59 Å²	59	39%	0.39	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-12.5	176.2	57.5	173.5	0	0	0	113.1	K275 V285 L287 F345	K275-I277 PolarHBondContact O-N 2.65Å; I277-V285 HydrophobicContact CD1-CG1 3.96Å; I277-V285 HydrophobicContact CG1-CB 4.22Å; I277-V285 HydrophobicContact CG1-CG1 3.95Å; I277-V285 VanDerWaalsContact CG1-O 3.26Å; I277-V285 WeakPolarHBondContact CG1-O 3.48Å; I277-V285 PolarHBondContact N-O 2.86Å; I277-L287 HydrophobicContact CD1-CB 4.41Å; I277-L287 HydrophobicContact CG2-CB 3.73Å; I277-F345 HydrophobicContact CD1-CD2 4.1Å; I277-F345 HydrophobicContact CD1-CE2 3.74Å
278	G	84.2	Confident	85.9	Confident	29 Å²	29	56.4 Å²	56.4	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	161.6	168.9	0	0	0	0	0	112.9	V285	G278-V285 PolarHBondContact N-O 3.49Å; G278-V285 PolarHBondContact O-N 2.8Å
279	S	82.6	Confident	85.9	Confident	60 Å²	60	57.9 Å²	57.9	42%	0.42	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.9	178.3	28.4	0	0	0	0	110.4	E276	E276-S279 VanDerWaalsContact OE1-CB 3.29Å; E276-S279 WeakPolarHBondContact OE1-CB 3.46Å; E276-S279 PolarHBondContact OE1-OG 3.2Å
280	G	71.6	Confident	85.7	Confident	42 Å²	42	53.5 Å²	53.5	43%	0.433	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	-173.5	-172.1	0	0	0	0	0	113.2	F282 G283	G280-F282 VanDerWaalsContact C-N 3.26Å; G280-F282 PolarHBondContact O-N 3.14Å; G280-G283 PolarHBondContact N-O 2.86Å; G280-G283 PolarHBondContact O-N 2.68Å
281	Q	68.9	Low	85.2	Confident	125 Å²	125	56 Å²	56	58%	0.584	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-36.9	-172.3	-169.8	-176.4	-95.9	0	0	113.3
282	F	69.1	Low	84.3	Confident	56 Å²	56	59.4 Å²	59.4	25%	0.246	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.9	-173.4	-52.4	-67.1	0	0	0	114.1	G280 I301 N302 S305 M306	G280-F282 VanDerWaalsContact C-N 3.26Å; G280-F282 PolarHBondContact O-N 3.14Å; F282-I301 WeakPolarHBondContact O-CA 3.47Å; F282-N302 PolarHBondContact O-N 2.74Å; F282-S305 PolarHBondContact O-OG 2.81Å; F282-M306 HydrophobicContact CD1-CE 4.28Å
283	G	80.2	Confident	83.3	Confident	7 Å²	7	65.3 Å²	65.3	7%	0.072	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.4	-174.3	-170.7	0	0	0	0	0	116.5	G280 A300	G280-G283 PolarHBondContact N-O 2.86Å; G280-G283 PolarHBondContact O-N 2.68Å; G283-A300 CarbonylContact C-O 3.46Å; G283-A300 WeakPolarHBondContact CA-O 3.47Å
284	V	87.8	Confident	82.3	Confident	34 Å²	34	62.3 Å²	62.3	21%	0.206	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.4	173.8	-173.7	0	0	0	0	109.1	E276 H286 A300	E276-V284 HydrophobicContact CG-CG1 3.63Å; V284-H286 VanDerWaalsContact CG1-CE1 3.46Å; V284-H286 WeakPolarHBondContact CG1-CE1 3.31Å; V284-H286 PolarHBondContact O-ND1 2.74Å; V284-A300 PolarHBondContact N-O 2.75Å; V284-A300 WeakPolarHBondContact O-CB 3.39Å; V284-A300 PolarHBondContact O-N 3.1Å
285	V	91.4	Very high	81.9	Confident	46 Å²	46	63 Å²	63	28%	0.279	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.5	179	-168.2	0	0	0	0	109.5	I277 G278 A297 I298 K299	I277-V285 HydrophobicContact CD1-CG1 3.96Å; I277-V285 HydrophobicContact CG1-CB 4.22Å; I277-V285 HydrophobicContact CG1-CG1 3.95Å; I277-V285 VanDerWaalsContact CG1-O 3.26Å; I277-V285 WeakPolarHBondContact CG1-O 3.48Å; I277-V285 PolarHBondContact N-O 2.86Å; G278-V285 PolarHBondContact N-O 3.49Å; G278-V285 PolarHBondContact O-N 2.8Å; V285-A297 HydrophobicContact CG1-CB 4.27Å; V285-I298 WeakPolarHBondContact CA-O 3.33Å; V285-K299 HydrophobicContact CG2-CB 4.3Å; V285-K299 HydrophobicContact CG2-CG 4.38Å
286	H	93.8	Very high	81.7	Confident	43 Å²	43	56.5 Å²	56.5	20%	0.199	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.4	176.8	-59.3	80.1	0	0	0	110.7	F273 K275 V284 A297 I298	F273-H286 HydrophobicContact CD1-CB 3.88Å; F273-H286 AromaticContact CD1-CG 3.75Å; F273-H286 HydrophobicContact CE1-CB 4.41Å; K275-H286 CarbonylContact O-C 3.56Å; K275-H286 VanDerWaalsContact O-CA 3.24Å; K275-H286 WeakPolarHBondContact O-CA 3.41Å; V284-H286 VanDerWaalsContact CG1-CE1 3.46Å; V284-H286 WeakPolarHBondContact CG1-CE1 3.31Å; V284-H286 PolarHBondContact O-ND1 2.74Å; H286-A297 CarbonylContact O-C 3.54Å; H286-A297 WeakPolarHBondContact O-CA 3.28Å; H286-I298 HydrophobicContact CB-CB 4.48Å; H286-I298 PolarHBondContact N-O 2.96Å; H286-I298 PolarHBondContact O-N 2.74Å
287	L	94.3	Very high	81.7	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.7	152.5	169.9	62.1	0	0	0	107.2	I274 K275 I277 Q295 F345	I274-L287 WeakPolarHBondContact CA-O 3.37Å; I274-L287 HydrophobicContact CB-CG 4.35Å; I274-L287 WeakPolarHBondContact CB-O 3.38Å; I274-L287 HydrophobicContact CD1-CG 4.47Å; I274-L287 HydrophobicContact CG2-CD2 4.46Å; I274-L287 PolarHBondContact N-O 2.98Å; K275-L287 PolarHBondContact N-O 2.91Å; K275-L287 VanDerWaalsContact N-O 3.12Å; K275-L287 PolarHBondContact O-N 2.67Å; I277-L287 HydrophobicContact CD1-CB 4.41Å; I277-L287 HydrophobicContact CG2-CB 3.73Å; L287-Q295 HydrophobicContact CD1-CB 4.36Å; L287-F345 HydrophobicContact CB-CE2 4.4Å; L287-F345 HydrophobicContact CD1-CB 4.46Å; L287-F345 HydrophobicContact CD1-CD1 3.77Å; L287-F345 HydrophobicContact CD1-CD2 3.86Å; L287-F345 HydrophobicContact CD1-CE1 3.9Å; L287-F345 HydrophobicContact CD1-CE2 4.01Å; L287-F345 HydrophobicContact CD1-CG 3.75Å; L287-F345 HydrophobicContact CD1-CZ 4.03Å; L287-F345 HydrophobicContact CD2-CE1 4.47Å; L287-F345 HydrophobicContact CD2-CZ 4.31Å
288	G	92.1	Very high	81.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	179.4	172	0	0	0	0	0	112.3	A272 V296	A272-G288 CarbonylContact O-C 3.54Å; A272-G288 WeakPolarHBondContact O-CA 3.28Å; G288-V296 PolarHBondContact N-O 3.36Å; G288-V296 WeakPolarHBondContact O-CG2 3.38Å; G288-V296 PolarHBondContact O-N 3.32Å
289	E	84.5	Confident	82.1	Confident	62 Å²	62	48.8 Å²	48.8	29%	0.29	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.6	169.4	-90.4	166.7	-151.5	0	0	110	A272 I274 I294 Q295	A272-E289 HydrophobicContact CB-CB 4.4Å; A272-E289 PolarHBondContact N-O 3.06Å; A272-E289 PolarHBondContact O-N 3.23Å; I274-E289 HydrophobicContact CD1-CB 4.14Å; I274-E289 HydrophobicContact CD1-CG 3.74Å; E289-I294 CarbonylContact C-O 3.45Å; E289-I294 VanDerWaalsContact CA-O 3.29Å; E289-I294 WeakPolarHBondContact CA-O 3.49Å; E289-Q295 HydrophobicContact CG-CG 4.35Å
290	W	78.8	Confident	82.3	Confident	11 Å²	11	46.4 Å²	46.4	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.5	169.7	-176.6	46.6	0	0	0	109.3	F259 I266 E270 L271 S292 H293 I294 V296	F259-W290 HydrophobicContact CB-CH2 3.73Å; F259-W290 HydrophobicContact CB-CZ3 4Å; F259-W290 HydrophobicContact CD1-CZ3 4.4Å; F259-W290 HydrophobicContact CD2-CE3 4.37Å; F259-W290 AromaticContact CD2-CH2 3.96Å; F259-W290 HydrophobicContact CD2-CH2 3.96Å; F259-W290 AromaticContact CD2-CZ3 3.37Å; F259-W290 HydrophobicContact CD2-CZ3 3.37Å; F259-W290 AromaticContact CE2-CZ3 3.83Å; F259-W290 HydrophobicContact CE2-CZ3 3.83Å; F259-W290 AromaticContact CG-CH2 3.95Å; F259-W290 HydrophobicContact CG-CH2 3.95Å; F259-W290 AromaticContact CG-CZ3 3.68Å; F259-W290 HydrophobicContact CG-CZ3 3.68Å; I266-W290 HydrophobicContact CD1-CD2 4.44Å; I266-W290 HydrophobicContact CD1-CZ2 4.42Å; I266-W290 HydrophobicContact CG1-CZ2 4.3Å; E270-W290 WeakPolarHBondContact O-CA 3.11Å; E270-W290 PolarHBondContact OE2-NE1 3.35Å; L271-W290 HydrophobicContact CD2-CB 3.85Å; L271-W290 HydrophobicContact CD2-CG 3.98Å; W290-S292 PolarHBondContact O-N 2.78Å; W290-S292 VanDerWaalsContact O-N 3.14Å; W290-H293 PolarHBondContact O-N 2.91Å; W290-I294 HydrophobicContact CB-CB 4.49Å; W290-I294 HydrophobicContact CD2-CD1 4.29Å; W290-I294 HydrophobicContact CE3-CD1 3.41Å; W290-I294 VanDerWaalsContact CE3-CD1 3.41Å; W290-I294 HydrophobicContact CZ3-CD1 3.76Å; W290-I294 PolarHBondContact N-O 3.05Å; W290-I294 PolarHBondContact O-N 3.14Å; W290-V296 HydrophobicContact CB-CG1 3.75Å; W290-V296 HydrophobicContact CB-CG2 4.2Å
291	R	70.8	Confident	82.8	Confident	97 Å²	97	44.8 Å²	44.8	37%	0.366	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	34	-175.9	-59.5	179	177.6	-174.1	-4.7	113.5	E270 H293	E270-R291 HydrophobicContact CB-CG 4.17Å; E270-R291 VanDerWaalsContact CD-NE 3.35Å; E270-R291 VanDerWaalsContact CD-NH2 3.27Å; E270-R291 HydrophobicContact CG-CG 4.44Å; E270-R291 PolarHBondContact O-N 3.39Å; E270-R291 IonicContact OE1-CZ 2.81Å; E270-R291 IonicContact OE1-NE 2.67Å; E270-R291 IonicContact OE1-NH2 3.57Å; E270-R291 PolarHBondContact OE1-NH2 2.82Å; E270-R291 IonicContact OE2-CZ 3.15Å; E270-R291 VanDerWaalsContact OE2-CZ 3.26Å; E270-R291 IonicContact OE2-NE 3.92Å; E270-R291 PolarHBondContact OE2-NE 3.41Å; E270-R291 IonicContact OE2-NH2 2.75Å; E270-R291 PolarHBondContact OE2-NH2 3.31Å; R291-H293 PolarHBondContact O-CD2 3.05Å; R291-H293 VanDerWaalsContact O-CG 3.28Å; R291-H293 PolarHBondContact O-N 3.35Å
292	S	66.5	Low	83.1	Confident	86 Å²	86	42.3 Å²	42.3	60%	0.601	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	17.6	179.6	-47.2	0	0	0	0	115.9	W290	W290-S292 PolarHBondContact O-N 2.78Å; W290-S292 VanDerWaalsContact O-N 3.14Å
293	H	68.1	Low	83.2	Confident	169 Å²	169	46.7 Å²	46.7	78%	0.782	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139.7	-12.3	-169.4	-66	-24.1	0	0	0	114.3	W290 R291	W290-H293 PolarHBondContact O-N 2.91Å; R291-H293 PolarHBondContact O-CD2 3.05Å; R291-H293 VanDerWaalsContact O-CG 3.28Å; R291-H293 PolarHBondContact O-N 3.35Å
294	I	73.5	Confident	82.6	Confident	22 Å²	22	50.3 Å²	50.3	11%	0.113	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	116.9	-172.6	-53.7	158.6	0	0	0	108.1	E289 W290 V296 Y330	E289-I294 CarbonylContact C-O 3.45Å; E289-I294 VanDerWaalsContact CA-O 3.29Å; E289-I294 WeakPolarHBondContact CA-O 3.49Å; W290-I294 HydrophobicContact CB-CB 4.49Å; W290-I294 HydrophobicContact CD2-CD1 4.29Å; W290-I294 HydrophobicContact CE3-CD1 3.41Å; W290-I294 VanDerWaalsContact CE3-CD1 3.41Å; W290-I294 HydrophobicContact CZ3-CD1 3.76Å; W290-I294 PolarHBondContact N-O 3.05Å; W290-I294 PolarHBondContact O-N 3.14Å; I294-V296 HydrophobicContact CG2-CG1 4.07Å; I294-V296 PolarHBondContact O-N 2.85Å; I294-Y330 HydrophobicContact CG2-CE2 4.08Å
295	Q	84.6	Confident	81.4	Confident	102 Å²	102	50.6 Å²	50.6	48%	0.477	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.7	172.1	-69.7	-171.6	-26.7	0	0	110.4	L287 E289 F345	L287-Q295 HydrophobicContact CD1-CB 4.36Å; E289-Q295 HydrophobicContact CG-CG 4.35Å; Q295-F345 HydrophobicContact CB-CB 4.31Å; Q295-F345 HydrophobicContact CB-CD1 4.33Å
296	V	89.8	Confident	80.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	150.6	-174.2	-64.6	0	0	0	0	111.1	L271 G288 W290 I294 I298 Y330 V342 T343	L271-V296 HydrophobicContact CD2-CG2 4.35Å; G288-V296 PolarHBondContact N-O 3.36Å; G288-V296 WeakPolarHBondContact O-CG2 3.38Å; G288-V296 PolarHBondContact O-N 3.32Å; W290-V296 HydrophobicContact CB-CG1 3.75Å; W290-V296 HydrophobicContact CB-CG2 4.2Å; I294-V296 HydrophobicContact CG2-CG1 4.07Å; I294-V296 PolarHBondContact O-N 2.85Å; V296-I298 HydrophobicContact CG2-CD1 4.02Å; V296-I298 HydrophobicContact CG2-CG1 3.74Å; V296-Y330 HydrophobicContact CG1-CD2 3.69Å; V296-Y330 HydrophobicContact CG1-CE2 3.84Å; V296-V342 HydrophobicContact CB-CG1 3.77Å; V296-V342 HydrophobicContact CG1-CG1 3.86Å; V296-V342 HydrophobicContact CG2-CG1 4.09Å; V296-T343 WeakPolarHBondContact CA-O 3.32Å
297	A	93.2	Very high	78.9	Confident	9 Å²	9	50.2 Å²	50.2	7%	0.074	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.3	163	0	0	0	0	0	109	V285 H286 V342 T343	V285-A297 HydrophobicContact CG1-CB 4.27Å; H286-A297 CarbonylContact O-C 3.54Å; H286-A297 WeakPolarHBondContact O-CA 3.28Å; A297-V342 WeakPolarHBondContact O-CA 3.34Å; A297-T343 PolarHBondContact N-O 2.99Å; A297-T343 PolarHBondContact O-N 2.87Å
298	I	92.2	Very high	77.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	99.8	-177.6	-48.7	175.6	0	0	0	108.3	L271 F273 V285 H286 V296 A300 Y340 I341	L271-I298 HydrophobicContact CB-CD1 4.17Å; L271-I298 HydrophobicContact CD1-CD1 4.38Å; L271-I298 HydrophobicContact CD2-CD1 4.06Å; L271-I298 HydrophobicContact CG-CD1 4.45Å; F273-I298 HydrophobicContact CD1-CD1 4.26Å; F273-I298 HydrophobicContact CE1-CB 4.2Å; F273-I298 HydrophobicContact CE1-CD1 4.08Å; F273-I298 HydrophobicContact CE1-CG2 3.75Å; F273-I298 HydrophobicContact CE2-CD1 4.41Å; F273-I298 HydrophobicContact CZ-CD1 4.15Å; F273-I298 HydrophobicContact CZ-CG2 3.87Å; V285-I298 WeakPolarHBondContact CA-O 3.33Å; H286-I298 HydrophobicContact CB-CB 4.48Å; H286-I298 PolarHBondContact N-O 2.96Å; H286-I298 PolarHBondContact O-N 2.74Å; V296-I298 HydrophobicContact CG2-CD1 4.02Å; V296-I298 HydrophobicContact CG2-CG1 3.74Å; I298-A300 PolarHBondContact O-N 3.47Å; I298-Y340 HydrophobicContact CG2-CD1 3.77Å; I298-Y340 HydrophobicContact CG2-CG 3.92Å; I298-I341 WeakPolarHBondContact CA-O 3.44Å
299	K	89.7	Confident	76.4	Confident	28 Å²	28	59.9 Å²	59.9	12%	0.122	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	99.1	175.4	175.9	-178	168.5	-174.4	0	108.1	V285 I301 E314 Y340 I341 D408	V285-K299 HydrophobicContact CG2-CB 4.3Å; V285-K299 HydrophobicContact CG2-CG 4.38Å; K299-I301 HydrophobicContact CD-CD1 4.27Å; K299-I301 HydrophobicContact CG-CD1 3.95Å; K299-E314 IonicContact NZ-OE1 3.26Å; K299-E314 PolarHBondContact NZ-OE1 2.91Å; K299-E314 IonicContact NZ-OE2 2.79Å; K299-E314 PolarHBondContact NZ-OE2 2.96Å; K299-Y340 WeakPolarHBondContact O-CA 3.44Å; K299-I341 HydrophobicContact CB-CB 4.24Å; K299-I341 HydrophobicContact CD-CD1 4.27Å; K299-I341 PolarHBondContact N-O 3.28Å; K299-I341 PolarHBondContact O-N 2.96Å; K299-D408 IonicContact NZ-OD1 3.88Å; K299-D408 PolarHBondContact NZ-OD1 3.5Å
300	A	88.6	Confident	75.5	Confident	10 Å²	10	60 Å²	60	8%	0.083	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.6	175.9	0	0	0	0	0	110.3	G283 V284 I298 Y340	G283-A300 CarbonylContact C-O 3.46Å; G283-A300 WeakPolarHBondContact CA-O 3.47Å; V284-A300 PolarHBondContact N-O 2.75Å; V284-A300 WeakPolarHBondContact O-CB 3.39Å; V284-A300 PolarHBondContact O-N 3.1Å; I298-A300 PolarHBondContact O-N 3.47Å; A300-Y340 HydrophobicContact CB-CD1 3.64Å; A300-Y340 HydrophobicContact CB-CE1 3.58Å
301	I	82.3	Confident	75.1	Confident	9 Å²	9	59.5 Å²	59.5	5%	0.046	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	128.7	-174.1	-55	-61.4	0	0	0	110.5	F282 K299 M306 F311 P338 L339	F282-I301 WeakPolarHBondContact O-CA 3.47Å; K299-I301 HydrophobicContact CD-CD1 4.27Å; K299-I301 HydrophobicContact CG-CD1 3.95Å; I301-M306 HydrophobicContact CG2-CB 4.24Å; I301-F311 HydrophobicContact CD1-CD2 4.42Å; I301-F311 HydrophobicContact CD1-CE2 4.48Å; I301-F311 HydrophobicContact CG1-CD2 3.73Å; I301-F311 HydrophobicContact CG1-CE2 3.67Å; I301-P338 WeakPolarHBondContact O-CB 3.3Å; I301-L339 HydrophobicContact CB-CB 4.33Å; I301-L339 HydrophobicContact CG1-CB 4.42Å; I301-L339 PolarHBondContact N-O 3.02Å
302	N	74.6	Confident	75	Confident	72 Å²	72	57.7 Å²	57.7	39%	0.385	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-70.5	133.4	178.7	-71.2	-27.6	0	0	0	110.3	F282 G304 S305	F282-N302 PolarHBondContact O-N 2.74Å; N302-G304 PolarHBondContact O-N 3.49Å; N302-S305 WeakPolarHBondContact O-CB 3.37Å; N302-S305 PolarHBondContact O-N 3.27Å; N302-S305 PolarHBondContact O-OG 3.38Å
303	E	71.4	Confident	75	Confident	148 Å²	148	58 Å²	58	69%	0.692	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	131.4	176.3	-63.6	-162.1	136.9	0	0	111.2	S305 K337	E303-S305 VanDerWaalsContact C-N 3.26Å; E303-S305 PolarHBondContact O-N 3Å; E303-K337 WeakPolarHBondContact OE1-CD 3.29Å
304	G	66.3	Low	75.1	Confident	83 Å²	83	50.3 Å²	50.3	86%	0.856	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	2.3	-176.8	0	0	0	0	0	115.8	N302	N302-G304 PolarHBondContact O-N 3.49Å
305	S	62.4	Low	75	Confident	40 Å²	40	49.4 Å²	49.4	28%	0.28	27%	0.272	S	S	.	.	S	Bend	trans	-82.9	-20.1	173.2	70.4	0	0	0	0	114.1	F282 N302 E303	F282-S305 PolarHBondContact O-OG 2.81Å; N302-S305 WeakPolarHBondContact O-CB 3.37Å; N302-S305 PolarHBondContact O-N 3.27Å; N302-S305 PolarHBondContact O-OG 3.38Å; E303-S305 VanDerWaalsContact C-N 3.26Å; E303-S305 PolarHBondContact O-N 3Å
306	M	66.7	Low	74.3	Confident	41 Å²	41	50.3 Å²	50.3	20%	0.202	27%	0.274	C	S	.	.	S	Bend	trans	-153.2	156.1	-178.6	-172	176.1	-81.9	0	0	108.8	F282 I301 D310 F311	F282-M306 HydrophobicContact CD1-CE 4.28Å; I301-M306 HydrophobicContact CG2-CB 4.24Å; M306-D310 HydrophobicContact CG-CB 3.63Å; M306-D310 HydrophobicContact SD-CB 4.23Å; M306-F311 HydrophobicContact SD-CB 3.92Å
307	S	67.4	Low	73.5	Confident	40 Å²	40	51.1 Å²	51.1	28%	0.28	28%	0.279	S	S	.	.			trans	-79.2	160.1	169.2	71.3	0	0	0	0	111.2	E309 D310 F311	S307-E309 PolarHBondContact O-N 2.85Å; S307-D310 PolarHBondContact O-N 3.43Å; S307-D310 VanDerWaalsContact OG-CB 3.26Å; S307-D310 WeakPolarHBondContact OG-CB 3.3Å; S307-D310 PolarHBondContact OG-N 3.05Å; S307-D310 PolarHBondContact OG-OD2 2.87Å; S307-F311 WeakPolarHBondContact O-CB 3.47Å; S307-F311 PolarHBondContact O-N 3.44Å; S307-F311 VanDerWaalsContact O-N 3.12Å
308	E	67.4	Low	72.4	Confident	94 Å²	94	51.1 Å²	51.1	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-69.9	-30.6	176.7	-61	-178.5	-157.1	0	0	110.2	I312 K337 L339	E308-I312 WeakPolarHBondContact O-CB 3.41Å; E308-I312 WeakPolarHBondContact O-CD1 3.42Å; E308-I312 WeakPolarHBondContact O-CG1 3.4Å; E308-I312 PolarHBondContact O-N 3.4Å; E308-K337 WeakPolarHBondContact OE1-CE 3.28Å; E308-K337 IonicContact OE1-NZ 2.93Å; E308-K337 PolarHBondContact OE1-NZ 2.65Å; E308-L339 HydrophobicContact CG-CD1 4.32Å
309	E	65.6	Low	71.4	Confident	134 Å²	134	54.9 Å²	54.9	63%	0.626	30%	0.296	S	S	*	.	H	α-helix	trans	-65	-50.2	172.8	-63.3	78.6	-177	0	0	112.4	S307 F311 I312 E313	S307-E309 PolarHBondContact O-N 2.85Å; E309-F311 VanDerWaalsContact C-N 3.32Å; E309-F311 PolarHBondContact O-N 3.21Å; E309-I312 PolarHBondContact O-N 3.16Å; E309-E313 PolarHBondContact O-N 3.37Å
310	D	66.3	Low	70.6	Confident	65 Å²	65	59.6 Å²	59.6	35%	0.348	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-39.7	176.9	-78.1	-63.7	0	0	0	111.5	M306 S307 E313 E314 R413	M306-D310 HydrophobicContact CG-CB 3.63Å; M306-D310 HydrophobicContact SD-CB 4.23Å; S307-D310 PolarHBondContact O-N 3.43Å; S307-D310 VanDerWaalsContact OG-CB 3.26Å; S307-D310 WeakPolarHBondContact OG-CB 3.3Å; S307-D310 PolarHBondContact OG-N 3.05Å; S307-D310 PolarHBondContact OG-OD2 2.87Å; D310-E313 PolarHBondContact O-N 3.17Å; D310-E314 PolarHBondContact O-N 2.87Å; D310-R413 IonicContact OD1-NH2 2.7Å; D310-R413 PolarHBondContact OD1-NH2 2.81Å; D310-R413 VanDerWaalsContact OD1-NH2 3.15Å
311	F	69.9	Low	70	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-46.4	174.8	172.4	-91.9	0	0	0	111.7	I301 M306 S307 E309 E313 E314 A315 V332 T334 L339 I341	I301-F311 HydrophobicContact CD1-CD2 4.42Å; I301-F311 HydrophobicContact CD1-CE2 4.48Å; I301-F311 HydrophobicContact CG1-CD2 3.73Å; I301-F311 HydrophobicContact CG1-CE2 3.67Å; M306-F311 HydrophobicContact SD-CB 3.92Å; S307-F311 WeakPolarHBondContact O-CB 3.47Å; S307-F311 PolarHBondContact O-N 3.44Å; S307-F311 VanDerWaalsContact O-N 3.12Å; E309-F311 VanDerWaalsContact C-N 3.32Å; E309-F311 PolarHBondContact O-N 3.21Å; F311-E313 PolarHBondContact O-N 3.49Å; F311-E314 PolarHBondContact O-N 2.92Å; F311-A315 WeakPolarHBondContact O-CB 3.37Å; F311-A315 PolarHBondContact O-N 2.93Å; F311-V332 HydrophobicContact CE1-CB 4.17Å; F311-V332 HydrophobicContact CE1-CG1 4.38Å; F311-V332 HydrophobicContact CE1-CG2 4.42Å; F311-V332 HydrophobicContact CZ-CB 3.96Å; F311-V332 HydrophobicContact CZ-CG1 4.03Å; F311-T334 HydrophobicContact CE1-CG2 3.94Å; F311-L339 HydrophobicContact CB-CD1 4.23Å; F311-L339 HydrophobicContact CD1-CD1 3.82Å; F311-L339 HydrophobicContact CD2-CB 4.25Å; F311-L339 HydrophobicContact CD2-CD1 4.16Å; F311-L339 HydrophobicContact CE1-CB 4.18Å; F311-L339 HydrophobicContact CE1-CD1 4.17Å; F311-L339 HydrophobicContact CE2-CB 3.76Å; F311-L339 HydrophobicContact CE2-CD1 4.44Å; F311-L339 HydrophobicContact CG-CD1 3.81Å; F311-L339 HydrophobicContact CZ-CB 3.74Å; F311-L339 HydrophobicContact CZ-CD1 4.46Å; F311-I341 HydrophobicContact CD2-CD1 4.24Å; F311-I341 HydrophobicContact CD2-CG1 4.18Å; F311-I341 HydrophobicContact CE2-CD1 3.93Å; F311-I341 HydrophobicContact CE2-CG1 3.38Å; F311-I341 HydrophobicContact CZ-CG1 3.99Å
312	I	67.9	Low	69.7	Low	59 Å²	59	60.3 Å²	60.3	30%	0.303	32%	0.321	S	S	.	.	H	α-helix	trans	-64.2	-30.7	175.9	-73.1	168.4	0	0	0	110.8	E308 E309 K316	E308-I312 WeakPolarHBondContact O-CB 3.41Å; E308-I312 WeakPolarHBondContact O-CD1 3.42Å; E308-I312 WeakPolarHBondContact O-CG1 3.4Å; E308-I312 PolarHBondContact O-N 3.4Å; E309-I312 PolarHBondContact O-N 3.16Å; I312-K316 HydrophobicContact CG2-CD 3.85Å; I312-K316 HydrophobicContact CG2-CG 4.44Å; I312-K316 VanDerWaalsContact O-CB 3.27Å; I312-K316 WeakPolarHBondContact O-CB 3.3Å; I312-K316 WeakPolarHBondContact O-CD 3.44Å; I312-K316 WeakPolarHBondContact O-CG 3.42Å; I312-K316 PolarHBondContact O-N 2.84Å
313	E	67.6	Low	70	Confident	93 Å²	93	58.7 Å²	58.7	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-72.3	-43.8	171.8	-71.8	-166.1	172.5	0	0	113.5	E309 D310 F311 A315 K316 V317 R413	E309-E313 PolarHBondContact O-N 3.37Å; D310-E313 PolarHBondContact O-N 3.17Å; F311-E313 PolarHBondContact O-N 3.49Å; E313-A315 VanDerWaalsContact C-N 3.31Å; E313-A315 PolarHBondContact O-N 2.9Å; E313-K316 PolarHBondContact O-N 2.86Å; E313-V317 WeakPolarHBondContact O-CG2 2.98Å; E313-V317 PolarHBondContact O-N 3.23Å; E313-R413 IonicContact OE2-CZ 2.87Å; E313-R413 IonicContact OE2-NH1 4Å; E313-R413 PolarHBondContact OE2-NH1 3.27Å; E313-R413 IonicContact OE2-NH2 3.52Å
314	E	70.4	Confident	70.5	Confident	6 Å²	6	55 Å²	55	3%	0.028	30%	0.301	C	S	.	.	H	α-helix	trans	-55.4	-48.4	172.2	179.1	174.9	168.2	0	0	110	K299 D310 F311 V317 M318 I341 G410	K299-E314 IonicContact NZ-OE1 3.26Å; K299-E314 PolarHBondContact NZ-OE1 2.91Å; K299-E314 IonicContact NZ-OE2 2.79Å; K299-E314 PolarHBondContact NZ-OE2 2.96Å; D310-E314 PolarHBondContact O-N 2.87Å; F311-E314 PolarHBondContact O-N 2.92Å; E314-V317 PolarHBondContact O-N 2.72Å; E314-M318 HydrophobicContact CG-SD 4.13Å; E314-M318 WeakPolarHBondContact O-CG 3.2Å; E314-M318 PolarHBondContact O-N 3.2Å; E314-I341 HydrophobicContact CG-CD1 4.17Å; E314-I341 WeakPolarHBondContact OE1-CD1 3.25Å; E314-G410 WeakPolarHBondContact OE2-CA 3.44Å
315	A	70.3	Confident	71.8	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-48.7	176	0	0	0	0	0	112.3	F311 E313 V317 M318 M319 V332	F311-A315 WeakPolarHBondContact O-CB 3.37Å; F311-A315 PolarHBondContact O-N 2.93Å; E313-A315 VanDerWaalsContact C-N 3.31Å; E313-A315 PolarHBondContact O-N 2.9Å; A315-V317 VanDerWaalsContact C-N 3.28Å; A315-V317 PolarHBondContact O-N 3.01Å; A315-M318 PolarHBondContact O-N 3.39Å; A315-M319 WeakPolarHBondContact O-CB 3.44Å; A315-M319 VanDerWaalsContact O-CG 3.26Å; A315-M319 WeakPolarHBondContact O-CG 3.43Å; A315-M319 PolarHBondContact O-N 3.14Å; A315-V332 HydrophobicContact CB-CG1 3.86Å; A315-V332 HydrophobicContact CB-CG2 4.5Å
316	K	70.1	Confident	73	Confident	121 Å²	121	50.1 Å²	50.1	53%	0.526	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-29	178.5	-78.8	166.7	-178	166	0	113.7	I312 E313 K320	I312-K316 HydrophobicContact CG2-CD 3.85Å; I312-K316 HydrophobicContact CG2-CG 4.44Å; I312-K316 VanDerWaalsContact O-CB 3.27Å; I312-K316 WeakPolarHBondContact O-CB 3.3Å; I312-K316 WeakPolarHBondContact O-CD 3.44Å; I312-K316 WeakPolarHBondContact O-CG 3.42Å; I312-K316 PolarHBondContact O-N 2.84Å; E313-K316 PolarHBondContact O-N 2.86Å; K316-K320 WeakPolarHBondContact O-CG 3.42Å
317	V	72.6	Confident	74.2	Confident	16 Å²	16	48.5 Å²	48.5	10%	0.097	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-56.8	169.6	166.6	0	0	0	0	108.9	E313 E314 A315 M319 K320 L321 Y386 T412	E313-V317 WeakPolarHBondContact O-CG2 2.98Å; E313-V317 PolarHBondContact O-N 3.23Å; E314-V317 PolarHBondContact O-N 2.72Å; A315-V317 VanDerWaalsContact C-N 3.28Å; A315-V317 PolarHBondContact O-N 3.01Å; V317-M319 VanDerWaalsContact C-N 3.28Å; V317-M319 PolarHBondContact O-N 3.48Å; V317-K320 PolarHBondContact O-N 2.86Å; V317-L321 HydrophobicContact CG1-CD1 3.79Å; V317-L321 HydrophobicContact CG1-CG 4.44Å; V317-L321 WeakPolarHBondContact O-CG 3.25Å; V317-L321 PolarHBondContact O-N 2.9Å; V317-Y386 HydrophobicContact CB-CE1 4.5Å; V317-Y386 HydrophobicContact CG1-CD1 4Å; V317-Y386 HydrophobicContact CG1-CE1 3.89Å; V317-Y386 HydrophobicContact CG2-CE1 4.31Å; V317-T412 HydrophobicContact CG1-CG2 3.84Å
318	M	71.6	Confident	74.9	Confident	10 Å²	10	47.1 Å²	47.1	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-31.9	-177.7	-68.4	-178.3	68.2	0	0	113.8	E314 A315 K320 L321 L329 T343 F409	E314-M318 HydrophobicContact CG-SD 4.13Å; E314-M318 WeakPolarHBondContact O-CG 3.2Å; E314-M318 PolarHBondContact O-N 3.2Å; A315-M318 PolarHBondContact O-N 3.39Å; M318-K320 VanDerWaalsContact C-N 3.26Å; M318-K320 PolarHBondContact O-N 3.37Å; M318-L321 PolarHBondContact O-N 2.89Å; M318-L329 HydrophobicContact CB-CB 4.02Å; M318-L329 HydrophobicContact CB-CD2 3.98Å; M318-L329 HydrophobicContact CB-CG 4.43Å; M318-L329 HydrophobicContact CE-CB 4.21Å; M318-L329 HydrophobicContact CE-CD1 4.23Å; M318-T343 HydrophobicContact CE-CG2 3.81Å; M318-F409 HydrophobicContact CE-CD2 3.8Å; M318-F409 HydrophobicContact CE-CE2 4.27Å; M318-F409 HydrophobicContact CG-CB 3.71Å; M318-F409 HydrophobicContact CG-CD2 3.61Å; M318-F409 HydrophobicContact CG-CG 3.9Å; M318-F409 HydrophobicContact SD-CB 4.14Å; M318-F409 HydrophobicContact SD-CD2 3.8Å; M318-F409 HydrophobicContact SD-CG 4.42Å
319	M	71.3	Confident	75.5	Confident	78 Å²	78	43 Å²	43	38%	0.384	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.8	173.7	-76.3	178.7	72.2	0	0	113.9	W264 A315 V317 L329	W264-M319 HydrophobicContact CB-CE 3.63Å; W264-M319 HydrophobicContact CB-SD 4.11Å; W264-M319 HydrophobicContact CD2-CE 4.42Å; W264-M319 HydrophobicContact CD2-SD 4.34Å; W264-M319 HydrophobicContact CG-CE 3.63Å; W264-M319 HydrophobicContact CG-SD 4.07Å; A315-M319 WeakPolarHBondContact O-CB 3.44Å; A315-M319 VanDerWaalsContact O-CG 3.26Å; A315-M319 WeakPolarHBondContact O-CG 3.43Å; A315-M319 PolarHBondContact O-N 3.14Å; V317-M319 VanDerWaalsContact C-N 3.28Å; V317-M319 PolarHBondContact O-N 3.48Å; M319-L329 HydrophobicContact CB-CD2 4.47Å; M319-L329 HydrophobicContact CG-CD2 3.54Å
320	K	72.8	Confident	76.1	Confident	128 Å²	128	38.2 Å²	38.2	56%	0.557	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.5	178.8	-67.3	175.2	-180	-179.7	0	113	K316 V317 M318 Y386	K316-K320 WeakPolarHBondContact O-CG 3.42Å; V317-K320 PolarHBondContact O-N 2.86Å; M318-K320 VanDerWaalsContact C-N 3.26Å; M318-K320 PolarHBondContact O-N 3.37Å; K320-Y386 WeakPolarHBondContact CB-OH 3.24Å; K320-Y386 VanDerWaalsContact CD-OH 3.27Å; K320-Y386 WeakPolarHBondContact CD-OH 3.27Å
321	L	74.8	Confident	76.6	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	18%	0.175	C	C	.	.			trans	-95	118.8	-179.4	-61.9	176.7	0	0	0	109	V317 M318 L326 Y380 L381 Y386 F409	V317-L321 HydrophobicContact CG1-CD1 3.79Å; V317-L321 HydrophobicContact CG1-CG 4.44Å; V317-L321 WeakPolarHBondContact O-CG 3.25Å; V317-L321 PolarHBondContact O-N 2.9Å; M318-L321 PolarHBondContact O-N 2.89Å; L321-L326 HydrophobicContact CB-CD1 4Å; L321-L326 HydrophobicContact CD1-CD1 4.46Å; L321-L326 HydrophobicContact CD2-CD1 4.44Å; L321-Y380 HydrophobicContact CD2-CE1 3.88Å; L321-L381 HydrophobicContact CD1-CD2 3.92Å; L321-L381 HydrophobicContact CD2-CD2 3.57Å; L321-L381 HydrophobicContact CG-CD2 4.37Å; L321-Y386 HydrophobicContact CD2-CD1 4.3Å; L321-Y386 HydrophobicContact CD2-CD2 3.72Å; L321-Y386 HydrophobicContact CD2-CE1 4.32Å; L321-Y386 HydrophobicContact CD2-CE2 3.75Å; L321-Y386 HydrophobicContact CD2-CG 4.01Å; L321-F409 HydrophobicContact CD1-CD1 3.82Å; L321-F409 HydrophobicContact CD1-CE1 3.9Å; L321-F409 HydrophobicContact CD1-CG 4.36Å; L321-F409 HydrophobicContact CD1-CZ 4.49Å
322	S	76.8	Confident	77.3	Confident	27 Å²	27	35.2 Å²	35.2	19%	0.189	18%	0.175	C	C	.	.			trans	-143	112.2	170.2	-167.8	0	0	0	0	110.4	A257 Q328 Y380	A257-S322 WeakPolarHBondContact CB-OG 3.47Å; S322-Q328 PolarHBondContact OG-OE1 2.82Å; S322-Y380 PolarHBondContact N-OH 3.32Å; S322-Y380 WeakPolarHBondContact O-CE2 3.39Å; S322-Y380 PolarHBondContact O-OH 3.42Å; S322-Y380 VanDerWaalsContact O-OH 3.1Å
323	H	80.3	Confident	78.1	Confident	39 Å²	39	32.4 Å²	32.4	18%	0.181	16%	0.161	C	C	.	.			trans	-159.4	148.5	-175.5	-177.1	-112.2	0	0	0	110.1	K325 L326 E376 Y380	H323-K325 PolarHBondContact ND1-N 3.11Å; H323-K325 PolarHBondContact O-N 3.16Å; H323-L326 HydrophobicContact CB-CB 4.44Å; H323-L326 HydrophobicContact CB-CD1 4Å; H323-L326 HydrophobicContact CB-CG 3.96Å; H323-L326 PolarHBondContact O-N 2.88Å; H323-L326 VanDerWaalsContact O-N 3.13Å; H323-E376 PolarHBondContact CE1-O 2.83Å; H323-Y380 HydrophobicContact CB-CD1 3.88Å; H323-Y380 HydrophobicContact CB-CD2 3.79Å; H323-Y380 HydrophobicContact CB-CE1 4.02Å; H323-Y380 HydrophobicContact CB-CE2 3.94Å; H323-Y380 HydrophobicContact CB-CG 3.76Å; H323-Y380 AromaticContact CD2-CD2 3.67Å; H323-Y380 AromaticContact CD2-CG 3.98Å; H323-Y380 AromaticContact CG-CD2 3.77Å; H323-Y380 AromaticContact CG-CG 3.7Å
324	S	81.9	Confident	78.7	Confident	69 Å²	69	29.6 Å²	29.6	48%	0.483	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.9	-174.2	61.4	0	0	0	0	114.5	K405	S324-K405 VanDerWaalsContact O-CE 3.23Å; S324-K405 WeakPolarHBondContact O-CE 3.18Å
325	K	92.8	Very high	78.9	Confident	18 Å²	18	33.7 Å²	33.7	8%	0.078	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	12.4	-179.2	-49.4	-61.6	-178.2	176	0	114.1	H323 D373 E376 T403 K405 I406	H323-K325 PolarHBondContact ND1-N 3.11Å; H323-K325 PolarHBondContact O-N 3.16Å; K325-D373 VanDerWaalsContact CB-O 3.25Å; K325-D373 WeakPolarHBondContact CB-O 3.44Å; K325-D373 HydrophobicContact CD-CB 3.98Å; K325-D373 WeakPolarHBondContact CE-OD1 3.46Å; K325-D373 VanDerWaalsContact CG-O 3.27Å; K325-D373 WeakPolarHBondContact CG-O 3.42Å; K325-D373 IonicContact NZ-OD1 3.8Å; K325-D373 PolarHBondContact NZ-OD1 3.13Å; K325-D373 IonicContact NZ-OD2 3.53Å; K325-E376 WeakPolarHBondContact CE-OE2 3.44Å; K325-E376 HydrophobicContact CG-CB 4.19Å; K325-E376 HydrophobicContact CG-CG 4.46Å; K325-E376 WeakPolarHBondContact CG-OE2 3.4Å; K325-E376 IonicContact NZ-OE2 2.81Å; K325-T403 HydrophobicContact CD-CG2 4.3Å; K325-K405 CarbonylContact O-C 3.56Å; K325-K405 VanDerWaalsContact O-CA 3.25Å; K325-K405 WeakPolarHBondContact O-CA 3.48Å; K325-I406 PolarHBondContact O-N 3.27Å
326	L	89.3	Confident	79.2	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.021	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-113.8	143.5	170.8	-57.4	-177.3	0	0	0	108.7	L321 H323 Q328 Y380 L381 I406 F409	L321-L326 HydrophobicContact CB-CD1 4Å; L321-L326 HydrophobicContact CD1-CD1 4.46Å; L321-L326 HydrophobicContact CD2-CD1 4.44Å; H323-L326 HydrophobicContact CB-CB 4.44Å; H323-L326 HydrophobicContact CB-CD1 4Å; H323-L326 HydrophobicContact CB-CG 3.96Å; H323-L326 PolarHBondContact O-N 2.88Å; H323-L326 VanDerWaalsContact O-N 3.13Å; L326-Q328 PolarHBondContact O-N 3.06Å; L326-Y380 HydrophobicContact CD1-CD1 3.65Å; L326-Y380 HydrophobicContact CD1-CE1 3.77Å; L326-L381 HydrophobicContact CD1-CD2 3.77Å; L326-L381 HydrophobicContact CD1-CG 4.4Å; L326-L381 HydrophobicContact CD2-CD1 4.35Å; L326-L381 HydrophobicContact CD2-CD2 4.44Å; L326-L381 HydrophobicContact CD2-CG 4.32Å; L326-I406 HydrophobicContact CD2-CB 3.77Å; L326-I406 HydrophobicContact CD2-CD1 4.04Å; L326-I406 HydrophobicContact CD2-CG1 4.17Å; L326-F409 HydrophobicContact CB-CZ 4.06Å; L326-F409 HydrophobicContact CD1-CZ 4.5Å; L326-F409 HydrophobicContact CD2-CE1 4.22Å; L326-F409 HydrophobicContact CD2-CZ 4.01Å; L326-F409 HydrophobicContact CG-CZ 4.4Å
327	V	90.3	Very high	79.7	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.042	20%	0.201	C	C	.	.			trans	-69.3	113.7	175.5	170	0	0	0	0	109	T343 E344 M346 L397 K405 I406	V327-T343 HydrophobicContact CG1-CG2 4.14Å; V327-E344 WeakPolarHBondContact CA-OE1 3.46Å; V327-E344 HydrophobicContact CG1-CG 3.98Å; V327-M346 HydrophobicContact CG2-CG 4.41Å; V327-L397 HydrophobicContact CG2-CB 4.4Å; V327-L397 HydrophobicContact CG2-CD1 4.09Å; V327-L397 HydrophobicContact CG2-CG 4.37Å; V327-K405 HydrophobicContact CG2-CB 3.64Å; V327-K405 HydrophobicContact CG2-CD 4.42Å; V327-I406 WeakPolarHBondContact CG2-O 3.35Å; V327-I406 PolarHBondContact N-O 3.38Å
328	Q	82.3	Confident	80.1	Confident	10 Å²	10	43.9 Å²	43.9	5%	0.047	21%	0.212	C	C	.	.			trans	-73.6	128.7	-174.3	-173.3	59.1	74.3	0	0	111.2	A255 S322 L326 T343 E344	A255-Q328 HydrophobicContact CB-CB 3.61Å; A255-Q328 HydrophobicContact CB-CG 3.58Å; S322-Q328 PolarHBondContact OG-OE1 2.82Å; L326-Q328 PolarHBondContact O-N 3.06Å; Q328-T343 WeakPolarHBondContact O-CA 3.43Å; Q328-T343 WeakPolarHBondContact O-CB 3.27Å; Q328-E344 PolarHBondContact N-OE1 3.01Å; Q328-E344 PolarHBondContact O-N 3.29Å
329	L	81.4	Confident	80.8	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.9	165.7	-174.1	72	0	0	0	110.1	M318 M319 G331 V332 I341 T343	M318-L329 HydrophobicContact CB-CB 4.02Å; M318-L329 HydrophobicContact CB-CD2 3.98Å; M318-L329 HydrophobicContact CB-CG 4.43Å; M318-L329 HydrophobicContact CE-CB 4.21Å; M318-L329 HydrophobicContact CE-CD1 4.23Å; M319-L329 HydrophobicContact CB-CD2 4.47Å; M319-L329 HydrophobicContact CG-CD2 3.54Å; L329-G331 WeakPolarHBondContact CD1-O 3.44Å; L329-V332 HydrophobicContact CD1-CG1 4.26Å; L329-I341 HydrophobicContact CD1-CG2 3.37Å; L329-T343 HydrophobicContact CD1-CG2 4.34Å
330	Y	76.6	Confident	81.6	Confident	33 Å²	33	42.3 Å²	42.3	13%	0.129	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-37.3	169.9	-64.6	-23.6	0	0	0	111.9	A255 F259 I294 V296 V342 E344	A255-Y330 HydrophobicContact CB-CE1 3.89Å; F259-Y330 HydrophobicContact CD2-CD1 4.13Å; F259-Y330 HydrophobicContact CD2-CG 4.28Å; F259-Y330 AromaticContact CE2-CD1 3.49Å; F259-Y330 HydrophobicContact CE2-CD1 3.49Å; F259-Y330 VanDerWaalsContact CE2-CD1 3.49Å; F259-Y330 HydrophobicContact CE2-CD2 4.27Å; F259-Y330 AromaticContact CE2-CE1 3.67Å; F259-Y330 HydrophobicContact CE2-CE1 3.67Å; F259-Y330 HydrophobicContact CE2-CE2 4.43Å; F259-Y330 AromaticContact CE2-CG 3.79Å; F259-Y330 HydrophobicContact CE2-CG 3.79Å; F259-Y330 HydrophobicContact CZ-CD1 4.47Å; F259-Y330 HydrophobicContact CZ-CE1 4.24Å; I294-Y330 HydrophobicContact CG2-CE2 4.08Å; V296-Y330 HydrophobicContact CG1-CD2 3.69Å; V296-Y330 HydrophobicContact CG1-CE2 3.84Å; Y330-V342 HydrophobicContact CD2-CG1 4.49Å; Y330-V342 PolarHBondContact N-O 3.24Å; Y330-E344 HydrophobicContact CE1-CB 4.22Å; Y330-E344 HydrophobicContact CE2-CB 4.15Å; Y330-E344 WeakPolarHBondContact OH-CB 3.39Å
331	G	78.6	Confident	82.2	Confident	2 Å²	2	36.3 Å²	36.3	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.1	-174.6	174.8	0	0	0	0	0	112.1	W264 L329 V342	W264-G331 VanDerWaalsContact O-CA 3.28Å; W264-G331 WeakPolarHBondContact O-CA 3.44Å; L329-G331 WeakPolarHBondContact CD1-O 3.44Å; G331-V342 PolarHBondContact N-O 3.34Å; G331-V342 PolarHBondContact O-N 2.87Å
332	V	83.5	Confident	82.8	Confident	1 Å²	1	36 Å²	36	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	160.5	173.9	-65.2	0	0	0	0	111.1	W264 E265 I266 F311 A315 L329 T334 Y340 I341	W264-V332 HydrophobicContact CE3-CG2 3.48Å; W264-V332 VanDerWaalsContact CE3-CG2 3.48Å; W264-V332 HydrophobicContact CZ3-CG2 3.55Å; W264-V332 PolarHBondContact O-N 3.18Å; E265-V332 CarbonylContact C-O 3.57Å; E265-V332 WeakPolarHBondContact CA-O 3.44Å; I266-V332 PolarHBondContact N-O 2.96Å; F311-V332 HydrophobicContact CE1-CB 4.17Å; F311-V332 HydrophobicContact CE1-CG1 4.38Å; F311-V332 HydrophobicContact CE1-CG2 4.42Å; F311-V332 HydrophobicContact CZ-CB 3.96Å; F311-V332 HydrophobicContact CZ-CG1 4.03Å; A315-V332 HydrophobicContact CB-CG1 3.86Å; A315-V332 HydrophobicContact CB-CG2 4.5Å; L329-V332 HydrophobicContact CD1-CG1 4.26Å; V332-T334 HydrophobicContact CG2-CG2 4.13Å; V332-Y340 CarbonylContact C-O 3.57Å; V332-Y340 WeakPolarHBondContact CA-O 3.4Å; V332-Y340 WeakPolarHBondContact CB-O 3.26Å; V332-I341 HydrophobicContact CG1-CB 4.43Å; V332-I341 HydrophobicContact CG1-CG1 4.31Å; V332-I341 HydrophobicContact CG1-CG2 4.21Å
333	C	84.8	Confident	83.4	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.1	169.2	-56.2	0	0	0	0	109.4	I266 P268 L339 Y340	I266-C333 PolarHBondContact O-SG 3.32Å; P268-C333 HydrophobicContact CG-CB 4.18Å; C333-L339 WeakPolarHBondContact O-CA 3.26Å; C333-Y340 HydrophobicContact CB-CD2 3.58Å; C333-Y340 HydrophobicContact CB-CG 4.17Å; C333-Y340 PolarHBondContact N-O 3.48Å; C333-Y340 PolarHBondContact O-N 3.25Å
334	T	80.8	Confident	83.7	Confident	34 Å²	34	34.7 Å²	34.7	21%	0.209	17%	0.167	C	C	.	.			trans	-111.2	-24	-174.5	34.3	0	0	0	0	113.2	W264 E265 F311 V332 W336	W264-T334 HydrophobicContact CH2-CG2 4.5Å; W264-T334 HydrophobicContact CZ3-CG2 4.03Å; E265-T334 WeakPolarHBondContact CG-OG1 3.38Å; E265-T334 PolarHBondContact OE1-OG1 3.17Å; F311-T334 HydrophobicContact CE1-CG2 3.94Å; V332-T334 HydrophobicContact CG2-CG2 4.13Å; T334-W336 VanDerWaalsContact C-N 3.35Å; T334-W336 PolarHBondContact O-N 2.91Å
335	Q	74.7	Confident	84.1	Confident	92 Å²	92	33.4 Å²	33.4	43%	0.43	15%	0.153	S	C	.	.	S	Bend	trans	-74	-22.7	-167.3	-60.1	178.4	3	0	0	114.2	E265	E265-Q335 PolarHBondContact OE2-NE2 3.38Å
336	W	76.3	Confident	84.1	Confident	186 Å²	186	32.9 Å²	32.9	71%	0.705	15%	0.151	S	C	*	.	S	Bend	trans	-142.9	155.6	-177.6	-55.4	99.6	0	0	0	109.7	T334	T334-W336 VanDerWaalsContact C-N 3.35Å; T334-W336 PolarHBondContact O-N 2.91Å
337	K	80.2	Confident	84.2	Confident	118 Å²	118	36.7 Å²	36.7	51%	0.513	17%	0.169	S	C	.	.	S	Bend	trans	-97.4	150.5	177	-67.5	-167.6	-179.6	-176.9	0	112	E303 E308	E303-K337 WeakPolarHBondContact OE1-CD 3.29Å; E308-K337 WeakPolarHBondContact OE1-CE 3.28Å; E308-K337 IonicContact OE1-NZ 2.93Å; E308-K337 PolarHBondContact OE1-NZ 2.65Å
338	P	81.6	Confident	84.3	Confident	50 Å²	50	39.4 Å²	39.4	33%	0.325	18%	0.183	S	C	.	.	S	Bend	cis	-69.9	154	-5.4	30.3	-34.9	0	0	0	112.4	I301 Y340	I301-P338 WeakPolarHBondContact O-CB 3.3Å; P338-Y340 HydrophobicContact CG-CE1 3.86Å
339	L	86.1	Confident	84.8	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.089	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-70.2	142.6	178.8	-54.4	175.8	0	0	0	110.2	I301 E308 F311 C333	I301-L339 HydrophobicContact CB-CB 4.33Å; I301-L339 HydrophobicContact CG1-CB 4.42Å; I301-L339 PolarHBondContact N-O 3.02Å; E308-L339 HydrophobicContact CG-CD1 4.32Å; F311-L339 HydrophobicContact CB-CD1 4.23Å; F311-L339 HydrophobicContact CD1-CD1 3.82Å; F311-L339 HydrophobicContact CD2-CB 4.25Å; F311-L339 HydrophobicContact CD2-CD1 4.16Å; F311-L339 HydrophobicContact CE1-CB 4.18Å; F311-L339 HydrophobicContact CE1-CD1 4.17Å; F311-L339 HydrophobicContact CE2-CB 3.76Å; F311-L339 HydrophobicContact CE2-CD1 4.44Å; F311-L339 HydrophobicContact CG-CD1 3.81Å; F311-L339 HydrophobicContact CZ-CB 3.74Å; F311-L339 HydrophobicContact CZ-CD1 4.46Å; C333-L339 WeakPolarHBondContact O-CA 3.26Å
340	Y	87.6	Confident	85.5	Confident	38 Å²	38	41.5 Å²	41.5	15%	0.149	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.8	179.3	-54.7	-59.1	0	0	0	111.9	F273 I298 K299 A300 V332 C333 P338	F273-Y340 HydrophobicContact CE1-CD1 4.47Å; F273-Y340 HydrophobicContact CE1-CE1 4.06Å; F273-Y340 HydrophobicContact CZ-CD1 4.1Å; F273-Y340 HydrophobicContact CZ-CD2 4.46Å; F273-Y340 AromaticContact CZ-CE1 3.65Å; F273-Y340 HydrophobicContact CZ-CE1 3.65Å; F273-Y340 HydrophobicContact CZ-CE2 4.07Å; F273-Y340 AromaticContact CZ-CZ 3.67Å; I298-Y340 HydrophobicContact CG2-CD1 3.77Å; I298-Y340 HydrophobicContact CG2-CG 3.92Å; K299-Y340 WeakPolarHBondContact O-CA 3.44Å; A300-Y340 HydrophobicContact CB-CD1 3.64Å; A300-Y340 HydrophobicContact CB-CE1 3.58Å; V332-Y340 CarbonylContact C-O 3.57Å; V332-Y340 WeakPolarHBondContact CA-O 3.4Å; V332-Y340 WeakPolarHBondContact CB-O 3.26Å; C333-Y340 HydrophobicContact CB-CD2 3.58Å; C333-Y340 HydrophobicContact CB-CG 4.17Å; C333-Y340 PolarHBondContact N-O 3.48Å; C333-Y340 PolarHBondContact O-N 3.25Å; P338-Y340 HydrophobicContact CG-CE1 3.86Å
341	I	86.8	Confident	86.5	Confident	2 Å²	2	40 Å²	40	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.3	159.7	-47.3	-172.4	0	0	0	108.3	I298 K299 F311 E314 L329 V332 T343	I298-I341 WeakPolarHBondContact CA-O 3.44Å; K299-I341 HydrophobicContact CB-CB 4.24Å; K299-I341 HydrophobicContact CD-CD1 4.27Å; K299-I341 PolarHBondContact N-O 3.28Å; K299-I341 PolarHBondContact O-N 2.96Å; F311-I341 HydrophobicContact CD2-CD1 4.24Å; F311-I341 HydrophobicContact CD2-CG1 4.18Å; F311-I341 HydrophobicContact CE2-CD1 3.93Å; F311-I341 HydrophobicContact CE2-CG1 3.38Å; F311-I341 HydrophobicContact CZ-CG1 3.99Å; E314-I341 HydrophobicContact CG-CD1 4.17Å; E314-I341 WeakPolarHBondContact OE1-CD1 3.25Å; L329-I341 HydrophobicContact CD1-CG2 3.37Å; V332-I341 HydrophobicContact CG1-CB 4.43Å; V332-I341 HydrophobicContact CG1-CG1 4.31Å; V332-I341 HydrophobicContact CG1-CG2 4.21Å; I341-T343 HydrophobicContact CG2-CG2 4.16Å
342	V	87.3	Confident	87.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	115.8	-178.5	-171.9	0	0	0	0	109.4	I266 L271 V296 A297 Y330 G331	I266-V342 HydrophobicContact CD1-CB 3.85Å; I266-V342 HydrophobicContact CD1-CG1 4.05Å; I266-V342 HydrophobicContact CD1-CG2 3.93Å; L271-V342 HydrophobicContact CD1-CG2 3.88Å; L271-V342 HydrophobicContact CD2-CG1 4.24Å; L271-V342 HydrophobicContact CD2-CG2 4.2Å; V296-V342 HydrophobicContact CB-CG1 3.77Å; V296-V342 HydrophobicContact CG1-CG1 3.86Å; V296-V342 HydrophobicContact CG2-CG1 4.09Å; A297-V342 WeakPolarHBondContact O-CA 3.34Å; Y330-V342 HydrophobicContact CD2-CG1 4.49Å; Y330-V342 PolarHBondContact N-O 3.24Å; G331-V342 PolarHBondContact N-O 3.34Å; G331-V342 PolarHBondContact O-N 2.87Å
343	T	89	Confident	87.9	Confident	18 Å²	18	44.3 Å²	44.3	11%	0.11	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	172.1	179.4	66.3	0	0	0	0	111.6	V296 A297 M318 V327 Q328 L329 I341	V296-T343 WeakPolarHBondContact CA-O 3.32Å; A297-T343 PolarHBondContact N-O 2.99Å; A297-T343 PolarHBondContact O-N 2.87Å; M318-T343 HydrophobicContact CE-CG2 3.81Å; V327-T343 HydrophobicContact CG1-CG2 4.14Å; Q328-T343 WeakPolarHBondContact O-CA 3.43Å; Q328-T343 WeakPolarHBondContact O-CB 3.27Å; L329-T343 HydrophobicContact CD1-CG2 4.34Å; I341-T343 HydrophobicContact CG2-CG2 4.16Å
344	E	86	Confident	88.5	Confident	21 Å²	21	45.4 Å²	45.4	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	142.8	164	65.3	-177.9	132.3	0	0	111.7	V327 Q328 Y330 K405	V327-E344 WeakPolarHBondContact CA-OE1 3.46Å; V327-E344 HydrophobicContact CG1-CG 3.98Å; Q328-E344 PolarHBondContact N-OE1 3.01Å; Q328-E344 PolarHBondContact O-N 3.29Å; Y330-E344 HydrophobicContact CE1-CB 4.22Å; Y330-E344 HydrophobicContact CE2-CB 4.15Å; Y330-E344 WeakPolarHBondContact OH-CB 3.39Å; E344-K405 WeakPolarHBondContact OE1-CD 3.2Å; E344-K405 IonicContact OE1-NZ 3.77Å; E344-K405 PolarHBondContact OE1-NZ 3.07Å; E344-K405 IonicContact OE2-NZ 3.73Å; E344-K405 PolarHBondContact OE2-NZ 2.92Å
345	F	90.6	Very high	89.3	Confident	41 Å²	41	43.9 Å²	43.9	18%	0.18	22%	0.215	C	C	.	.			trans	-84	137.8	173.8	177.6	-121.5	0	0	0	110.3	I277 L287 Q295 E347	I277-F345 HydrophobicContact CD1-CD2 4.1Å; I277-F345 HydrophobicContact CD1-CE2 3.74Å; L287-F345 HydrophobicContact CB-CE2 4.4Å; L287-F345 HydrophobicContact CD1-CB 4.46Å; L287-F345 HydrophobicContact CD1-CD1 3.77Å; L287-F345 HydrophobicContact CD1-CD2 3.86Å; L287-F345 HydrophobicContact CD1-CE1 3.9Å; L287-F345 HydrophobicContact CD1-CE2 4.01Å; L287-F345 HydrophobicContact CD1-CG 3.75Å; L287-F345 HydrophobicContact CD1-CZ 4.03Å; L287-F345 HydrophobicContact CD2-CE1 4.47Å; L287-F345 HydrophobicContact CD2-CZ 4.31Å; Q295-F345 HydrophobicContact CB-CB 4.31Å; Q295-F345 HydrophobicContact CB-CD1 4.33Å; F345-E347 HydrophobicContact CD1-CG 3.91Å; F345-E347 HydrophobicContact CE1-CB 4.02Å; F345-E347 HydrophobicContact CE1-CG 3.74Å
346	M	92.4	Very high	90.4	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.039	21%	0.214	C	C	.	.			trans	-121.6	104.9	-177.2	-66.4	-72	-74.2	0	0	108.6	V327 N348 G349 L397 V398 K405	V327-M346 HydrophobicContact CG2-CG 4.41Å; M346-N348 VanDerWaalsContact C-N 3.32Å; M346-N348 PolarHBondContact O-N 3.05Å; M346-G349 PolarHBondContact O-N 2.6Å; M346-G349 VanDerWaalsContact O-N 3.08Å; M346-L397 HydrophobicContact CB-CB 3.65Å; M346-L397 HydrophobicContact CB-CD1 4.01Å; M346-L397 HydrophobicContact CB-CG 4.46Å; M346-L397 HydrophobicContact CE-CB 4Å; M346-L397 VanDerWaalsContact CE-O 3.3Å; M346-L397 WeakPolarHBondContact CE-O 3.38Å; M346-L397 HydrophobicContact CG-CB 3.74Å; M346-L397 HydrophobicContact CG-CD1 3.94Å; M346-V398 CarbonylContact C-O 3.54Å; M346-K405 HydrophobicContact CE-CB 3.87Å; M346-K405 HydrophobicContact CE-CD 3.87Å; M346-K405 HydrophobicContact CE-CG 3.74Å; M346-K405 HydrophobicContact SD-CD 3.94Å; M346-K405 HydrophobicContact SD-CG 4.47Å
347	E	91.1	Very high	91.4	Very high	83 Å²	83	41.5 Å²	41.5	39%	0.388	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.8	-155.3	-47.8	96.2	123.9	0	0	113.8	F345 V398 S399 S400	F345-E347 HydrophobicContact CD1-CG 3.91Å; F345-E347 HydrophobicContact CE1-CB 4.02Å; F345-E347 HydrophobicContact CE1-CG 3.74Å; E347-V398 PolarHBondContact N-O 2.94Å; E347-S399 VanDerWaalsContact OE2-CA 3.29Å; E347-S399 WeakPolarHBondContact OE2-CA 3.14Å; E347-S400 VanDerWaalsContact CD-CB 3.47Å; E347-S400 WeakPolarHBondContact OE1-CB 3.32Å; E347-S400 PolarHBondContact OE1-OG 3.14Å; E347-S400 PolarHBondContact OE2-N 3.34Å
348	N	92.6	Very high	92.1	Very high	65 Å²	65	37.9 Å²	37.9	35%	0.348	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	11.4	176.9	-77.6	-53.7	0	0	0	112.9	M346 Y354 V398 S399	M346-N348 VanDerWaalsContact C-N 3.32Å; M346-N348 PolarHBondContact O-N 3.05Å; N348-Y354 HydrophobicContact CB-CD2 3.82Å; N348-Y354 HydrophobicContact CB-CE2 4.06Å; N348-V398 WeakPolarHBondContact CA-O 3.22Å; N348-V398 HydrophobicContact CB-CB 3.79Å; N348-V398 HydrophobicContact CB-CG1 3.88Å; N348-V398 WeakPolarHBondContact CB-O 3.45Å; N348-V398 PolarHBondContact N-O 3.26Å; N348-S399 PolarHBondContact ND2-O 3.14Å
349	G	93.5	Very high	92.7	Very high	33 Å²	33	41 Å²	41	34%	0.34	20%	0.202	S	C	.	.			trans	66.6	-150.8	174	0	0	0	0	0	113.7	M346 L397 V398	M346-G349 PolarHBondContact O-N 2.6Å; M346-G349 VanDerWaalsContact O-N 3.08Å; G349-L397 CarbonylContact O-C 3.59Å; G349-L397 VanDerWaalsContact O-CA 3.29Å; G349-L397 WeakPolarHBondContact O-CA 3.42Å; G349-V398 PolarHBondContact O-N 3.14Å
350	C	95.1	Very high	93.1	Very high	29 Å²	29	43.4 Å²	43.4	20%	0.196	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-82.6	143.8	179.7	72.9	0	0	0	0	112.9	L352 N353 Y354 R394 C396 L397	C350-L352 VanDerWaalsContact C-N 3.26Å; C350-L352 PolarHBondContact O-N 3.45Å; C350-N353 PolarHBondContact O-N 2.77Å; C350-Y354 PolarHBondContact O-N 3.21Å; C350-R394 WeakPolarHBondContact CB-O 3.41Å; C350-C396 CarbonylContact C-O 3.58Å; C350-C396 WeakPolarHBondContact CA-O 3.34Å; C350-L397 HydrophobicContact CB-CD2 3.86Å
351	L	97.8	Very high	93.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-37.6	-175.9	173	66.8	0	0	0	112.2	N353 Y354 L355 V370 I374 A393 C396 V398 V404 V459	L351-N353 VanDerWaalsContact C-N 3.31Å; L351-N353 PolarHBondContact O-N 2.9Å; L351-Y354 HydrophobicContact CD1-CD1 4.48Å; L351-Y354 PolarHBondContact O-N 3.28Å; L351-L355 HydrophobicContact CD1-CD1 4.08Å; L351-L355 HydrophobicContact CD1-CD2 4.27Å; L351-L355 HydrophobicContact CD1-CG 3.83Å; L351-L355 HydrophobicContact CG-CD1 3.87Å; L351-L355 HydrophobicContact CG-CG 4.14Å; L351-L355 WeakPolarHBondContact O-CB 3.42Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.03Å; L351-V370 HydrophobicContact CD1-CG1 3.82Å; L351-V370 HydrophobicContact CD1-CG2 4.4Å; L351-V370 HydrophobicContact CD2-CG1 3.54Å; L351-V370 HydrophobicContact CG-CG1 4.34Å; L351-I374 HydrophobicContact CD2-CD1 3.83Å; L351-A393 WeakPolarHBondContact CB-O 3.29Å; L351-A393 HydrophobicContact CD2-CB 4.23Å; L351-A393 HydrophobicContact CG-CB 4.36Å; L351-C396 HydrophobicContact CB-CB 4.04Å; L351-C396 WeakPolarHBondContact CB-O 3.45Å; L351-C396 HydrophobicContact CD2-CB 4.06Å; L351-C396 PolarHBondContact N-O 2.86Å; L351-V398 HydrophobicContact CB-CG2 3.94Å; L351-V398 HydrophobicContact CD1-CG2 4.02Å; L351-V404 HydrophobicContact CD2-CG1 4.32Å; L351-V459 HydrophobicContact CD2-CG2 4.04Å
352	L	97.1	Very high	93.5	Very high	20 Å²	20	49.7 Å²	49.7	11%	0.105	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-38.9	177.6	-176.7	60.3	0	0	0	113.1	C350 R356 A393 R394	C350-L352 VanDerWaalsContact C-N 3.26Å; C350-L352 PolarHBondContact O-N 3.45Å; L352-R356 VanDerWaalsContact O-CD 3.3Å; L352-R356 WeakPolarHBondContact O-CD 3.49Å; L352-R356 VanDerWaalsContact O-CG 3.27Å; L352-R356 WeakPolarHBondContact O-CG 3.42Å; L352-A393 HydrophobicContact CB-CB 4.14Å; L352-A393 HydrophobicContact CD1-CB 4.42Å; L352-A393 PolarHBondContact N-O 3.44Å; L352-R394 HydrophobicContact CD2-CB 4.14Å
353	N	95.8	Very high	93.6	Very high	74 Å²	74	58 Å²	58	40%	0.396	29%	0.293	S	S	.	.	H	α-helix	trans	-77.4	-45.4	176.6	-72	-2.9	0	0	0	110.5	C350 L351 L355 R356 E357	C350-N353 PolarHBondContact O-N 2.77Å; L351-N353 VanDerWaalsContact C-N 3.31Å; L351-N353 PolarHBondContact O-N 2.9Å; N353-L355 VanDerWaalsContact C-N 3.29Å; N353-L355 PolarHBondContact O-N 3.29Å; N353-R356 WeakPolarHBondContact O-CB 3.49Å; N353-R356 PolarHBondContact O-N 3.37Å; N353-E357 WeakPolarHBondContact O-CG 3.49Å; N353-E357 PolarHBondContact O-N 3.35Å
354	Y	96.8	Very high	93.7	Very high	24 Å²	24	61.3 Å²	61.3	9%	0.094	31%	0.305	C	S	.	.	H	α-helix	trans	-53.5	-43.1	176.4	-178.3	-94.8	0	0	0	113	N348 C350 L351 R356 N358 L362 V398 C402	N348-Y354 HydrophobicContact CB-CD2 3.82Å; N348-Y354 HydrophobicContact CB-CE2 4.06Å; C350-Y354 PolarHBondContact O-N 3.21Å; L351-Y354 HydrophobicContact CD1-CD1 4.48Å; L351-Y354 PolarHBondContact O-N 3.28Å; Y354-R356 VanDerWaalsContact C-N 3.35Å; Y354-R356 PolarHBondContact O-N 3.16Å; Y354-N358 WeakPolarHBondContact O-CB 3.43Å; Y354-N358 PolarHBondContact O-N 2.97Å; Y354-N358 VanDerWaalsContact O-N 3.08Å; Y354-N358 PolarHBondContact O-ND2 3.22Å; Y354-L362 HydrophobicContact CE1-CD2 4.03Å; Y354-V398 HydrophobicContact CD1-CG1 4.43Å; Y354-V398 HydrophobicContact CD1-CG2 4.31Å; Y354-V398 HydrophobicContact CD2-CG1 4.28Å; Y354-V398 HydrophobicContact CE1-CG1 4.42Å; Y354-V398 HydrophobicContact CE2-CG1 4.25Å; Y354-V398 HydrophobicContact CG-CB 4.49Å; Y354-V398 HydrophobicContact CG-CG1 4.35Å; Y354-V398 HydrophobicContact CG-CG2 4.14Å; Y354-C402 PolarHBondContact OH-SG 2.92Å; Y354-C402 VanDerWaalsContact OH-SG 3.41Å
355	L	97.6	Very high	93.7	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-39.8	174.7	-74.6	167.7	0	0	0	112.5	L351 N353 K359 L362 L367 A393 V459	L351-L355 HydrophobicContact CD1-CD1 4.08Å; L351-L355 HydrophobicContact CD1-CD2 4.27Å; L351-L355 HydrophobicContact CD1-CG 3.83Å; L351-L355 HydrophobicContact CG-CD1 3.87Å; L351-L355 HydrophobicContact CG-CG 4.14Å; L351-L355 WeakPolarHBondContact O-CB 3.42Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.03Å; N353-L355 VanDerWaalsContact C-N 3.29Å; N353-L355 PolarHBondContact O-N 3.29Å; L355-K359 WeakPolarHBondContact O-CA 3.47Å; L355-K359 PolarHBondContact O-N 2.87Å; L355-K359 VanDerWaalsContact O-N 3.11Å; L355-L362 HydrophobicContact CD2-CD1 3.77Å; L355-L367 HydrophobicContact CD2-CD2 3.84Å; L355-A393 HydrophobicContact CD1-CB 4.46Å; L355-V459 HydrophobicContact CD1-CG2 4.19Å; L355-V459 HydrophobicContact CD2-CG1 4.49Å
356	R	97.4	Very high	93.7	Very high	104 Å²	104	62.7 Å²	62.7	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-75.2	-41	-177.9	-71	168.5	175.6	172.4	-0.5	112.3	L352 N353 Y354 N358 K359 G463	L352-R356 VanDerWaalsContact O-CD 3.3Å; L352-R356 WeakPolarHBondContact O-CD 3.49Å; L352-R356 VanDerWaalsContact O-CG 3.27Å; L352-R356 WeakPolarHBondContact O-CG 3.42Å; N353-R356 WeakPolarHBondContact O-CB 3.49Å; N353-R356 PolarHBondContact O-N 3.37Å; Y354-R356 VanDerWaalsContact C-N 3.35Å; Y354-R356 PolarHBondContact O-N 3.16Å; R356-N358 VanDerWaalsContact C-N 3.33Å; R356-K359 VanDerWaalsContact O-CB 3.24Å; R356-K359 WeakPolarHBondContact O-CB 3.29Å; R356-K359 PolarHBondContact O-N 2.77Å; R356-G463 VanDerWaalsContact CZ-O 3.3Å; R356-G463 PolarHBondContact NE-O 2.94Å; R356-G463 PolarHBondContact NH2-O 3.36Å
357	E	96.5	Very high	93.8	Very high	124 Å²	124	62.4 Å²	62.4	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-71.1	-29.7	179.3	-69.1	166.2	-156.6	0	0	112.2	N353 K361	N353-E357 WeakPolarHBondContact O-CG 3.49Å; N353-E357 PolarHBondContact O-N 3.35Å; E357-K361 PolarHBondContact O-NZ 2.9Å
358	N	94.9	Very high	94	Very high	42 Å²	42	58.4 Å²	58.4	23%	0.225	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	11.5	177.2	-63.7	-73.9	0	0	0	114	Y354 R356 G360 K361 L362	Y354-N358 WeakPolarHBondContact O-CB 3.43Å; Y354-N358 PolarHBondContact O-N 2.97Å; Y354-N358 VanDerWaalsContact O-N 3.08Å; Y354-N358 PolarHBondContact O-ND2 3.22Å; R356-N358 VanDerWaalsContact C-N 3.33Å; N358-G360 PolarHBondContact O-N 2.82Å; N358-K361 WeakPolarHBondContact O-CA 3.26Å; N358-K361 WeakPolarHBondContact O-CB 3.5Å; N358-K361 PolarHBondContact O-N 3.37Å; N358-L362 HydrophobicContact CB-CD1 4.13Å; N358-L362 HydrophobicContact CB-CD2 3.78Å; N358-L362 HydrophobicContact CB-CG 3.77Å; N358-L362 PolarHBondContact O-N 3.41Å
359	K	95.1	Very high	93.9	Very high	115 Å²	115	55.5 Å²	55.5	50%	0.5	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	131.1	-179.8	-174.2	170.4	-174.8	171.9	0	112.7	L355 R356 K361 E462	L355-K359 WeakPolarHBondContact O-CA 3.47Å; L355-K359 PolarHBondContact O-N 2.87Å; L355-K359 VanDerWaalsContact O-N 3.11Å; R356-K359 VanDerWaalsContact O-CB 3.24Å; R356-K359 WeakPolarHBondContact O-CB 3.29Å; R356-K359 PolarHBondContact O-N 2.77Å; K359-K361 PolarHBondContact O-N 2.8Å; K359-E462 WeakPolarHBondContact CA-OE1 3.29Å; K359-E462 HydrophobicContact CB-CB 4.32Å; K359-E462 HydrophobicContact CD-CB 4.33Å; K359-E462 HydrophobicContact CG-CB 3.88Å; K359-E462 WeakPolarHBondContact CG-OE2 3.26Å
360	G	93.8	Very high	94	Very high	69 Å²	69	54.1 Å²	54.1	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-3.2	-174.5	0	0	0	0	0	115	N358 E462	N358-G360 PolarHBondContact O-N 2.82Å; G360-E462 PolarHBondContact N-OE1 3.19Å; G360-E462 PolarHBondContact N-OE2 2.79Å
361	K	92.6	Very high	94.2	Very high	145 Å²	145	52.7 Å²	52.7	63%	0.63	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-22.3	178.7	-45.4	170.8	-165.7	153.2	0	112.3	E357 N358 K359	E357-K361 PolarHBondContact O-NZ 2.9Å; N358-K361 WeakPolarHBondContact O-CA 3.26Å; N358-K361 WeakPolarHBondContact O-CB 3.5Å; N358-K361 PolarHBondContact O-N 3.37Å; K359-K361 PolarHBondContact O-N 2.8Å
362	L	90.2	Very high	94.1	Very high	27 Å²	27	52.9 Å²	52.9	14%	0.141	25%	0.253	C	S	.	.			trans	-76	130.2	-177.6	-63.7	176.9	0	0	0	111	Y354 L355 N358 M366 L367	Y354-L362 HydrophobicContact CE1-CD2 4.03Å; L355-L362 HydrophobicContact CD2-CD1 3.77Å; N358-L362 HydrophobicContact CB-CD1 4.13Å; N358-L362 HydrophobicContact CB-CD2 3.78Å; N358-L362 HydrophobicContact CB-CG 3.77Å; N358-L362 PolarHBondContact O-N 3.41Å; L362-M366 HydrophobicContact CD2-CG 4.46Å; L362-L367 HydrophobicContact CB-CD2 4.04Å; L362-L367 HydrophobicContact CB-CG 4.44Å; L362-L367 HydrophobicContact CD1-CD2 3.89Å
363	R	90	Very high	93.9	Very high	175 Å²	175	52.1 Å²	52.1	66%	0.66	25%	0.249	S	C	*	.			trans	-78.9	154.3	174.6	-56.7	-173.6	-176.6	174.8	-0.3	111.1	E365 M366 L367	R363-E365 VanDerWaalsContact C-N 3.29Å; R363-E365 VanDerWaalsContact CB-OE2 3.28Å; R363-E365 WeakPolarHBondContact CB-OE2 3.22Å; R363-E365 WeakPolarHBondContact CD-OE2 3.37Å; R363-E365 PolarHBondContact O-N 3.01Å; R363-M366 VanDerWaalsContact O-CB 3.32Å; R363-M366 WeakPolarHBondContact O-CB 3.42Å; R363-M366 PolarHBondContact O-N 3.17Å; R363-L367 PolarHBondContact O-N 3.23Å
364	K	90.1	Very high	94	Very high	86 Å²	86	48.6 Å²	48.6	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-41.2	-178.2	-62	-177	-177.2	-175.6	0	111.2	M366 L367 L368 L490 W527	K364-M366 PolarHBondContact O-N 2.95Å; K364-L367 WeakPolarHBondContact O-CA 3.24Å; K364-L367 WeakPolarHBondContact O-CB 3.33Å; K364-L367 PolarHBondContact O-N 2.87Å; K364-L368 PolarHBondContact O-N 2.93Å; K364-L490 WeakPolarHBondContact CD-O 3.46Å; K364-L490 WeakPolarHBondContact CE-O 3.28Å; K364-W527 VanDerWaalsContact C-CH2 3.5Å; K364-W527 HydrophobicContact CB-CH2 3.57Å; K364-W527 HydrophobicContact CB-CZ2 3.91Å; K364-W527 HydrophobicContact CB-CZ3 4.07Å; K364-W527 VanDerWaalsContact O-CH2 3.29Å; K364-W527 WeakPolarHBondContact O-CH2 3.46Å; K364-W527 WeakPolarHBondContact O-CZ3 3.44Å
365	E	87.3	Confident	94.1	Very high	70 Å²	70	47.4 Å²	47.4	33%	0.327	23%	0.226	S	C	.	.	H	α-helix	trans	-52.2	-38.9	174.2	-47.7	82.5	-98.9	0	0	112.3	N158 R363 S369 W527	N158-E365 HydrophobicContact CB-CB 4.3Å; R363-E365 VanDerWaalsContact C-N 3.29Å; R363-E365 VanDerWaalsContact CB-OE2 3.28Å; R363-E365 WeakPolarHBondContact CB-OE2 3.22Å; R363-E365 WeakPolarHBondContact CD-OE2 3.37Å; R363-E365 PolarHBondContact O-N 3.01Å; E365-S369 PolarHBondContact O-N 2.93Å; E365-S369 VanDerWaalsContact O-N 3.14Å; E365-W527 HydrophobicContact CG-CE3 4.44Å
366	M	89.3	Confident	93.9	Very high	22 Å²	22	48.6 Å²	48.6	11%	0.108	23%	0.231	C	C	.	.	H	α-helix	trans	-69.6	-47.1	175.4	-177.7	62.9	-161.2	0	0	111	R162 L362 R363 K364 L368 S369 V370 C402	R162-M366 PolarHBondContact NH1-SD 3.43Å; R162-M366 VanDerWaalsContact NH1-SD 3.39Å; L362-M366 HydrophobicContact CD2-CG 4.46Å; R363-M366 VanDerWaalsContact O-CB 3.32Å; R363-M366 WeakPolarHBondContact O-CB 3.42Å; R363-M366 PolarHBondContact O-N 3.17Å; K364-M366 PolarHBondContact O-N 2.95Å; M366-L368 VanDerWaalsContact C-N 3.31Å; M366-L368 PolarHBondContact O-N 3.49Å; M366-S369 WeakPolarHBondContact CA-OG 3.28Å; M366-S369 PolarHBondContact O-N 2.8Å; M366-S369 PolarHBondContact O-OG 3.33Å; M366-V370 HydrophobicContact CE-CG2 3.96Å; M366-V370 WeakPolarHBondContact O-CG2 3.5Å; M366-V370 PolarHBondContact O-N 3.36Å; M366-C402 HydrophobicContact CE-CB 3.6Å
367	L	95.3	Very high	93.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-39.1	178.3	-61.1	178.9	0	0	0	112.3	L355 L362 R363 K364 V370 C371 V459 F460 L490	L355-L367 HydrophobicContact CD2-CD2 3.84Å; L362-L367 HydrophobicContact CB-CD2 4.04Å; L362-L367 HydrophobicContact CB-CG 4.44Å; L362-L367 HydrophobicContact CD1-CD2 3.89Å; R363-L367 PolarHBondContact O-N 3.23Å; K364-L367 WeakPolarHBondContact O-CA 3.24Å; K364-L367 WeakPolarHBondContact O-CB 3.33Å; K364-L367 PolarHBondContact O-N 2.87Å; L367-V370 WeakPolarHBondContact O-CB 3.43Å; L367-V370 PolarHBondContact O-N 2.83Å; L367-C371 PolarHBondContact O-N 3.08Å; L367-C371 PolarHBondContact O-SG 2.8Å; L367-V459 HydrophobicContact CB-CG1 3.86Å; L367-V459 HydrophobicContact CD2-CG1 3.87Å; L367-V459 HydrophobicContact CG-CG1 4.41Å; L367-V459 WeakPolarHBondContact O-CG1 3.29Å; L367-F460 HydrophobicContact CB-CD1 4.41Å; L367-F460 HydrophobicContact CB-CE1 4.04Å; L367-F460 HydrophobicContact CB-CE2 4.34Å; L367-F460 HydrophobicContact CB-CZ 4Å; L367-F460 HydrophobicContact CD1-CD1 4.23Å; L367-F460 HydrophobicContact CD1-CE1 4.48Å; L367-L490 HydrophobicContact CD1-CB 4.43Å; L367-L490 HydrophobicContact CD1-CD1 3.67Å
368	L	94.9	Very high	93.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.3	-40.3	172.4	-178.2	53	0	0	0	112.3	K364 M366 V370 C371 Q372 F460 I495 L520 I523 A524 W527	K364-L368 PolarHBondContact O-N 2.93Å; M366-L368 VanDerWaalsContact C-N 3.31Å; M366-L368 PolarHBondContact O-N 3.49Å; L368-V370 PolarHBondContact O-N 3.12Å; L368-C371 CarbonylContact O-C 3.58Å; L368-C371 PolarHBondContact O-N 2.92Å; L368-Q372 HydrophobicContact CD1-CG 4.21Å; L368-Q372 HydrophobicContact CG-CG 4.35Å; L368-Q372 WeakPolarHBondContact O-CG 3.26Å; L368-Q372 PolarHBondContact O-N 3.44Å; L368-F460 HydrophobicContact CB-CZ 4.42Å; L368-I495 HydrophobicContact CD1-CD1 3.66Å; L368-I495 HydrophobicContact CD2-CD1 4.28Å; L368-L520 HydrophobicContact CD1-CB 4.19Å; L368-L520 HydrophobicContact CD1-CD2 3.66Å; L368-L520 HydrophobicContact CD1-CG 4.47Å; L368-I523 HydrophobicContact CD2-CG2 4.16Å; L368-A524 HydrophobicContact CD2-CB 3.72Å; L368-A524 HydrophobicContact CG-CB 4.39Å; L368-W527 HydrophobicContact CB-CE3 4.17Å; L368-W527 HydrophobicContact CB-CH2 3.84Å; L368-W527 HydrophobicContact CB-CZ3 3.3Å; L368-W527 HydrophobicContact CD2-CD2 4.34Å; L368-W527 HydrophobicContact CD2-CE3 3.64Å; L368-W527 HydrophobicContact CD2-CH2 4.19Å; L368-W527 HydrophobicContact CD2-CZ3 3.55Å; L368-W527 HydrophobicContact CG-CZ3 4.08Å
369	S	91.6	Very high	94	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-32.1	177.2	69.5	0	0	0	0	112.8	E365 M366 Q372 D373	E365-S369 PolarHBondContact O-N 2.93Å; E365-S369 VanDerWaalsContact O-N 3.14Å; M366-S369 WeakPolarHBondContact CA-OG 3.28Å; M366-S369 PolarHBondContact O-N 2.8Å; M366-S369 PolarHBondContact O-OG 3.33Å; S369-Q372 PolarHBondContact O-N 3.45Å; S369-D373 WeakPolarHBondContact O-CB 3.45Å; S369-D373 PolarHBondContact O-N 2.86Å
370	V	95.8	Very high	93.8	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.024	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-46.7	169.5	170.3	0	0	0	0	111.2	L351 M366 L367 L368 Q372 I374 V404 V459	L351-V370 HydrophobicContact CD1-CG1 3.82Å; L351-V370 HydrophobicContact CD1-CG2 4.4Å; L351-V370 HydrophobicContact CD2-CG1 3.54Å; L351-V370 HydrophobicContact CG-CG1 4.34Å; M366-V370 HydrophobicContact CE-CG2 3.96Å; M366-V370 WeakPolarHBondContact O-CG2 3.5Å; M366-V370 PolarHBondContact O-N 3.36Å; L367-V370 WeakPolarHBondContact O-CB 3.43Å; L367-V370 PolarHBondContact O-N 2.83Å; L368-V370 PolarHBondContact O-N 3.12Å; V370-Q372 VanDerWaalsContact C-N 3.34Å; V370-Q372 PolarHBondContact O-N 2.9Å; V370-I374 HydrophobicContact CG1-CD1 3.98Å; V370-I374 WeakPolarHBondContact O-CG1 3.28Å; V370-I374 PolarHBondContact O-N 3.37Å; V370-I374 VanDerWaalsContact O-N 3.16Å; V370-V404 HydrophobicContact CB-CG2 4.3Å; V370-V404 HydrophobicContact CG1-CG2 4.08Å; V370-V404 HydrophobicContact CG2-CG2 3.85Å; V370-V459 HydrophobicContact CB-CG1 4.39Å; V370-V459 HydrophobicContact CG1-CG1 4.25Å; V370-V459 HydrophobicContact CG1-CG2 3.84Å
371	C	98	Very high	93.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-36.2	177	-64	0	0	0	0	112.5	L367 L368 C375 F452 M456 L520	L367-C371 PolarHBondContact O-N 3.08Å; L367-C371 PolarHBondContact O-SG 2.8Å; L368-C371 CarbonylContact O-C 3.58Å; L368-C371 PolarHBondContact O-N 2.92Å; C371-C375 WeakPolarHBondContact O-CB 3.46Å; C371-C375 PolarHBondContact O-N 2.89Å; C371-F452 HydrophobicContact CB-CZ 4.49Å; C371-M456 HydrophobicContact CB-CG 4.35Å; C371-L520 HydrophobicContact CB-CD1 4.43Å
372	Q	95.8	Very high	93.9	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.019	11%	0.108	C	C	.	.	H	α-helix	trans	-68.4	-46.4	176.3	-70.9	179.4	-80.5	0	0	112	L368 S369 V370 I374 C375 E376 L520 T521	L368-Q372 HydrophobicContact CD1-CG 4.21Å; L368-Q372 HydrophobicContact CG-CG 4.35Å; L368-Q372 WeakPolarHBondContact O-CG 3.26Å; L368-Q372 PolarHBondContact O-N 3.44Å; S369-Q372 PolarHBondContact O-N 3.45Å; V370-Q372 VanDerWaalsContact C-N 3.34Å; V370-Q372 PolarHBondContact O-N 2.9Å; Q372-I374 VanDerWaalsContact C-N 3.31Å; Q372-I374 PolarHBondContact O-N 2.8Å; Q372-C375 PolarHBondContact O-N 2.68Å; Q372-C375 VanDerWaalsContact O-N 3.16Å; Q372-E376 PolarHBondContact O-N 3.43Å; Q372-L520 HydrophobicContact CG-CB 3.88Å; Q372-T521 PolarHBondContact NE2-OG1 2.86Å
373	D	93.6	Very high	94	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-53.8	-47.4	175.2	-84.3	8.6	0	0	0	111.4	Q159 K325 S369 G377 T403 V404	Q159-D373 PolarHBondContact NE2-OD1 3.08Å; K325-D373 VanDerWaalsContact CB-O 3.25Å; K325-D373 WeakPolarHBondContact CB-O 3.44Å; K325-D373 HydrophobicContact CD-CB 3.98Å; K325-D373 WeakPolarHBondContact CE-OD1 3.46Å; K325-D373 VanDerWaalsContact CG-O 3.27Å; K325-D373 WeakPolarHBondContact CG-O 3.42Å; K325-D373 IonicContact NZ-OD1 3.8Å; K325-D373 PolarHBondContact NZ-OD1 3.13Å; K325-D373 IonicContact NZ-OD2 3.53Å; S369-D373 WeakPolarHBondContact O-CB 3.45Å; S369-D373 PolarHBondContact O-N 2.86Å; D373-G377 PolarHBondContact O-N 3.2Å; D373-G377 VanDerWaalsContact O-N 3.11Å; D373-T403 WeakPolarHBondContact OD2-CG2 3.42Å; D373-V404 HydrophobicContact CB-CB 4.13Å; D373-V404 PolarHBondContact OD2-N 3.36Å
374	I	98.3	Very high	93.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-71	-37	179	-63.9	166.8	0	0	0	111.3	L351 V370 Q372 G377 M378 L391 C396 V404 I406 F452 L455	L351-I374 HydrophobicContact CD2-CD1 3.83Å; V370-I374 HydrophobicContact CG1-CD1 3.98Å; V370-I374 WeakPolarHBondContact O-CG1 3.28Å; V370-I374 PolarHBondContact O-N 3.37Å; V370-I374 VanDerWaalsContact O-N 3.16Å; Q372-I374 VanDerWaalsContact C-N 3.31Å; Q372-I374 PolarHBondContact O-N 2.8Å; I374-G377 PolarHBondContact O-N 2.86Å; I374-M378 HydrophobicContact CG2-CG 4.42Å; I374-M378 WeakPolarHBondContact O-CG 3.27Å; I374-M378 PolarHBondContact O-N 3.47Å; I374-L391 HydrophobicContact CG2-CD1 4.08Å; I374-C396 HydrophobicContact CD1-CB 4.14Å; I374-V404 HydrophobicContact CD1-CG1 3.91Å; I374-V404 HydrophobicContact CG1-CB 4.48Å; I374-V404 HydrophobicContact CG1-CG1 3.83Å; I374-I406 HydrophobicContact CG2-CD1 4.05Å; I374-I406 HydrophobicContact CG2-CG1 4.26Å; I374-F452 HydrophobicContact CB-CE2 4.21Å; I374-F452 HydrophobicContact CG2-CD2 3.94Å; I374-F452 HydrophobicContact CG2-CE2 3.9Å; I374-L455 HydrophobicContact CD1-CD1 4.12Å; I374-L455 HydrophobicContact CD1-CD2 3.55Å; I374-L455 HydrophobicContact CD1-CG 4.48Å; I374-L455 HydrophobicContact CG2-CD1 4.2Å; I374-L455 HydrophobicContact CG2-CD2 4.46Å
375	C	98.3	Very high	93.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.8	-36.6	178	-161.2	0	0	0	0	112.4	C371 Q372 M378 E379 F452 F513 L516 L517 L520	C371-C375 WeakPolarHBondContact O-CB 3.46Å; C371-C375 PolarHBondContact O-N 2.89Å; Q372-C375 PolarHBondContact O-N 2.68Å; Q372-C375 VanDerWaalsContact O-N 3.16Å; C375-M378 PolarHBondContact O-N 2.99Å; C375-E379 WeakPolarHBondContact O-CB 3.5Å; C375-E379 PolarHBondContact O-N 3.23Å; C375-F452 HydrophobicContact CB-CE1 4.43Å; C375-F452 HydrophobicContact CB-CE2 4.08Å; C375-F452 HydrophobicContact CB-CZ 3.69Å; C375-F513 PolarHBondContact SG-O 3.06Å; C375-L516 VanDerWaalsContact SG-CB 3.56Å; C375-L517 HydrophobicContact CB-CD1 4.16Å; C375-L517 PolarHBondContact SG-N 3.49Å; C375-L517 VanDerWaalsContact SG-N 3.37Å; C375-L520 HydrophobicContact CB-CD1 3.94Å
376	E	94.1	Very high	93.7	Very high	26 Å²	26	20 Å²	20	12%	0.121	9%	0.094	C	C	.	.	H	α-helix	trans	-67.8	-38.1	173.5	-167.1	-172.3	-149.5	0	0	110.8	N154 H323 K325 Q372 Y380 L517	N154-E376 PolarHBondContact ND2-OE1 2.75Å; H323-E376 PolarHBondContact CE1-O 2.83Å; K325-E376 WeakPolarHBondContact CE-OE2 3.44Å; K325-E376 HydrophobicContact CG-CB 4.19Å; K325-E376 HydrophobicContact CG-CG 4.46Å; K325-E376 WeakPolarHBondContact CG-OE2 3.4Å; K325-E376 IonicContact NZ-OE2 2.81Å; Q372-E376 PolarHBondContact O-N 3.43Å; E376-Y380 PolarHBondContact O-N 2.95Å; E376-L517 HydrophobicContact CB-CD1 4.1Å; E376-L517 HydrophobicContact CB-CD2 4.21Å; E376-L517 HydrophobicContact CG-CD2 4.26Å
377	G	93.8	Very high	93.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61	-43.6	170.7	0	0	0	0	0	113.7	D373 I374 L381	D373-G377 PolarHBondContact O-N 3.2Å; D373-G377 VanDerWaalsContact O-N 3.11Å; I374-G377 PolarHBondContact O-N 2.86Å; G377-L381 PolarHBondContact O-N 3.16Å
378	M	98.3	Very high	93.8	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-75.8	-31.4	179.4	-69.5	-55.3	-51.9	0	0	113.8	I374 C375 Y380 L381 E382 H388 L391 I406 D448 F513	I374-M378 HydrophobicContact CG2-CG 4.42Å; I374-M378 WeakPolarHBondContact O-CG 3.27Å; I374-M378 PolarHBondContact O-N 3.47Å; C375-M378 PolarHBondContact O-N 2.99Å; M378-Y380 VanDerWaalsContact C-N 3.3Å; M378-Y380 PolarHBondContact O-N 3.34Å; M378-L381 HydrophobicContact CE-CB 4.42Å; M378-L381 HydrophobicContact CE-CD1 4.05Å; M378-L381 PolarHBondContact O-N 2.84Å; M378-L381 VanDerWaalsContact O-N 3.16Å; M378-L381 HydrophobicContact SD-CD1 3.8Å; M378-E382 WeakPolarHBondContact O-CB 3.42Å; M378-E382 PolarHBondContact O-N 3.45Å; M378-H388 HydrophobicContact CE-CB 4.07Å; M378-H388 HydrophobicContact SD-CB 4.39Å; M378-L391 HydrophobicContact CE-CD2 4.26Å; M378-L391 HydrophobicContact CG-CD1 4.42Å; M378-L391 HydrophobicContact CG-CD2 3.75Å; M378-L391 HydrophobicContact SD-CD1 4.01Å; M378-L391 HydrophobicContact SD-CD2 3.78Å; M378-L391 HydrophobicContact SD-CG 4.4Å; M378-I406 HydrophobicContact CG-CD1 3.65Å; M378-I406 HydrophobicContact SD-CD1 3.56Å; M378-I406 VanDerWaalsContact SD-CD1 3.56Å; M378-D448 HydrophobicContact CE-CB 3.71Å; M378-F513 HydrophobicContact CB-CB 4.4Å; M378-F513 HydrophobicContact CB-CD1 3.36Å; M378-F513 HydrophobicContact CB-CD2 3.89Å; M378-F513 HydrophobicContact CB-CE1 3.35Å; M378-F513 HydrophobicContact CB-CE2 3.87Å; M378-F513 HydrophobicContact CB-CG 3.62Å; M378-F513 HydrophobicContact CB-CZ 3.61Å; M378-F513 HydrophobicContact CE-CE2 3.85Å; M378-F513 HydrophobicContact CE-CZ 3.86Å; M378-F513 HydrophobicContact CG-CD1 4.23Å; M378-F513 HydrophobicContact CG-CE1 3.73Å; M378-F513 HydrophobicContact CG-CE2 4.45Å; M378-F513 HydrophobicContact CG-CZ 3.84Å
379	E	97.4	Very high	93.7	Very high	31 Å²	31	19.7 Å²	19.7	15%	0.145	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-41.3	171.4	-173.9	-78.7	153.9	0	0	110.8	C375 L381 E382 R383 F513 A514 L517	C375-E379 WeakPolarHBondContact O-CB 3.5Å; C375-E379 PolarHBondContact O-N 3.23Å; E379-L381 VanDerWaalsContact C-N 3.34Å; E379-L381 PolarHBondContact O-N 3.15Å; E379-E382 PolarHBondContact O-N 2.92Å; E379-R383 VanDerWaalsContact O-CB 3.26Å; E379-R383 WeakPolarHBondContact O-CB 3.19Å; E379-R383 PolarHBondContact O-N 3.11Å; E379-R383 IonicContact OE1-CZ 3.9Å; E379-R383 IonicContact OE1-NE 3.41Å; E379-R383 IonicContact OE1-NH1 3.75Å; E379-R383 PolarHBondContact OE1-NH1 2.94Å; E379-R383 IonicContact OE2-CZ 2.66Å; E379-R383 IonicContact OE2-NH1 3.15Å; E379-R383 PolarHBondContact OE2-NH1 3.19Å; E379-R383 IonicContact OE2-NH2 2.69Å; E379-F513 HydrophobicContact CB-CB 3.95Å; E379-A514 HydrophobicContact CG-CB 4.05Å; E379-L517 HydrophobicContact CB-CD2 4.49Å
380	Y	92.5	Very high	93.8	Very high	27 Å²	27	20.6 Å²	20.6	11%	0.106	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-40.1	172.9	175.3	-83.4	0	0	0	112.1	L321 S322 H323 L326 E376 M378 N384	L321-Y380 HydrophobicContact CD2-CE1 3.88Å; S322-Y380 PolarHBondContact N-OH 3.32Å; S322-Y380 WeakPolarHBondContact O-CE2 3.39Å; S322-Y380 PolarHBondContact O-OH 3.42Å; S322-Y380 VanDerWaalsContact O-OH 3.1Å; H323-Y380 HydrophobicContact CB-CD1 3.88Å; H323-Y380 HydrophobicContact CB-CD2 3.79Å; H323-Y380 HydrophobicContact CB-CE1 4.02Å; H323-Y380 HydrophobicContact CB-CE2 3.94Å; H323-Y380 HydrophobicContact CB-CG 3.76Å; H323-Y380 AromaticContact CD2-CD2 3.67Å; H323-Y380 AromaticContact CD2-CG 3.98Å; H323-Y380 AromaticContact CG-CD2 3.77Å; H323-Y380 AromaticContact CG-CG 3.7Å; L326-Y380 HydrophobicContact CD1-CD1 3.65Å; L326-Y380 HydrophobicContact CD1-CE1 3.77Å; E376-Y380 PolarHBondContact O-N 2.95Å; M378-Y380 VanDerWaalsContact C-N 3.3Å; M378-Y380 PolarHBondContact O-N 3.34Å; Y380-N384 WeakPolarHBondContact O-CB 3.39Å; Y380-N384 PolarHBondContact O-N 2.62Å; Y380-N384 PolarHBondContact O-ND2 3.35Å
381	L	93.2	Very high	93.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.9	-48.3	176.8	-65.2	-177.5	0	0	0	111.9	L321 L326 G377 M378 E379 R383 N384 G385 Y386 H388 F409	L321-L381 HydrophobicContact CD1-CD2 3.92Å; L321-L381 HydrophobicContact CD2-CD2 3.57Å; L321-L381 HydrophobicContact CG-CD2 4.37Å; L326-L381 HydrophobicContact CD1-CD2 3.77Å; L326-L381 HydrophobicContact CD1-CG 4.4Å; L326-L381 HydrophobicContact CD2-CD1 4.35Å; L326-L381 HydrophobicContact CD2-CD2 4.44Å; L326-L381 HydrophobicContact CD2-CG 4.32Å; G377-L381 PolarHBondContact O-N 3.16Å; M378-L381 HydrophobicContact CE-CB 4.42Å; M378-L381 HydrophobicContact CE-CD1 4.05Å; M378-L381 PolarHBondContact O-N 2.84Å; M378-L381 VanDerWaalsContact O-N 3.16Å; M378-L381 HydrophobicContact SD-CD1 3.8Å; E379-L381 VanDerWaalsContact C-N 3.34Å; E379-L381 PolarHBondContact O-N 3.15Å; L381-R383 PolarHBondContact O-N 3.43Å; L381-N384 CarbonylContact O-C 3.58Å; L381-N384 PolarHBondContact O-N 3.4Å; L381-N384 VanDerWaalsContact O-N 3.16Å; L381-G385 PolarHBondContact O-N 2.9Å; L381-G385 VanDerWaalsContact O-N 3.11Å; L381-Y386 CarbonylContact C-O 3.53Å; L381-Y386 PolarHBondContact O-N 3.25Å; L381-H388 HydrophobicContact CD1-CB 4.28Å; L381-F409 HydrophobicContact CD1-CE1 4.34Å
382	E	95.5	Very high	93.8	Very high	41 Å²	41	20.4 Å²	20.4	19%	0.192	10%	0.095	C	C	.	.	H	α-helix	trans	-55	-50.7	176.7	-176.6	-179.2	-119.4	0	0	110.9	M378 E379 N384 G385 T512 F513	M378-E382 WeakPolarHBondContact O-CB 3.42Å; M378-E382 PolarHBondContact O-N 3.45Å; E379-E382 PolarHBondContact O-N 2.92Å; E382-N384 VanDerWaalsContact C-N 3.27Å; E382-N384 PolarHBondContact O-N 2.83Å; E382-G385 PolarHBondContact O-N 2.95Å; E382-G385 VanDerWaalsContact O-N 3.15Å; E382-T512 WeakPolarHBondContact OE1-CA 3.44Å; E382-T512 WeakPolarHBondContact OE2-CB 3.48Å; E382-F513 HydrophobicContact CB-CD2 4.1Å; E382-F513 HydrophobicContact CG-CD2 4.47Å; E382-F513 PolarHBondContact OE1-N 3.4Å; E382-F513 WeakPolarHBondContact OE2-CB 3.27Å; E382-F513 PolarHBondContact OE2-N 3.3Å
383	R	92.4	Very high	93.9	Very high	153 Å²	153	20.2 Å²	20.2	58%	0.577	9%	0.094	S	C	*	.	H	α-helix	trans	-65.1	-26.4	-179.9	-171.2	178	66.3	-129.7	-7.6	113.8	E379 L381	E379-R383 VanDerWaalsContact O-CB 3.26Å; E379-R383 WeakPolarHBondContact O-CB 3.19Å; E379-R383 PolarHBondContact O-N 3.11Å; E379-R383 IonicContact OE1-CZ 3.9Å; E379-R383 IonicContact OE1-NE 3.41Å; E379-R383 IonicContact OE1-NH1 3.75Å; E379-R383 PolarHBondContact OE1-NH1 2.94Å; E379-R383 IonicContact OE2-CZ 2.66Å; E379-R383 IonicContact OE2-NH1 3.15Å; E379-R383 PolarHBondContact OE2-NH1 3.19Å; E379-R383 IonicContact OE2-NH2 2.69Å; L381-R383 PolarHBondContact O-N 3.43Å
384	N	84.6	Confident	94	Very high	64 Å²	64	23.3 Å²	23.3	34%	0.342	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7.6	177.6	-72.7	-80.8	0	0	0	113.4	Y380 L381 E382 Y386 Y414	Y380-N384 WeakPolarHBondContact O-CB 3.39Å; Y380-N384 PolarHBondContact O-N 2.62Å; Y380-N384 PolarHBondContact O-ND2 3.35Å; L381-N384 CarbonylContact O-C 3.58Å; L381-N384 PolarHBondContact O-N 3.4Å; L381-N384 VanDerWaalsContact O-N 3.16Å; E382-N384 VanDerWaalsContact C-N 3.27Å; E382-N384 PolarHBondContact O-N 2.83Å; N384-Y386 HydrophobicContact CB-CD2 3.75Å; N384-Y386 HydrophobicContact CB-CE2 3.96Å; N384-Y386 VanDerWaalsContact O-CD2 3.26Å; N384-Y386 WeakPolarHBondContact O-CD2 3.41Å; N384-Y386 WeakPolarHBondContact O-CE2 3.35Å; N384-Y414 VanDerWaalsContact O-CE2 3.31Å; N384-Y414 WeakPolarHBondContact O-CE2 3.44Å
385	G	85.7	Confident	93.9	Very high	20 Å²	20	23.9 Å²	23.9	21%	0.206	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	31.7	177.5	0	0	0	0	0	114.3	L381 E382 Y414 V415	L381-G385 PolarHBondContact O-N 2.9Å; L381-G385 VanDerWaalsContact O-N 3.11Å; E382-G385 PolarHBondContact O-N 2.95Å; E382-G385 VanDerWaalsContact O-N 3.15Å; G385-Y414 CarbonylContact O-C 3.58Å; G385-Y414 WeakPolarHBondContact O-CA 3.26Å; G385-Y414 WeakPolarHBondContact O-CD2 3.49Å; G385-V415 PolarHBondContact O-N 3.32Å
386	Y	90.4	Very high	93.8	Very high	18 Å²	18	23.9 Å²	23.9	7%	0.071	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129	175.6	-69.7	-90.4	0	0	0	111.3	V317 K320 L321 L381 N384 T412 R413 Y414	V317-Y386 HydrophobicContact CB-CE1 4.5Å; V317-Y386 HydrophobicContact CG1-CD1 4Å; V317-Y386 HydrophobicContact CG1-CE1 3.89Å; V317-Y386 HydrophobicContact CG2-CE1 4.31Å; K320-Y386 WeakPolarHBondContact CB-OH 3.24Å; K320-Y386 VanDerWaalsContact CD-OH 3.27Å; K320-Y386 WeakPolarHBondContact CD-OH 3.27Å; L321-Y386 HydrophobicContact CD2-CD1 4.3Å; L321-Y386 HydrophobicContact CD2-CD2 3.72Å; L321-Y386 HydrophobicContact CD2-CE1 4.32Å; L321-Y386 HydrophobicContact CD2-CE2 3.75Å; L321-Y386 HydrophobicContact CD2-CG 4.01Å; L381-Y386 CarbonylContact C-O 3.53Å; L381-Y386 PolarHBondContact O-N 3.25Å; N384-Y386 HydrophobicContact CB-CD2 3.75Å; N384-Y386 HydrophobicContact CB-CE2 3.96Å; N384-Y386 VanDerWaalsContact O-CD2 3.26Å; N384-Y386 WeakPolarHBondContact O-CD2 3.41Å; N384-Y386 WeakPolarHBondContact O-CE2 3.35Å; Y386-T412 HydrophobicContact CD1-CG2 4.12Å; Y386-R413 WeakPolarHBondContact CA-O 3.44Å; Y386-Y414 HydrophobicContact CD1-CD2 4.42Å; Y386-Y414 HydrophobicContact CD2-CD2 4.23Å; Y386-Y414 HydrophobicContact CE1-CD2 4.09Å; Y386-Y414 HydrophobicContact CE1-CG 4.36Å; Y386-Y414 AromaticContact CE2-CD2 3.88Å; Y386-Y414 HydrophobicContact CE2-CD2 3.88Å; Y386-Y414 HydrophobicContact CE2-CE2 4.49Å; Y386-Y414 HydrophobicContact CG-CD2 4.49Å; Y386-Y414 AromaticContact CZ-CD2 3.8Å
387	I	92	Very high	93.9	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.9	172.8	-45	169.3	0	0	0	107.8	R389 T412 R413 V415 S444 D448	I387-R389 HydrophobicContact CB-CG 4.13Å; I387-R389 HydrophobicContact CG2-CG 3.63Å; I387-T412 CarbonylContact O-C 3.54Å; I387-T412 WeakPolarHBondContact O-CA 3.38Å; I387-T412 WeakPolarHBondContact O-CG2 3.47Å; I387-R413 PolarHBondContact N-O 2.77Å; I387-R413 PolarHBondContact O-N 3.07Å; I387-V415 HydrophobicContact CD1-CB 4.05Å; I387-V415 HydrophobicContact CD1-CG1 4.44Å; I387-V415 HydrophobicContact CD1-CG2 3.67Å; I387-V415 HydrophobicContact CG1-CG2 4.22Å; I387-S444 WeakPolarHBondContact CG2-O 3.43Å; I387-D448 WeakPolarHBondContact CA-OD2 3.37Å; I387-D448 VanDerWaalsContact CG2-OD2 3.22Å; I387-D448 WeakPolarHBondContact CG2-OD2 3.31Å
388	H	94.3	Very high	94	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.112	C	C	.	.			trans	-75.6	-41	-175.5	-177.8	-7.2	0	0	0	113	M378 L381 D390 I406 S407 M411 D448	M378-H388 HydrophobicContact CE-CB 4.07Å; M378-H388 HydrophobicContact SD-CB 4.39Å; L381-H388 HydrophobicContact CD1-CB 4.28Å; H388-D390 PolarHBondContact O-N 3.43Å; H388-I406 VanDerWaalsContact CD2-CG2 3.46Å; H388-I406 WeakPolarHBondContact CD2-CG2 3.3Å; H388-I406 VanDerWaalsContact NE2-CG2 3.26Å; H388-I406 WeakPolarHBondContact NE2-CG2 3.27Å; H388-S407 PolarHBondContact CE1-O 2.88Å; H388-M411 CarbonylContact O-C 3.42Å; H388-D448 PolarHBondContact N-OD2 2.77Å
389	R	92.7	Very high	93.5	Very high	17 Å²	17	24.8 Å²	24.8	6%	0.064	12%	0.115	C	C	.	.	S	Bend	trans	68	-8.6	173.2	-53.7	175.6	48.8	-126.8	5.3	117.2	I387 M411 S422 Y443 D448	I387-R389 HydrophobicContact CB-CG 4.13Å; I387-R389 HydrophobicContact CG2-CG 3.63Å; R389-M411 HydrophobicContact CB-CB 4.27Å; R389-M411 WeakPolarHBondContact CD-O 3.31Å; R389-M411 PolarHBondContact NH1-O 3.11Å; R389-S422 PolarHBondContact NH2-OG 3.42Å; R389-Y443 HydrophobicContact CB-CD1 3.78Å; R389-Y443 HydrophobicContact CB-CE1 3.93Å; R389-Y443 HydrophobicContact CG-CD1 3.54Å; R389-Y443 HydrophobicContact CG-CE1 4.17Å; R389-Y443 HydrophobicContact CG-CG 4.01Å; R389-D448 WeakPolarHBondContact CA-OD1 3.44Å; R389-D448 PolarHBondContact N-OD1 3.45Å
390	D	92.7	Very high	92.7	Very high	21 Å²	21	26.1 Å²	26.1	11%	0.112	13%	0.127	C	C	.	.			trans	-139.4	42.4	171.8	-164.6	29.1	0	0	0	112.8	H388 A392 R394 N395 M411 P429	H388-D390 PolarHBondContact O-N 3.43Å; D390-A392 PolarHBondContact O-N 2.92Å; D390-R394 IonicContact OD1-CZ 3.11Å; D390-R394 IonicContact OD1-NE 2.85Å; D390-R394 IonicContact OD1-NH2 3.23Å; D390-R394 PolarHBondContact OD1-NH2 3.23Å; D390-R394 IonicContact OD2-NE 2.72Å; D390-R394 IonicContact OD2-NH2 2.75Å; D390-N395 VanDerWaalsContact CG-ND2 3.25Å; D390-N395 PolarHBondContact O-ND2 3.08Å; D390-N395 PolarHBondContact OD2-ND2 3.11Å; D390-M411 HydrophobicContact CB-SD 4.01Å; D390-P429 VanDerWaalsContact OD1-CB 3.28Å; D390-P429 WeakPolarHBondContact OD1-CB 3.44Å; D390-P429 WeakPolarHBondContact OD1-CG 3.4Å
391	L	97.7	Very high	91.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.138	C	C	.	.			trans	-70.7	111.8	178.8	179.3	65.1	0	0	0	111.6	I374 M378 I406 S451 F452 L455 F513	I374-L391 HydrophobicContact CG2-CD1 4.08Å; M378-L391 HydrophobicContact CE-CD2 4.26Å; M378-L391 HydrophobicContact CG-CD1 4.42Å; M378-L391 HydrophobicContact CG-CD2 3.75Å; M378-L391 HydrophobicContact SD-CD1 4.01Å; M378-L391 HydrophobicContact SD-CD2 3.78Å; M378-L391 HydrophobicContact SD-CG 4.4Å; L391-I406 HydrophobicContact CD1-CG2 4.35Å; L391-S451 WeakPolarHBondContact O-CB 3.19Å; L391-F452 HydrophobicContact CD2-CB 3.7Å; L391-F452 HydrophobicContact CD2-CD2 4.3Å; L391-L455 HydrophobicContact CD1-CD1 3.73Å; L391-L455 HydrophobicContact CG-CD1 3.9Å; L391-F513 HydrophobicContact CD2-CZ 4.46Å
392	A	97.7	Very high	91.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-154.5	162.3	179.1	0	0	0	0	0	111.4	D390 R394 N395 W432	D390-A392 PolarHBondContact O-N 2.92Å; A392-R394 HydrophobicContact CB-CG 3.72Å; A392-R394 PolarHBondContact O-N 3.02Å; A392-R394 VanDerWaalsContact O-N 3.09Å; A392-N395 PolarHBondContact O-N 3.27Å; A392-W432 HydrophobicContact CB-CD2 4.23Å; A392-W432 HydrophobicContact CB-CG 4.18Å; A392-W432 HydrophobicContact CB-CZ2 4.42Å
393	A	97.9	Very high	90.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-63.2	-18.7	-179.8	0	0	0	0	0	114	L351 L352 L355 N395 E458	L351-A393 WeakPolarHBondContact CB-O 3.29Å; L351-A393 HydrophobicContact CD2-CB 4.23Å; L351-A393 HydrophobicContact CG-CB 4.36Å; L352-A393 HydrophobicContact CB-CB 4.14Å; L352-A393 HydrophobicContact CD1-CB 4.42Å; L352-A393 PolarHBondContact N-O 3.44Å; L355-A393 HydrophobicContact CD1-CB 4.46Å; A393-N395 VanDerWaalsContact C-N 3.33Å; A393-E458 HydrophobicContact CB-CB 4.01Å; A393-E458 HydrophobicContact CB-CG 4.44Å; A393-E458 WeakPolarHBondContact CB-OE2 3.35Å; A393-E458 PolarHBondContact N-OE2 2.81Å
394	R	95.1	Very high	90.9	Very high	68 Å²	68	21.3 Å²	21.3	26%	0.257	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-67.3	-29.9	170	50.2	159.1	179.2	-66.6	-8.4	113.5	C350 L352 D390 A392 P429 W432	C350-R394 WeakPolarHBondContact CB-O 3.41Å; L352-R394 HydrophobicContact CD2-CB 4.14Å; D390-R394 IonicContact OD1-CZ 3.11Å; D390-R394 IonicContact OD1-NE 2.85Å; D390-R394 IonicContact OD1-NH2 3.23Å; D390-R394 PolarHBondContact OD1-NH2 3.23Å; D390-R394 IonicContact OD2-NE 2.72Å; D390-R394 IonicContact OD2-NH2 2.75Å; A392-R394 HydrophobicContact CB-CG 3.72Å; A392-R394 PolarHBondContact O-N 3.02Å; A392-R394 VanDerWaalsContact O-N 3.09Å; R394-P429 VanDerWaalsContact NH2-CB 3.27Å; R394-W432 VanDerWaalsContact NH1-CZ2 3.29Å; R394-W432 VanDerWaalsContact NH1-CZ3 3.32Å
395	N	95.6	Very high	91.3	Very high	13 Å²	13	19.7 Å²	19.7	7%	0.07	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-105.1	13.7	-171.8	-61.3	-4.2	0	0	0	111.7	D390 A392 A393 S407 D408	D390-N395 VanDerWaalsContact CG-ND2 3.25Å; D390-N395 PolarHBondContact O-ND2 3.08Å; D390-N395 PolarHBondContact OD2-ND2 3.11Å; A392-N395 PolarHBondContact O-N 3.27Å; A393-N395 VanDerWaalsContact C-N 3.33Å; N395-S407 VanDerWaalsContact C-OG 3.26Å; N395-S407 CarbonylContact O-C 3.59Å; N395-S407 WeakPolarHBondContact O-CA 3.32Å; N395-S407 PolarHBondContact O-N 3.2Å; N395-S407 PolarHBondContact O-OG 3.19Å; N395-D408 HydrophobicContact CB-CB 4.46Å
396	C	97.5	Very high	91.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	137	167.2	-63.7	0	0	0	0	108.6	C350 L351 I374 V404 K405	C350-C396 CarbonylContact C-O 3.58Å; C350-C396 WeakPolarHBondContact CA-O 3.34Å; L351-C396 HydrophobicContact CB-CB 4.04Å; L351-C396 WeakPolarHBondContact CB-O 3.45Å; L351-C396 HydrophobicContact CD2-CB 4.06Å; L351-C396 PolarHBondContact N-O 2.86Å; I374-C396 HydrophobicContact CD1-CB 4.14Å; C396-V404 HydrophobicContact CB-CG1 3.84Å; C396-K405 CarbonylContact C-O 3.56Å; C396-K405 VanDerWaalsContact CA-O 3.28Å; C396-K405 WeakPolarHBondContact CA-O 3.44Å
397	L	96.2	Very high	91.9	Very high	36 Å²	36	18.4 Å²	18.4	19%	0.188	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	153.7	179.2	-55.4	-173.2	0	0	0	111.5	V327 M346 G349 C350 V404 K405	V327-L397 HydrophobicContact CG2-CB 4.4Å; V327-L397 HydrophobicContact CG2-CD1 4.09Å; V327-L397 HydrophobicContact CG2-CG 4.37Å; M346-L397 HydrophobicContact CB-CB 3.65Å; M346-L397 HydrophobicContact CB-CD1 4.01Å; M346-L397 HydrophobicContact CB-CG 4.46Å; M346-L397 HydrophobicContact CE-CB 4Å; M346-L397 VanDerWaalsContact CE-O 3.3Å; M346-L397 WeakPolarHBondContact CE-O 3.38Å; M346-L397 HydrophobicContact CG-CB 3.74Å; M346-L397 HydrophobicContact CG-CD1 3.94Å; G349-L397 CarbonylContact O-C 3.59Å; G349-L397 VanDerWaalsContact O-CA 3.29Å; G349-L397 WeakPolarHBondContact O-CA 3.42Å; C350-L397 HydrophobicContact CB-CD2 3.86Å; L397-V404 WeakPolarHBondContact O-CA 3.24Å; L397-K405 PolarHBondContact N-O 2.8Å; L397-K405 PolarHBondContact O-N 3.36Å
398	V	95	Very high	91.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.4	-175	-170.3	0	0	0	0	110.3	M346 E347 N348 G349 L351 Y354 V404	M346-V398 CarbonylContact C-O 3.54Å; E347-V398 PolarHBondContact N-O 2.94Å; N348-V398 WeakPolarHBondContact CA-O 3.22Å; N348-V398 HydrophobicContact CB-CB 3.79Å; N348-V398 HydrophobicContact CB-CG1 3.88Å; N348-V398 WeakPolarHBondContact CB-O 3.45Å; N348-V398 PolarHBondContact N-O 3.26Å; G349-V398 PolarHBondContact O-N 3.14Å; L351-V398 HydrophobicContact CB-CG2 3.94Å; L351-V398 HydrophobicContact CD1-CG2 4.02Å; Y354-V398 HydrophobicContact CD1-CG1 4.43Å; Y354-V398 HydrophobicContact CD1-CG2 4.31Å; Y354-V398 HydrophobicContact CD2-CG1 4.28Å; Y354-V398 HydrophobicContact CE1-CG1 4.42Å; Y354-V398 HydrophobicContact CE2-CG1 4.25Å; Y354-V398 HydrophobicContact CG-CB 4.49Å; Y354-V398 HydrophobicContact CG-CG1 4.35Å; Y354-V398 HydrophobicContact CG-CG2 4.14Å; V398-V404 HydrophobicContact CG2-CG2 4.24Å
399	S	86.6	Confident	90.8	Very high	10 Å²	10	20.6 Å²	20.6	7%	0.07	11%	0.114	C	C	.	.			trans	-81.1	167.8	176.2	66.8	0	0	0	0	112.2	E347 N348 T401 C402 T403	E347-S399 VanDerWaalsContact OE2-CA 3.29Å; E347-S399 WeakPolarHBondContact OE2-CA 3.14Å; N348-S399 PolarHBondContact ND2-O 3.14Å; S399-T401 PolarHBondContact O-N 3.46Å; S399-T401 PolarHBondContact OG-N 2.81Å; S399-T401 PolarHBondContact OG-OG1 3.32Å; S399-C402 WeakPolarHBondContact O-CA 3.4Å; S399-C402 PolarHBondContact O-N 2.92Å; S399-C402 PolarHBondContact OG-N 3.48Å; S399-T403 PolarHBondContact N-O 3.22Å; S399-T403 WeakPolarHBondContact OG-CB 3.27Å; S399-T403 PolarHBondContact OG-N 2.86Å; S399-T403 PolarHBondContact OG-O 3.05Å
400	S	81.1	Confident	89.7	Confident	58 Å²	58	20.9 Å²	20.9	41%	0.406	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-38.2	168.2	52.6	0	0	0	0	113.1	E347 C402	E347-S400 VanDerWaalsContact CD-CB 3.47Å; E347-S400 WeakPolarHBondContact OE1-CB 3.32Å; E347-S400 PolarHBondContact OE1-OG 3.14Å; E347-S400 PolarHBondContact OE2-N 3.34Å; S400-C402 PolarHBondContact O-N 2.97Å
401	T	75.7	Confident	88.6	Confident	54 Å²	54	21.7 Å²	21.7	33%	0.331	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-0.1	173.9	49.4	0	0	0	0	113.8	R162 S399 T403	R162-T401 PolarHBondContact NH2-O 3.36Å; S399-T401 PolarHBondContact O-N 3.46Å; S399-T401 PolarHBondContact OG-N 2.81Å; S399-T401 PolarHBondContact OG-OG1 3.32Å; T401-T403 VanDerWaalsContact C-N 3.26Å; T401-T403 PolarHBondContact O-N 2.95Å
402	C	81.3	Confident	87.7	Confident	25 Å²	25	21.7 Å²	21.7	17%	0.169	13%	0.125	C	C	.	.			trans	52.1	44.4	-172.5	-42.5	0	0	0	0	112.2	R162 Y354 M366 S399 S400	R162-C402 PolarHBondContact NH1-O 2.83Å; Y354-C402 PolarHBondContact OH-SG 2.92Å; Y354-C402 VanDerWaalsContact OH-SG 3.41Å; M366-C402 HydrophobicContact CE-CB 3.6Å; S399-C402 WeakPolarHBondContact O-CA 3.4Å; S399-C402 PolarHBondContact O-N 2.92Å; S399-C402 PolarHBondContact OG-N 3.48Å; S400-C402 PolarHBondContact O-N 2.97Å
403	T	85	Confident	86.6	Confident	40 Å²	40	24.2 Å²	24.2	25%	0.245	14%	0.135	C	C	.	.			trans	-90.1	144.1	159.3	-58.7	0	0	0	0	107.3	K325 D373 S399 T401	K325-T403 HydrophobicContact CD-CG2 4.3Å; D373-T403 WeakPolarHBondContact OD2-CG2 3.42Å; S399-T403 PolarHBondContact N-O 3.22Å; S399-T403 WeakPolarHBondContact OG-CB 3.27Å; S399-T403 PolarHBondContact OG-N 2.86Å; S399-T403 PolarHBondContact OG-O 3.05Å; T401-T403 VanDerWaalsContact C-N 3.26Å; T401-T403 PolarHBondContact O-N 2.95Å
404	V	93.4	Very high	85.4	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.9	177.9	-174.6	0	0	0	0	110.8	L351 V370 D373 I374 C396 L397 V398	L351-V404 HydrophobicContact CD2-CG1 4.32Å; V370-V404 HydrophobicContact CB-CG2 4.3Å; V370-V404 HydrophobicContact CG1-CG2 4.08Å; V370-V404 HydrophobicContact CG2-CG2 3.85Å; D373-V404 HydrophobicContact CB-CB 4.13Å; D373-V404 PolarHBondContact OD2-N 3.36Å; I374-V404 HydrophobicContact CD1-CG1 3.91Å; I374-V404 HydrophobicContact CG1-CB 4.48Å; I374-V404 HydrophobicContact CG1-CG1 3.83Å; C396-V404 HydrophobicContact CB-CG1 3.84Å; L397-V404 WeakPolarHBondContact O-CA 3.24Å; V398-V404 HydrophobicContact CG2-CG2 4.24Å
405	K	94.9	Very high	84.4	Confident	30 Å²	30	27.8 Å²	27.8	13%	0.13	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	145	176.7	-59.8	-174.8	170.3	-168.6	0	111.5	S324 K325 V327 E344 M346 C396 L397	S324-K405 VanDerWaalsContact O-CE 3.23Å; S324-K405 WeakPolarHBondContact O-CE 3.18Å; K325-K405 CarbonylContact O-C 3.56Å; K325-K405 VanDerWaalsContact O-CA 3.25Å; K325-K405 WeakPolarHBondContact O-CA 3.48Å; V327-K405 HydrophobicContact CG2-CB 3.64Å; V327-K405 HydrophobicContact CG2-CD 4.42Å; E344-K405 WeakPolarHBondContact OE1-CD 3.2Å; E344-K405 IonicContact OE1-NZ 3.77Å; E344-K405 PolarHBondContact OE1-NZ 3.07Å; E344-K405 IonicContact OE2-NZ 3.73Å; E344-K405 PolarHBondContact OE2-NZ 2.92Å; M346-K405 HydrophobicContact CE-CB 3.87Å; M346-K405 HydrophobicContact CE-CD 3.87Å; M346-K405 HydrophobicContact CE-CG 3.74Å; M346-K405 HydrophobicContact SD-CD 3.94Å; M346-K405 HydrophobicContact SD-CG 4.47Å; C396-K405 CarbonylContact C-O 3.56Å; C396-K405 VanDerWaalsContact CA-O 3.28Å; C396-K405 WeakPolarHBondContact CA-O 3.44Å; L397-K405 PolarHBondContact N-O 2.8Å; L397-K405 PolarHBondContact O-N 3.36Å
406	I	96.2	Very high	83.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	143.2	176.3	-49.2	-179.6	0	0	0	109.6	K325 L326 V327 I374 M378 H388 L391 F409	K325-I406 PolarHBondContact O-N 3.27Å; L326-I406 HydrophobicContact CD2-CB 3.77Å; L326-I406 HydrophobicContact CD2-CD1 4.04Å; L326-I406 HydrophobicContact CD2-CG1 4.17Å; V327-I406 WeakPolarHBondContact CG2-O 3.35Å; V327-I406 PolarHBondContact N-O 3.38Å; I374-I406 HydrophobicContact CG2-CD1 4.05Å; I374-I406 HydrophobicContact CG2-CG1 4.26Å; M378-I406 HydrophobicContact CG-CD1 3.65Å; M378-I406 HydrophobicContact SD-CD1 3.56Å; M378-I406 VanDerWaalsContact SD-CD1 3.56Å; H388-I406 VanDerWaalsContact CD2-CG2 3.46Å; H388-I406 WeakPolarHBondContact CD2-CG2 3.3Å; H388-I406 VanDerWaalsContact NE2-CG2 3.26Å; H388-I406 WeakPolarHBondContact NE2-CG2 3.27Å; L391-I406 HydrophobicContact CD1-CG2 4.35Å; I406-F409 HydrophobicContact CG2-CE1 4.46Å; I406-F409 WeakPolarHBondContact O-CZ 3.48Å
407	S	91.7	Very high	82	Confident	12 Å²	12	40.8 Å²	40.8	8%	0.084	22%	0.22	C	C	.	.			trans	-146.7	-177.9	-172.9	72.3	0	0	0	0	112.6	H388 N395	H388-S407 PolarHBondContact CE1-O 2.88Å; N395-S407 VanDerWaalsContact C-OG 3.26Å; N395-S407 CarbonylContact O-C 3.59Å; N395-S407 WeakPolarHBondContact O-CA 3.32Å; N395-S407 PolarHBondContact O-N 3.2Å; N395-S407 PolarHBondContact O-OG 3.19Å
408	D	83.3	Confident	81	Confident	45 Å²	45	41.8 Å²	41.8	24%	0.241	23%	0.225	C	C	.	.			trans	55.5	63	-178.6	-147.4	29.3	0	0	0	113.7	K299 N395 G410	K299-D408 IonicContact NZ-OD1 3.88Å; K299-D408 PolarHBondContact NZ-OD1 3.5Å; N395-D408 HydrophobicContact CB-CB 4.46Å; D408-G410 PolarHBondContact O-N 3.47Å; D408-G410 VanDerWaalsContact O-N 3.15Å
409	F	80.6	Confident	80.3	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.009	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-75.3	7.4	-178.1	-58.8	-83.9	0	0	0	114.1	M318 L321 L326 L381 I406 M411 T412	M318-F409 HydrophobicContact CE-CD2 3.8Å; M318-F409 HydrophobicContact CE-CE2 4.27Å; M318-F409 HydrophobicContact CG-CB 3.71Å; M318-F409 HydrophobicContact CG-CD2 3.61Å; M318-F409 HydrophobicContact CG-CG 3.9Å; M318-F409 HydrophobicContact SD-CB 4.14Å; M318-F409 HydrophobicContact SD-CD2 3.8Å; M318-F409 HydrophobicContact SD-CG 4.42Å; L321-F409 HydrophobicContact CD1-CD1 3.82Å; L321-F409 HydrophobicContact CD1-CE1 3.9Å; L321-F409 HydrophobicContact CD1-CG 4.36Å; L321-F409 HydrophobicContact CD1-CZ 4.49Å; L326-F409 HydrophobicContact CB-CZ 4.06Å; L326-F409 HydrophobicContact CD1-CZ 4.5Å; L326-F409 HydrophobicContact CD2-CE1 4.22Å; L326-F409 HydrophobicContact CD2-CZ 4.01Å; L326-F409 HydrophobicContact CG-CZ 4.4Å; L381-F409 HydrophobicContact CD1-CE1 4.34Å; I406-F409 HydrophobicContact CG2-CE1 4.46Å; I406-F409 WeakPolarHBondContact O-CZ 3.48Å; F409-M411 PolarHBondContact O-N 2.97Å; F409-T412 WeakPolarHBondContact CA-OG1 3.46Å; F409-T412 HydrophobicContact CD1-CG2 4.37Å; F409-T412 WeakPolarHBondContact O-CA 3.43Å; F409-T412 WeakPolarHBondContact O-CB 3.38Å; F409-T412 PolarHBondContact O-N 3.42Å; F409-T412 PolarHBondContact O-OG1 3.42Å
410	G	68.8	Low	79.9	Confident	23 Å²	23	50.2 Å²	50.2	24%	0.237	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-62.2	-13.9	-178.6	0	0	0	0	0	116.1	E314 D408	E314-G410 WeakPolarHBondContact OE2-CA 3.44Å; D408-G410 PolarHBondContact O-N 3.47Å; D408-G410 VanDerWaalsContact O-N 3.15Å
411	M	69.3	Low	80	Confident	37 Å²	37	51.8 Å²	51.8	18%	0.182	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-102.8	-4.8	167.8	-66.8	-166.5	66.3	0	0	114	H388 R389 D390 F409	H388-M411 CarbonylContact O-C 3.42Å; R389-M411 HydrophobicContact CB-CB 4.27Å; R389-M411 WeakPolarHBondContact CD-O 3.31Å; R389-M411 PolarHBondContact NH1-O 3.11Å; D390-M411 HydrophobicContact CB-SD 4.01Å; F409-M411 PolarHBondContact O-N 2.97Å
412	T	78.2	Confident	80.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.256	C	S	.	.			trans	-73.6	135.8	-174.6	-57.8	0	0	0	0	111	V317 Y386 I387 F409	V317-T412 HydrophobicContact CG1-CG2 3.84Å; Y386-T412 HydrophobicContact CD1-CG2 4.12Å; I387-T412 CarbonylContact O-C 3.54Å; I387-T412 WeakPolarHBondContact O-CA 3.38Å; I387-T412 WeakPolarHBondContact O-CG2 3.47Å; F409-T412 WeakPolarHBondContact CA-OG1 3.46Å; F409-T412 HydrophobicContact CD1-CG2 4.37Å; F409-T412 WeakPolarHBondContact O-CA 3.43Å; F409-T412 WeakPolarHBondContact O-CB 3.38Å; F409-T412 PolarHBondContact O-N 3.42Å; F409-T412 PolarHBondContact O-OG1 3.42Å
413	R	75.3	Confident	79.9	Confident	53 Å²	53	52.9 Å²	52.9	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.7	176.9	-64.4	-64.2	-169.8	-154	-1.6	110.8	D310 E313 Y386 I387 V415	D310-R413 IonicContact OD1-NH2 2.7Å; D310-R413 PolarHBondContact OD1-NH2 2.81Å; D310-R413 VanDerWaalsContact OD1-NH2 3.15Å; E313-R413 IonicContact OE2-CZ 2.87Å; E313-R413 IonicContact OE2-NH1 4Å; E313-R413 PolarHBondContact OE2-NH1 3.27Å; E313-R413 IonicContact OE2-NH2 3.52Å; Y386-R413 WeakPolarHBondContact CA-O 3.44Å; I387-R413 PolarHBondContact N-O 2.77Å; I387-R413 PolarHBondContact O-N 3.07Å; R413-V415 HydrophobicContact CB-CG2 4.45Å
414	Y	73.8	Confident	78.9	Confident	125 Å²	125	60.2 Å²	60.2	49%	0.49	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.9	169.6	177.6	-103.7	0	0	0	109.7	N384 G385 Y386 L416	N384-Y414 VanDerWaalsContact O-CE2 3.31Å; N384-Y414 WeakPolarHBondContact O-CE2 3.44Å; G385-Y414 CarbonylContact O-C 3.58Å; G385-Y414 WeakPolarHBondContact O-CA 3.26Å; G385-Y414 WeakPolarHBondContact O-CD2 3.49Å; Y386-Y414 HydrophobicContact CD1-CD2 4.42Å; Y386-Y414 HydrophobicContact CD2-CD2 4.23Å; Y386-Y414 HydrophobicContact CE1-CD2 4.09Å; Y386-Y414 HydrophobicContact CE1-CG 4.36Å; Y386-Y414 AromaticContact CE2-CD2 3.88Å; Y386-Y414 HydrophobicContact CE2-CD2 3.88Å; Y386-Y414 HydrophobicContact CE2-CE2 4.49Å; Y386-Y414 HydrophobicContact CG-CD2 4.49Å; Y386-Y414 AromaticContact CZ-CD2 3.8Å; Y414-L416 HydrophobicContact CE1-CD2 3.88Å; Y414-L416 HydrophobicContact CE1-CG 4.11Å; Y414-L416 VanDerWaalsContact OH-CD2 3.32Å; Y414-L416 WeakPolarHBondContact OH-CD2 3.44Å
415	V	72.2	Confident	77.4	Confident	19 Å²	19	63.8 Å²	63.8	12%	0.115	34%	0.344	C	S	.	.			trans	-141.7	122.7	-173.5	-174.6	0	0	0	0	109.5	G385 I387 R413 E419	G385-V415 PolarHBondContact O-N 3.32Å; I387-V415 HydrophobicContact CD1-CB 4.05Å; I387-V415 HydrophobicContact CD1-CG1 4.44Å; I387-V415 HydrophobicContact CD1-CG2 3.67Å; I387-V415 HydrophobicContact CG1-CG2 4.22Å; R413-V415 HydrophobicContact CB-CG2 4.45Å; V415-E419 WeakPolarHBondContact CG1-O 3.42Å
416	L	68.8	Low	75.9	Confident	139 Å²	139	64.1 Å²	64.1	73%	0.728	35%	0.353	S	S	*	.	S	Bend	trans	-71.2	-41.7	-177	-71.6	166.8	0	0	0	112.9	Y414	Y414-L416 HydrophobicContact CE1-CD2 3.88Å; Y414-L416 HydrophobicContact CE1-CG 4.11Å; Y414-L416 VanDerWaalsContact OH-CD2 3.32Å; Y414-L416 WeakPolarHBondContact OH-CD2 3.44Å
417	D	75.1	Confident	74.8	Confident	147 Å²	147	72.1 Å²	72.1	79%	0.786	39%	0.388	S	S	*	.	S	Bend	trans	-103.9	15.3	-171.5	-56.4	-63.1	0	0	0	113.6	E419	D417-E419 PolarHBondContact O-N 3.44Å
418	D	75.2	Confident	74.3	Confident	56 Å²	56	73.8 Å²	73.8	30%	0.299	39%	0.394	S	S	.	.	S	Bend	trans	53.3	10	-177.3	-164.2	42.3	0	0	0	117.1	S444 S445	D418-S444 WeakPolarHBondContact O-CA 3.49Å; D418-S444 WeakPolarHBondContact O-CB 3.22Å; D418-S445 VanDerWaalsContact OD1-CB 3.31Å; D418-S445 WeakPolarHBondContact OD1-CB 3.43Å; D418-S445 PolarHBondContact OD1-N 3.41Å; D418-S445 PolarHBondContact OD1-OG 3.31Å; D418-S445 WeakPolarHBondContact OD2-CB 3.4Å; D418-S445 PolarHBondContact OD2-N 3.27Å; D418-S445 PolarHBondContact OD2-OG 3.04Å
419	E	79.1	Confident	74.7	Confident	118 Å²	118	72.6 Å²	72.6	55%	0.551	39%	0.388	S	S	*	.			trans	-116.3	126.4	168.7	-74.3	-158.9	-158.5	0	0	111.7	V415 D417 K442	V415-E419 WeakPolarHBondContact CG1-O 3.42Å; D417-E419 PolarHBondContact O-N 3.44Å; E419-K442 IonicContact OE2-NZ 3.56Å; E419-K442 PolarHBondContact OE2-NZ 2.93Å
420	Y	80	Confident	75.3	Confident	69 Å²	69	74.3 Å²	74.3	27%	0.271	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.7	172.5	171.7	-103.8	0	0	0	111.2	Y443	Y420-Y443 HydrophobicContact CD1-CD2 4.02Å; Y420-Y443 HydrophobicContact CD1-CG 4.43Å; Y420-Y443 HydrophobicContact CE1-CD2 4.46Å; Y420-Y443 PolarHBondContact N-O 2.88Å; Y420-Y443 PolarHBondContact O-N 2.82Å
421	V	82.7	Confident	76.7	Confident	92 Å²	92	74.3 Å²	74.3	56%	0.558	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	117	173.6	-171.5	0	0	0	0	108.9	N441 K442	V421-N441 WeakPolarHBondContact CA-O 3.47Å; V421-K442 HydrophobicContact CG2-CG 4.3Å
422	S	79	Confident	78	Confident	10 Å²	10	73.4 Å²	73.4	7%	0.07	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-82.1	147.4	178.1	-164.6	0	0	0	0	111.6	R389 N441	R389-S422 PolarHBondContact NH2-OG 3.42Å; S422-N441 PolarHBondContact N-O 2.72Å; S422-N441 WeakPolarHBondContact O-CB 3.31Å
423	S	75.4	Confident	78.9	Confident	91 Å²	91	73.5 Å²	73.5	64%	0.636	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-56.1	141.6	175.5	-53.9	0	0	0	0	112.5	A426	S423-A426 WeakPolarHBondContact O-CB 3.38Å; S423-A426 PolarHBondContact O-N 3.19Å
424	F	63.9	Low	80	Confident	194 Å²	194	71 Å²	71	85%	0.851	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	138.5	175.7	-92.5	-95.2	0	0	0	111.8
425	G	62.7	Low	81	Confident	76 Å²	76	65.9 Å²	65.9	78%	0.784	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-2.7	179.1	0	0	0	0	0	115.3
426	A	63.8	Low	82.1	Confident	38 Å²	38	65.9 Å²	65.9	31%	0.314	36%	0.357	S	S	.	.			trans	-57.9	137.9	169.5	0	0	0	0	0	111.2	S423 F428	S423-A426 WeakPolarHBondContact O-CB 3.38Å; S423-A426 PolarHBondContact O-N 3.19Å; A426-F428 WeakPolarHBondContact O-CD1 3.48Å
427	K	72.5	Confident	83.3	Confident	168 Å²	168	59.4 Å²	59.4	73%	0.73	32%	0.323	S	S	*	.			trans	-81.5	138.9	170.9	-63	-179.2	-173.4	171	0	109.4
428	F	80.8	Confident	84.1	Confident	47 Å²	47	53.6 Å²	53.6	21%	0.206	29%	0.291	C	S	.	.			trans	-150.1	160.9	-178.7	63.2	-99.4	0	0	0	110.7	A426 I430 S433 V437 F438 Y443	A426-F428 WeakPolarHBondContact O-CD1 3.48Å; F428-I430 HydrophobicContact CD2-CG1 3.93Å; F428-I430 HydrophobicContact CE2-CB 4.36Å; F428-I430 HydrophobicContact CE2-CD1 4.46Å; F428-I430 HydrophobicContact CE2-CG1 3.4Å; F428-I430 VanDerWaalsContact CE2-CG1 3.4Å; F428-I430 HydrophobicContact CZ-CG1 4.01Å; F428-I430 PolarHBondContact O-N 3.09Å; F428-S433 WeakPolarHBondContact CD2-OG 3.36Å; F428-V437 HydrophobicContact CD2-CG1 3.9Å; F428-V437 HydrophobicContact CE2-CG1 4.12Å; F428-V437 HydrophobicContact CG-CG1 4.29Å; F428-F438 HydrophobicContact CE2-CB 3.7Å; F428-F438 HydrophobicContact CZ-CB 3.8Å; F428-Y443 VanDerWaalsContact CB-OH 3.23Å; F428-Y443 WeakPolarHBondContact CB-OH 3.35Å
429	P	91	Very high	84.8	Confident	20 Å²	20	55 Å²	55	13%	0.13	30%	0.298	C	S	.	.			trans	-82.3	70.2	-168.7	37.6	-43.4	0	0	0	112.7	D390 R394 K431 W432 S433	D390-P429 VanDerWaalsContact OD1-CB 3.28Å; D390-P429 WeakPolarHBondContact OD1-CB 3.44Å; D390-P429 WeakPolarHBondContact OD1-CG 3.4Å; R394-P429 VanDerWaalsContact NH2-CB 3.27Å; P429-K431 PolarHBondContact O-N 3.31Å; P429-W432 HydrophobicContact CB-CB 4.39Å; P429-W432 HydrophobicContact CB-CE3 4.08Å; P429-W432 HydrophobicContact CG-CB 4.38Å; P429-W432 PolarHBondContact O-N 2.76Å; P429-S433 PolarHBondContact O-N 2.7Å; P429-S433 PolarHBondContact O-OG 2.91Å
430	I	94.4	Very high	85.4	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.195	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-37.4	-42	-172.3	-67.8	165.5	0	0	0	115.2	F428 W432 S433 N472 V476	F428-I430 HydrophobicContact CD2-CG1 3.93Å; F428-I430 HydrophobicContact CE2-CB 4.36Å; F428-I430 HydrophobicContact CE2-CD1 4.46Å; F428-I430 HydrophobicContact CE2-CG1 3.4Å; F428-I430 VanDerWaalsContact CE2-CG1 3.4Å; F428-I430 HydrophobicContact CZ-CG1 4.01Å; F428-I430 PolarHBondContact O-N 3.09Å; I430-W432 VanDerWaalsContact C-N 3.28Å; I430-W432 PolarHBondContact O-N 3.49Å; I430-S433 PolarHBondContact O-N 3.45Å; I430-N472 HydrophobicContact CB-CB 4.33Å; I430-N472 HydrophobicContact CD1-CB 3.83Å; I430-N472 HydrophobicContact CG2-CB 4.02Å; I430-V476 HydrophobicContact CG2-CG2 3.87Å
431	K	96.9	Very high	85.9	Confident	22 Å²	22	53 Å²	53	10%	0.096	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.7	-179.4	-71.8	-178.4	164	-144.5	0	115.9	P429 M465 P466 F467 K470 V475	P429-K431 PolarHBondContact O-N 3.31Å; K431-M465 HydrophobicContact CD-SD 4.17Å; K431-P466 HydrophobicContact CB-CB 4.45Å; K431-P466 WeakPolarHBondContact CD-O 3.23Å; K431-P466 PolarHBondContact NZ-O 3.39Å; K431-P466 VanDerWaalsContact NZ-O 3.1Å; K431-F467 HydrophobicContact CB-CD2 4.34Å; K431-F467 HydrophobicContact CG-CD2 4.35Å; K431-F467 PolarHBondContact NZ-O 3.38Å; K431-F467 WeakPolarHBondContact O-CE2 3.3Å; K431-K470 WeakPolarHBondContact CE-O 3.34Å; K431-K470 PolarHBondContact NZ-O 2.91Å; K431-V475 HydrophobicContact CG-CG1 4.41Å; K431-V475 HydrophobicContact CG-CG2 4.28Å
432	W	97.8	Very high	86.4	Confident	19 Å²	19	52.3 Å²	52.3	7%	0.072	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-9.9	171.4	-68.3	-104.2	0	0	0	112	A392 R394 P429 I430 S451 V454 E458 M465 P466	A392-W432 HydrophobicContact CB-CD2 4.23Å; A392-W432 HydrophobicContact CB-CG 4.18Å; A392-W432 HydrophobicContact CB-CZ2 4.42Å; R394-W432 VanDerWaalsContact NH1-CZ2 3.29Å; R394-W432 VanDerWaalsContact NH1-CZ3 3.32Å; P429-W432 HydrophobicContact CB-CB 4.39Å; P429-W432 HydrophobicContact CB-CE3 4.08Å; P429-W432 HydrophobicContact CG-CB 4.38Å; P429-W432 PolarHBondContact O-N 2.76Å; I430-W432 VanDerWaalsContact C-N 3.28Å; I430-W432 PolarHBondContact O-N 3.49Å; W432-S451 PolarHBondContact O-OG 2.84Å; W432-V454 HydrophobicContact CD2-CG1 4.49Å; W432-V454 HydrophobicContact CG-CB 4.43Å; W432-V454 HydrophobicContact CG-CG1 3.99Å; W432-E458 WeakPolarHBondContact CZ2-OE1 3.46Å; W432-E458 PolarHBondContact NE1-OE2 2.83Å; W432-M465 HydrophobicContact CH2-SD 3.96Å; W432-P466 HydrophobicContact CH2-CG 4.34Å; W432-P466 HydrophobicContact CZ2-CG 3.8Å
433	S	96.7	Very high	87.1	Confident	3 Å²	3	52 Å²	52	2%	0.021	28%	0.277	C	S	.	.			trans	-86.6	143.3	-173	-56.8	0	0	0	0	113.7	F428 P429 I430 W450	F428-S433 WeakPolarHBondContact CD2-OG 3.36Å; P429-S433 PolarHBondContact O-N 2.7Å; P429-S433 PolarHBondContact O-OG 2.91Å; I430-S433 PolarHBondContact O-N 3.45Å; S433-W450 PolarHBondContact O-NE1 2.8Å
434	P	97.3	Very high	88.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.251	C	S	.	.			trans	-78.5	168.2	171.4	34.8	-39.7	0	0	0	113	E436 V437 F438 W450	P434-E436 WeakPolarHBondContact CB-OE1 3.43Å; P434-E436 WeakPolarHBondContact CG-OE1 3.46Å; P434-E436 PolarHBondContact O-N 3.34Å; P434-V437 HydrophobicContact CG-CB 4.08Å; P434-V437 HydrophobicContact CG-CG2 3.7Å; P434-V437 PolarHBondContact O-N 3.21Å; P434-V437 VanDerWaalsContact O-N 3.14Å; P434-F438 WeakPolarHBondContact O-CD1 3.38Å; P434-F438 PolarHBondContact O-N 3.02Å; P434-W450 HydrophobicContact CB-CB 3.93Å; P434-W450 HydrophobicContact CB-CD2 3.56Å; P434-W450 HydrophobicContact CB-CE3 3.78Å; P434-W450 HydrophobicContact CB-CG 3.64Å; P434-W450 HydrophobicContact CB-CZ3 4.48Å; P434-W450 HydrophobicContact CG-CB 4.31Å; P434-W450 HydrophobicContact CG-CG 4.36Å
435	P	95.9	Very high	89.6	Confident	16 Å²	16	39.4 Å²	39.4	10%	0.104	21%	0.213	C	C	.	.	H	α-helix	trans	-50.5	-46.4	178.3	-29	35.4	0	0	0	115.1	V437 F438 L439 W450 I479	P435-V437 VanDerWaalsContact C-N 3.27Å; P435-V437 PolarHBondContact O-N 2.76Å; P435-F438 HydrophobicContact CB-CE2 4.37Å; P435-F438 HydrophobicContact CB-CZ 4.15Å; P435-F438 HydrophobicContact CG-CZ 4.18Å; P435-F438 PolarHBondContact O-N 3.2Å; P435-L439 HydrophobicContact CB-CD1 4.28Å; P435-L439 VanDerWaalsContact O-CB 3.26Å; P435-L439 WeakPolarHBondContact O-CB 3.41Å; P435-L439 VanDerWaalsContact O-CG 3.27Å; P435-L439 WeakPolarHBondContact O-CG 3.46Å; P435-L439 PolarHBondContact O-N 3.1Å; P435-W450 HydrophobicContact CG-CH2 4.34Å; P435-I479 HydrophobicContact CG-CG2 3.93Å
436	E	95.8	Very high	91.3	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.093	18%	0.183	C	C	.	.	H	α-helix	trans	-68.9	-23.9	-176.3	70.5	-73.1	172	0	0	113.8	P434 F440 N441 K442 P507 R510	P434-E436 WeakPolarHBondContact CB-OE1 3.43Å; P434-E436 WeakPolarHBondContact CG-OE1 3.46Å; P434-E436 PolarHBondContact O-N 3.34Å; E436-F440 HydrophobicContact CB-CD2 4.36Å; E436-F440 CarbonylContact O-C 3.58Å; E436-F440 WeakPolarHBondContact O-CA 3.43Å; E436-F440 WeakPolarHBondContact O-CB 3.46Å; E436-F440 PolarHBondContact O-N 3.31Å; E436-F440 VanDerWaalsContact O-N 3.15Å; E436-N441 PolarHBondContact O-N 3.39Å; E436-K442 HydrophobicContact CB-CB 4.25Å; E436-K442 HydrophobicContact CG-CB 4.25Å; E436-K442 PolarHBondContact O-N 2.94Å; E436-P507 HydrophobicContact CG-CG 3.95Å; E436-R510 IonicContact OE1-CZ 3.66Å; E436-R510 IonicContact OE1-NH1 3.65Å; E436-R510 PolarHBondContact OE1-NH1 3.04Å; E436-R510 IonicContact OE1-NH2 2.67Å; E436-R510 PolarHBondContact OE1-NH2 2.83Å; E436-R510 IonicContact OE2-CZ 3.26Å; E436-R510 IonicContact OE2-NH1 2.75Å; E436-R510 IonicContact OE2-NH2 2.68Å; E436-R510 PolarHBondContact OE2-NH2 2.95Å
437	V	94.4	Very high	92.9	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-71.7	-53.1	169.8	168.5	0	0	0	0	109.8	F428 P434 P435 N441 K442 Y443	F428-V437 HydrophobicContact CD2-CG1 3.9Å; F428-V437 HydrophobicContact CE2-CG1 4.12Å; F428-V437 HydrophobicContact CG-CG1 4.29Å; P434-V437 HydrophobicContact CG-CB 4.08Å; P434-V437 HydrophobicContact CG-CG2 3.7Å; P434-V437 PolarHBondContact O-N 3.21Å; P434-V437 VanDerWaalsContact O-N 3.14Å; P435-V437 VanDerWaalsContact C-N 3.27Å; P435-V437 PolarHBondContact O-N 2.76Å; V437-N441 WeakPolarHBondContact O-CA 3.47Å; V437-N441 PolarHBondContact O-N 3.48Å; V437-K442 WeakPolarHBondContact CG2-O 2.99Å; V437-Y443 HydrophobicContact CG1-CD1 4.48Å; V437-Y443 HydrophobicContact CG1-CE1 3.75Å; V437-Y443 HydrophobicContact CG1-CE2 4.27Å; V437-Y443 HydrophobicContact CG2-CD1 3.83Å; V437-Y443 HydrophobicContact CG2-CE1 3.93Å; V437-Y443 HydrophobicContact CG2-CG 4.2Å
438	F	91.3	Very high	94.2	Very high	26 Å²	26	27.8 Å²	27.8	11%	0.114	13%	0.134	C	C	.	.	H	α-helix	trans	-79.4	-18.7	-172.8	63	-118.7	0	0	0	115.2	F428 P434 P435 V476 I479	F428-F438 HydrophobicContact CE2-CB 3.7Å; F428-F438 HydrophobicContact CZ-CB 3.8Å; P434-F438 WeakPolarHBondContact O-CD1 3.38Å; P434-F438 PolarHBondContact O-N 3.02Å; P435-F438 HydrophobicContact CB-CE2 4.37Å; P435-F438 HydrophobicContact CB-CZ 4.15Å; P435-F438 HydrophobicContact CG-CZ 4.18Å; P435-F438 PolarHBondContact O-N 3.2Å; F438-V476 HydrophobicContact CB-CG2 4.33Å; F438-V476 HydrophobicContact CD1-CG2 4.36Å; F438-V476 HydrophobicContact CD2-CB 4.28Å; F438-V476 HydrophobicContact CD2-CG1 3.79Å; F438-V476 HydrophobicContact CD2-CG2 3.88Å; F438-V476 HydrophobicContact CE2-CB 4.17Å; F438-V476 HydrophobicContact CE2-CG1 3.7Å; F438-V476 HydrophobicContact CE2-CG2 4.2Å; F438-V476 HydrophobicContact CG-CG2 3.98Å; F438-V476 HydrophobicContact CZ-CG1 4.5Å; F438-I479 HydrophobicContact CE1-CB 4.25Å; F438-I479 HydrophobicContact CE1-CD1 4.22Å; F438-I479 HydrophobicContact CE1-CG2 3.95Å; F438-I479 HydrophobicContact CZ-CB 4Å; F438-I479 HydrophobicContact CZ-CG2 3.82Å
439	L	90.2	Very high	95	Very high	86 Å²	86	25.5 Å²	25.5	45%	0.45	12%	0.124	S	C	.	.	H	α-helix	trans	-92.7	-36.1	174	-61.9	174.7	0	0	0	113.1	P435	P435-L439 HydrophobicContact CB-CD1 4.28Å; P435-L439 VanDerWaalsContact O-CB 3.26Å; P435-L439 WeakPolarHBondContact O-CB 3.41Å; P435-L439 VanDerWaalsContact O-CG 3.27Å; P435-L439 WeakPolarHBondContact O-CG 3.46Å; P435-L439 PolarHBondContact O-N 3.1Å
440	F	90.9	Very high	95.4	Very high	128 Å²	128	24.8 Å²	24.8	56%	0.561	12%	0.118	S	C	*	.	H	α-helix	trans	-131.5	3.9	-167.4	-48.7	-59.9	0	0	0	114.7	E436 K442	E436-F440 HydrophobicContact CB-CD2 4.36Å; E436-F440 CarbonylContact O-C 3.58Å; E436-F440 WeakPolarHBondContact O-CA 3.43Å; E436-F440 WeakPolarHBondContact O-CB 3.46Å; E436-F440 PolarHBondContact O-N 3.31Å; E436-F440 VanDerWaalsContact O-N 3.15Å; F440-K442 HydrophobicContact CB-CD 4.43Å; F440-K442 HydrophobicContact CB-CG 4.05Å; F440-K442 PolarHBondContact O-N 2.85Å
441	N	90.3	Very high	95.6	Very high	15 Å²	15	23.2 Å²	23.2	8%	0.08	11%	0.111	C	C	.	.			trans	54.8	26.5	-174.2	-62.4	-72.8	0	0	0	113.9	V421 S422 E436 V437 Y443	V421-N441 WeakPolarHBondContact CA-O 3.47Å; S422-N441 PolarHBondContact N-O 2.72Å; S422-N441 WeakPolarHBondContact O-CB 3.31Å; E436-N441 PolarHBondContact O-N 3.39Å; V437-N441 WeakPolarHBondContact O-CA 3.47Å; V437-N441 PolarHBondContact O-N 3.48Å; N441-Y443 VanDerWaalsContact O-CD2 3.25Å; N441-Y443 WeakPolarHBondContact O-CD2 3.49Å; N441-Y443 WeakPolarHBondContact O-CE2 3.47Å
442	K	93.2	Very high	95.7	Very high	78 Å²	78	22.2 Å²	22.2	34%	0.339	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	117	-179.3	-75.9	-167.5	161.3	-133.4	0	111.7	E419 V421 E436 V437 F440	E419-K442 IonicContact OE2-NZ 3.56Å; E419-K442 PolarHBondContact OE2-NZ 2.93Å; V421-K442 HydrophobicContact CG2-CG 4.3Å; E436-K442 HydrophobicContact CB-CB 4.25Å; E436-K442 HydrophobicContact CG-CB 4.25Å; E436-K442 PolarHBondContact O-N 2.94Å; V437-K442 WeakPolarHBondContact CG2-O 2.99Å; F440-K442 HydrophobicContact CB-CD 4.43Å; F440-K442 HydrophobicContact CB-CG 4.05Å; F440-K442 PolarHBondContact O-N 2.85Å
443	Y	93.9	Very high	95.7	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.016	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.4	174.9	-60.9	-98.3	0	0	0	110.5	R389 Y420 F428 V437 N441	R389-Y443 HydrophobicContact CB-CD1 3.78Å; R389-Y443 HydrophobicContact CB-CE1 3.93Å; R389-Y443 HydrophobicContact CG-CD1 3.54Å; R389-Y443 HydrophobicContact CG-CE1 4.17Å; R389-Y443 HydrophobicContact CG-CG 4.01Å; Y420-Y443 HydrophobicContact CD1-CD2 4.02Å; Y420-Y443 HydrophobicContact CD1-CG 4.43Å; Y420-Y443 HydrophobicContact CE1-CD2 4.46Å; Y420-Y443 PolarHBondContact N-O 2.88Å; Y420-Y443 PolarHBondContact O-N 2.82Å; F428-Y443 VanDerWaalsContact CB-OH 3.23Å; F428-Y443 WeakPolarHBondContact CB-OH 3.35Å; V437-Y443 HydrophobicContact CG1-CD1 4.48Å; V437-Y443 HydrophobicContact CG1-CE1 3.75Å; V437-Y443 HydrophobicContact CG1-CE2 4.27Å; V437-Y443 HydrophobicContact CG2-CD1 3.83Å; V437-Y443 HydrophobicContact CG2-CE1 3.93Å; V437-Y443 HydrophobicContact CG2-CG 4.2Å; N441-Y443 VanDerWaalsContact O-CD2 3.25Å; N441-Y443 WeakPolarHBondContact O-CD2 3.49Å; N441-Y443 WeakPolarHBondContact O-CE2 3.47Å
444	S	95.8	Very high	95.8	Very high	13 Å²	13	21.2 Å²	21.2	9%	0.091	10%	0.102	C	C	.	.			trans	-161.4	168.7	178.3	52.2	0	0	0	0	109.8	I387 D418 K446 S447 D448	I387-S444 WeakPolarHBondContact CG2-O 3.43Å; D418-S444 WeakPolarHBondContact O-CA 3.49Å; D418-S444 WeakPolarHBondContact O-CB 3.22Å; S444-K446 PolarHBondContact O-N 3.15Å; S444-K446 VanDerWaalsContact O-N 3.14Å; S444-K446 PolarHBondContact OG-N 3.49Å; S444-S447 PolarHBondContact N-OG 3.47Å; S444-S447 WeakPolarHBondContact O-CA 3.45Å; S444-S447 WeakPolarHBondContact O-CB 3.46Å; S444-S447 PolarHBondContact O-N 2.72Å; S444-S447 PolarHBondContact O-OG 3.14Å; S444-S447 PolarHBondContact OG-N 3.18Å; S444-D448 PolarHBondContact O-N 2.57Å
445	S	96.4	Very high	95.9	Very high	7 Å²	7	21.1 Å²	21.1	5%	0.049	10%	0.102	C	C	.	.	H	α-helix	trans	-44.8	-42.1	163.9	64.5	0	0	0	0	111.6	D418 S447 D448 V449	D418-S445 VanDerWaalsContact OD1-CB 3.31Å; D418-S445 WeakPolarHBondContact OD1-CB 3.43Å; D418-S445 PolarHBondContact OD1-N 3.41Å; D418-S445 PolarHBondContact OD1-OG 3.31Å; D418-S445 WeakPolarHBondContact OD2-CB 3.4Å; D418-S445 PolarHBondContact OD2-N 3.27Å; D418-S445 PolarHBondContact OD2-OG 3.04Å; S445-S447 VanDerWaalsContact C-N 3.25Å; S445-S447 PolarHBondContact O-N 3.06Å; S445-D448 CarbonylContact O-C 3.59Å; S445-D448 WeakPolarHBondContact O-CB 3.2Å; S445-D448 PolarHBondContact O-N 2.72Å; S445-V449 WeakPolarHBondContact O-CG2 3.44Å; S445-V449 PolarHBondContact O-N 3Å
446	K	98.4	Very high	96.1	Very high	35 Å²	35	20.4 Å²	20.4	15%	0.152	10%	0.097	C	C	.	.	H	α-helix	trans	-67.9	-19.8	179	-55.2	-58.9	174.6	169.9	0	113.7	S444 W450 P507 R510 P511	S444-K446 PolarHBondContact O-N 3.15Å; S444-K446 VanDerWaalsContact O-N 3.14Å; S444-K446 PolarHBondContact OG-N 3.49Å; K446-W450 PolarHBondContact O-N 2.97Å; K446-P507 HydrophobicContact CB-CB 3.82Å; K446-P507 HydrophobicContact CG-CB 4.4Å; K446-R510 HydrophobicContact CD-CB 4.31Å; K446-R510 PolarHBondContact NZ-O 2.78Å; K446-R510 VanDerWaalsContact O-CD 3.29Å; K446-R510 WeakPolarHBondContact O-CD 3.33Å; K446-R510 PolarHBondContact O-NH1 3.25Å; K446-P511 PolarHBondContact NZ-O 2.99Å
447	S	98.1	Very high	96.2	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-80	-32.7	169.7	73.8	0	0	0	0	112.9	S444 S445 S451	S444-S447 PolarHBondContact N-OG 3.47Å; S444-S447 WeakPolarHBondContact O-CA 3.45Å; S444-S447 WeakPolarHBondContact O-CB 3.46Å; S444-S447 PolarHBondContact O-N 2.72Å; S444-S447 PolarHBondContact O-OG 3.14Å; S444-S447 PolarHBondContact OG-N 3.18Å; S445-S447 VanDerWaalsContact C-N 3.25Å; S445-S447 PolarHBondContact O-N 3.06Å; S447-S451 PolarHBondContact O-N 2.86Å; S447-S451 PolarHBondContact O-OG 2.88Å
448	D	98.4	Very high	96.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-72.3	-34.3	169.6	-70.9	-28.7	0	0	0	111.4	M378 I387 H388 R389 S444 S445 W450 S451 F452 F513	M378-D448 HydrophobicContact CE-CB 3.71Å; I387-D448 WeakPolarHBondContact CA-OD2 3.37Å; I387-D448 VanDerWaalsContact CG2-OD2 3.22Å; I387-D448 WeakPolarHBondContact CG2-OD2 3.31Å; H388-D448 PolarHBondContact N-OD2 2.77Å; R389-D448 WeakPolarHBondContact CA-OD1 3.44Å; R389-D448 PolarHBondContact N-OD1 3.45Å; S444-D448 PolarHBondContact O-N 2.57Å; S445-D448 CarbonylContact O-C 3.59Å; S445-D448 WeakPolarHBondContact O-CB 3.2Å; S445-D448 PolarHBondContact O-N 2.72Å; D448-W450 VanDerWaalsContact C-N 3.32Å; D448-W450 PolarHBondContact O-N 3.44Å; D448-S451 CarbonylContact O-C 3.5Å; D448-S451 WeakPolarHBondContact O-CA 3.22Å; D448-S451 WeakPolarHBondContact O-CB 3.48Å; D448-S451 PolarHBondContact O-N 3.3Å; D448-S451 VanDerWaalsContact O-N 3.11Å; D448-F452 WeakPolarHBondContact O-CB 3.49Å; D448-F452 PolarHBondContact O-N 3.18Å; D448-F513 HydrophobicContact CB-CE2 4.01Å; D448-F513 HydrophobicContact CB-CZ 4.06Å
449	V	98.8	Very high	96.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.9	-43.5	173.2	166.1	0	0	0	0	111.5	S445 F452 G453 C502 R510 P511 F513 L516	S445-V449 WeakPolarHBondContact O-CG2 3.44Å; S445-V449 PolarHBondContact O-N 3Å; V449-F452 WeakPolarHBondContact O-CB 3.46Å; V449-F452 PolarHBondContact O-N 3.24Å; V449-G453 PolarHBondContact O-N 3.43Å; V449-C502 HydrophobicContact CG1-CB 4.04Å; V449-C502 VanDerWaalsContact O-CB 3.31Å; V449-C502 WeakPolarHBondContact O-CB 3.5Å; V449-R510 HydrophobicContact CG1-CB 3.92Å; V449-P511 HydrophobicContact CG1-CG 4.42Å; V449-P511 WeakPolarHBondContact CG2-O 3.41Å; V449-F513 HydrophobicContact CB-CE2 4.4Å; V449-F513 HydrophobicContact CB-CZ 4.34Å; V449-F513 HydrophobicContact CG2-CD2 3.74Å; V449-F513 HydrophobicContact CG2-CE1 4.27Å; V449-F513 HydrophobicContact CG2-CE2 3.43Å; V449-F513 VanDerWaalsContact CG2-CE2 3.43Å; V449-F513 HydrophobicContact CG2-CG 4.3Å; V449-F513 HydrophobicContact CG2-CZ 3.73Å; V449-L516 HydrophobicContact CG1-CD1 4.04Å; V449-L516 HydrophobicContact CG2-CD1 4.29Å
450	W	98.8	Very high	97.1	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.015	7%	0.066	C	C	.	.	H	α-helix	trans	-60.4	-46.7	173.2	179.2	-69.6	0	0	0	111.4	S433 P434 P435 K446 D448 F452 G453 V454 I479 C502 W503	S433-W450 PolarHBondContact O-NE1 2.8Å; P434-W450 HydrophobicContact CB-CB 3.93Å; P434-W450 HydrophobicContact CB-CD2 3.56Å; P434-W450 HydrophobicContact CB-CE3 3.78Å; P434-W450 HydrophobicContact CB-CG 3.64Å; P434-W450 HydrophobicContact CB-CZ3 4.48Å; P434-W450 HydrophobicContact CG-CB 4.31Å; P434-W450 HydrophobicContact CG-CG 4.36Å; P435-W450 HydrophobicContact CG-CH2 4.34Å; K446-W450 PolarHBondContact O-N 2.97Å; D448-W450 VanDerWaalsContact C-N 3.32Å; D448-W450 PolarHBondContact O-N 3.44Å; W450-F452 VanDerWaalsContact C-N 3.29Å; W450-F452 PolarHBondContact O-N 3.01Å; W450-G453 PolarHBondContact O-N 2.9Å; W450-G453 VanDerWaalsContact O-N 3.1Å; W450-V454 PolarHBondContact O-N 3.41Å; W450-V454 VanDerWaalsContact O-N 3.11Å; W450-I479 HydrophobicContact CH2-CG2 3.64Å; W450-I479 HydrophobicContact CZ2-CD1 4.29Å; W450-I479 HydrophobicContact CZ2-CG2 3.59Å; W450-C502 WeakPolarHBondContact CA-O 3.44Å; W450-W503 HydrophobicContact CD2-CB 4.4Å; W450-W503 AromaticContact CD2-CD1 3.75Å; W450-W503 HydrophobicContact CD2-CG 4.46Å; W450-W503 AromaticContact CE2-CD1 3.85Å; W450-W503 HydrophobicContact CE3-CB 4.08Å; W450-W503 AromaticContact CG-CD1 3.93Å; W450-W503 HydrophobicContact CH2-CB 4.16Å; W450-W503 HydrophobicContact CZ2-CB 4.47Å; W450-W503 HydrophobicContact CZ3-CB 3.96Å; W450-W503 VanDerWaalsContact CZ3-O 3.3Å; W450-W503 WeakPolarHBondContact CZ3-O 3.47Å; W450-W503 PolarHBondContact O-NE1 3.14Å
451	S	98.7	Very high	97.5	Very high	6 Å²	6	8.5 Å²	8.5	4%	0.042	4%	0.042	C	C	.	.	H	α-helix	trans	-59.1	-39.6	177.5	-52.3	0	0	0	0	111.7	L391 W432 S447 D448 V454 L455	L391-S451 WeakPolarHBondContact O-CB 3.19Å; W432-S451 PolarHBondContact O-OG 2.84Å; S447-S451 PolarHBondContact O-N 2.86Å; S447-S451 PolarHBondContact O-OG 2.88Å; D448-S451 CarbonylContact O-C 3.5Å; D448-S451 WeakPolarHBondContact O-CA 3.22Å; D448-S451 WeakPolarHBondContact O-CB 3.48Å; D448-S451 PolarHBondContact O-N 3.3Å; D448-S451 VanDerWaalsContact O-N 3.11Å; S451-V454 PolarHBondContact O-N 3.11Å; S451-L455 PolarHBondContact O-N 3.12Å
452	F	98.9	Very high	97.8	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-63.6	-40.5	173.6	178.2	-107.1	0	0	0	112.3	C371 I374 C375 L391 D448 V449 W450 V454 L455 M456 F513 L516 L520	C371-F452 HydrophobicContact CB-CZ 4.49Å; I374-F452 HydrophobicContact CB-CE2 4.21Å; I374-F452 HydrophobicContact CG2-CD2 3.94Å; I374-F452 HydrophobicContact CG2-CE2 3.9Å; C375-F452 HydrophobicContact CB-CE1 4.43Å; C375-F452 HydrophobicContact CB-CE2 4.08Å; C375-F452 HydrophobicContact CB-CZ 3.69Å; L391-F452 HydrophobicContact CD2-CB 3.7Å; L391-F452 HydrophobicContact CD2-CD2 4.3Å; D448-F452 WeakPolarHBondContact O-CB 3.49Å; D448-F452 PolarHBondContact O-N 3.18Å; V449-F452 WeakPolarHBondContact O-CB 3.46Å; V449-F452 PolarHBondContact O-N 3.24Å; W450-F452 VanDerWaalsContact C-N 3.29Å; W450-F452 PolarHBondContact O-N 3.01Å; F452-V454 VanDerWaalsContact C-N 3.31Å; F452-V454 PolarHBondContact O-N 3.38Å; F452-L455 WeakPolarHBondContact O-CB 3.2Å; F452-L455 PolarHBondContact O-N 3.12Å; F452-M456 HydrophobicContact CD1-CG 4.23Å; F452-M456 HydrophobicContact CD1-SD 4.05Å; F452-M456 HydrophobicContact CE1-CG 3.84Å; F452-M456 HydrophobicContact CE1-SD 3.43Å; F452-M456 WeakPolarHBondContact CE1-SD 3.44Å; F452-M456 HydrophobicContact CE2-CG 4.27Å; F452-M456 HydrophobicContact CZ-CG 3.84Å; F452-M456 HydrophobicContact CZ-SD 3.88Å; F452-M456 WeakPolarHBondContact O-CG 3.38Å; F452-M456 PolarHBondContact O-N 3.3Å; F452-F513 HydrophobicContact CB-CE1 3.66Å; F452-F513 HydrophobicContact CB-CZ 4.01Å; F452-F513 HydrophobicContact CD1-CE1 4.06Å; F452-F513 HydrophobicContact CD2-CE1 4.2Å; F452-F513 AromaticContact CG-CE1 3.72Å; F452-F513 HydrophobicContact CG-CE1 3.72Å; F452-L516 HydrophobicContact CD1-CD1 3.89Å; F452-L516 HydrophobicContact CE1-CD1 4.15Å; F452-L520 HydrophobicContact CE1-CD1 4.17Å; F452-L520 HydrophobicContact CZ-CD1 3.88Å
453	G	98.8	Very high	98	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-57.7	-43	171.4	0	0	0	0	0	112.3	V449 W450 M456 W457 W503	V449-G453 PolarHBondContact O-N 3.43Å; W450-G453 PolarHBondContact O-N 2.9Å; W450-G453 VanDerWaalsContact O-N 3.1Å; G453-M456 PolarHBondContact O-N 3.47Å; G453-W457 PolarHBondContact O-N 3.18Å; G453-W457 VanDerWaalsContact O-N 3.14Å; G453-W503 VanDerWaalsContact C-CZ2 3.46Å; G453-W503 VanDerWaalsContact O-CZ2 3.23Å; G453-W503 WeakPolarHBondContact O-CZ2 3.38Å
454	V	98.8	Very high	98.2	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.006	4%	0.037	C	C	.	.	H	α-helix	trans	-66.3	-40.7	174.9	-177.8	0	0	0	0	111.3	W432 W450 S451 F452 W457 E458 P466 L485 W503	W432-V454 HydrophobicContact CD2-CG1 4.49Å; W432-V454 HydrophobicContact CG-CB 4.43Å; W432-V454 HydrophobicContact CG-CG1 3.99Å; W450-V454 PolarHBondContact O-N 3.41Å; W450-V454 VanDerWaalsContact O-N 3.11Å; S451-V454 PolarHBondContact O-N 3.11Å; F452-V454 VanDerWaalsContact C-N 3.31Å; F452-V454 PolarHBondContact O-N 3.38Å; V454-W457 CarbonylContact O-C 3.52Å; V454-W457 WeakPolarHBondContact O-CA 3.45Å; V454-W457 WeakPolarHBondContact O-CB 3.31Å; V454-W457 PolarHBondContact O-N 3.02Å; V454-W457 VanDerWaalsContact O-N 3.11Å; V454-E458 PolarHBondContact O-N 3.38Å; V454-P466 HydrophobicContact CG1-CB 3.89Å; V454-P466 HydrophobicContact CG1-CG 3.54Å; V454-L485 HydrophobicContact CG1-CD1 4.13Å; V454-L485 HydrophobicContact CG2-CD1 4.26Å; V454-W503 HydrophobicContact CG2-CZ2 4.49Å
455	L	98.8	Very high	98.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.1	-44.8	174.7	-174.7	158.6	0	0	0	111.9	I374 L391 S451 F452 W457 E458 V459	I374-L455 HydrophobicContact CD1-CD1 4.12Å; I374-L455 HydrophobicContact CD1-CD2 3.55Å; I374-L455 HydrophobicContact CD1-CG 4.48Å; I374-L455 HydrophobicContact CG2-CD1 4.2Å; I374-L455 HydrophobicContact CG2-CD2 4.46Å; L391-L455 HydrophobicContact CD1-CD1 3.73Å; L391-L455 HydrophobicContact CG-CD1 3.9Å; S451-L455 PolarHBondContact O-N 3.12Å; F452-L455 WeakPolarHBondContact O-CB 3.2Å; F452-L455 PolarHBondContact O-N 3.12Å; L455-W457 PolarHBondContact O-N 3.29Å; L455-E458 WeakPolarHBondContact O-CB 3.35Å; L455-E458 PolarHBondContact O-N 2.85Å; L455-V459 HydrophobicContact CD2-CG2 3.91Å; L455-V459 WeakPolarHBondContact O-CG2 3.34Å; L455-V459 PolarHBondContact O-N 2.9Å
456	M	98.8	Very high	98.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-56.2	-40.8	173.4	-72.9	-172.9	63.4	0	0	110.7	C371 F452 G453 V459 F460 I495 V498 M499 L520	C371-M456 HydrophobicContact CB-CG 4.35Å; F452-M456 HydrophobicContact CD1-CG 4.23Å; F452-M456 HydrophobicContact CD1-SD 4.05Å; F452-M456 HydrophobicContact CE1-CG 3.84Å; F452-M456 HydrophobicContact CE1-SD 3.43Å; F452-M456 WeakPolarHBondContact CE1-SD 3.44Å; F452-M456 HydrophobicContact CE2-CG 4.27Å; F452-M456 HydrophobicContact CZ-CG 3.84Å; F452-M456 HydrophobicContact CZ-SD 3.88Å; F452-M456 WeakPolarHBondContact O-CG 3.38Å; F452-M456 PolarHBondContact O-N 3.3Å; G453-M456 PolarHBondContact O-N 3.47Å; M456-V459 PolarHBondContact O-N 2.68Å; M456-F460 WeakPolarHBondContact O-CD2 3.45Å; M456-F460 PolarHBondContact O-N 2.68Å; M456-I495 HydrophobicContact CE-CG2 4.05Å; M456-V498 HydrophobicContact CE-CB 4.45Å; M456-V498 HydrophobicContact CE-CG1 4.16Å; M456-V498 HydrophobicContact SD-CG1 4.05Å; M456-M499 HydrophobicContact CB-CE 3.89Å; M456-M499 HydrophobicContact CB-CG 3.81Å; M456-M499 HydrophobicContact CE-CE 4.19Å; M456-M499 HydrophobicContact CE-CG 3.87Å; M456-M499 WeakPolarHBondContact O-CE 3.23Å; M456-M499 HydrophobicContact SD-CG 4.24Å; M456-L520 HydrophobicContact CE-CD2 3.81Å
457	W	98.8	Very high	98.2	Very high	3 Å²	3	9.5 Å²	9.5	1%	0.011	5%	0.046	C	C	.	.	H	α-helix	trans	-65.6	-39.7	175	-175	98.1	0	0	0	112.4	G453 V454 L455 V459 T461 K464 P466 L485 Y486 P488 W503	G453-W457 PolarHBondContact O-N 3.18Å; G453-W457 VanDerWaalsContact O-N 3.14Å; V454-W457 CarbonylContact O-C 3.52Å; V454-W457 WeakPolarHBondContact O-CA 3.45Å; V454-W457 WeakPolarHBondContact O-CB 3.31Å; V454-W457 PolarHBondContact O-N 3.02Å; V454-W457 VanDerWaalsContact O-N 3.11Å; L455-W457 PolarHBondContact O-N 3.29Å; W457-V459 VanDerWaalsContact C-N 3.35Å; W457-V459 PolarHBondContact O-N 2.89Å; W457-T461 HydrophobicContact CD2-CG2 3.89Å; W457-T461 HydrophobicContact CE3-CG2 4.2Å; W457-T461 HydrophobicContact CG-CG2 4.47Å; W457-T461 HydrophobicContact CH2-CG2 4.11Å; W457-T461 HydrophobicContact CZ2-CG2 3.79Å; W457-T461 HydrophobicContact CZ3-CG2 4.29Å; W457-T461 WeakPolarHBondContact O-CB 3.46Å; W457-T461 VanDerWaalsContact O-CG2 3.31Å; W457-T461 WeakPolarHBondContact O-CG2 3.38Å; W457-T461 PolarHBondContact O-N 2.81Å; W457-T461 PolarHBondContact O-OG1 3.11Å; W457-K464 HydrophobicContact CH2-CB 3.82Å; W457-K464 HydrophobicContact CH2-CD 4.28Å; W457-K464 HydrophobicContact CZ3-CB 3.85Å; W457-P466 HydrophobicContact CE3-CG 4.29Å; W457-P466 HydrophobicContact CZ3-CB 4.38Å; W457-P466 HydrophobicContact CZ3-CG 4.21Å; W457-L485 HydrophobicContact CB-CD1 4.23Å; W457-L485 HydrophobicContact CD2-CB 4.37Å; W457-L485 HydrophobicContact CD2-CD1 3.97Å; W457-L485 HydrophobicContact CD2-CD2 4.45Å; W457-L485 HydrophobicContact CE3-CD1 4.29Å; W457-L485 HydrophobicContact CG-CB 4.11Å; W457-L485 HydrophobicContact CG-CD1 3.94Å; W457-L485 HydrophobicContact CZ2-CD2 4.23Å; W457-Y486 VanDerWaalsContact CD1-O 3.28Å; W457-Y486 HydrophobicContact CZ2-CD1 4.37Å; W457-Y486 AromaticContact CZ2-CE1 3.67Å; W457-Y486 HydrophobicContact CZ2-CE1 3.67Å; W457-Y486 AromaticContact CZ2-CZ 3.77Å; W457-Y486 PolarHBondContact NE1-O 3.5Å; W457-P488 HydrophobicContact CG-CG 4.16Å; W457-W503 HydrophobicContact CB-CH2 4.25Å; W457-W503 HydrophobicContact CB-CZ2 4.2Å
458	E	98.7	Very high	97.9	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.009	7%	0.065	C	C	.	.	H	α-helix	trans	-58.1	-45.8	171.1	-65.5	-176.1	93.3	0	0	111.3	A393 W432 V454 L455 T461 E462 G463 P466	A393-E458 HydrophobicContact CB-CB 4.01Å; A393-E458 HydrophobicContact CB-CG 4.44Å; A393-E458 WeakPolarHBondContact CB-OE2 3.35Å; A393-E458 PolarHBondContact N-OE2 2.81Å; W432-E458 WeakPolarHBondContact CZ2-OE1 3.46Å; W432-E458 PolarHBondContact NE1-OE2 2.83Å; V454-E458 PolarHBondContact O-N 3.38Å; L455-E458 WeakPolarHBondContact O-CB 3.35Å; L455-E458 PolarHBondContact O-N 2.85Å; E458-T461 PolarHBondContact O-N 3.25Å; E458-T461 PolarHBondContact O-OG1 3.14Å; E458-E462 PolarHBondContact O-N 3.11Å; E458-E462 VanDerWaalsContact O-N 3.14Å; E458-G463 PolarHBondContact O-N 2.86Å; E458-P466 HydrophobicContact CG-CG 4.01Å
459	V	98.6	Very high	97.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-53	179.2	171.4	0	0	0	0	111.2	L351 L355 L367 V370 L455 M456 W457 T461 E462	L351-V459 HydrophobicContact CD2-CG2 4.04Å; L355-V459 HydrophobicContact CD1-CG2 4.19Å; L355-V459 HydrophobicContact CD2-CG1 4.49Å; L367-V459 HydrophobicContact CB-CG1 3.86Å; L367-V459 HydrophobicContact CD2-CG1 3.87Å; L367-V459 HydrophobicContact CG-CG1 4.41Å; L367-V459 WeakPolarHBondContact O-CG1 3.29Å; V370-V459 HydrophobicContact CB-CG1 4.39Å; V370-V459 HydrophobicContact CG1-CG1 4.25Å; V370-V459 HydrophobicContact CG1-CG2 3.84Å; L455-V459 HydrophobicContact CD2-CG2 3.91Å; L455-V459 WeakPolarHBondContact O-CG2 3.34Å; L455-V459 PolarHBondContact O-N 2.9Å; M456-V459 PolarHBondContact O-N 2.68Å; W457-V459 VanDerWaalsContact C-N 3.35Å; W457-V459 PolarHBondContact O-N 2.89Å; V459-T461 PolarHBondContact O-N 2.92Å; V459-E462 PolarHBondContact O-N 3.07Å; V459-E462 VanDerWaalsContact O-N 3.11Å
460	F	98.4	Very high	97.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-77.5	-2.3	-178.3	-79.8	-88.6	0	0	0	114.8	L367 L368 M456 P488 L490 A491 I495 M499 W527	L367-F460 HydrophobicContact CB-CD1 4.41Å; L367-F460 HydrophobicContact CB-CE1 4.04Å; L367-F460 HydrophobicContact CB-CE2 4.34Å; L367-F460 HydrophobicContact CB-CZ 4Å; L367-F460 HydrophobicContact CD1-CD1 4.23Å; L367-F460 HydrophobicContact CD1-CE1 4.48Å; L368-F460 HydrophobicContact CB-CZ 4.42Å; M456-F460 WeakPolarHBondContact O-CD2 3.45Å; M456-F460 PolarHBondContact O-N 2.68Å; F460-P488 HydrophobicContact CB-CB 3.82Å; F460-P488 HydrophobicContact CB-CG 3.93Å; F460-P488 WeakPolarHBondContact O-CB 3.46Å; F460-L490 HydrophobicContact CD1-CB 4.12Å; F460-A491 HydrophobicContact CB-CB 4.1Å; F460-A491 HydrophobicContact CD1-CB 3.87Å; F460-A491 HydrophobicContact CG-CB 4.05Å; F460-I495 HydrophobicContact CD1-CG2 4.49Å; F460-I495 HydrophobicContact CD2-CG2 4.03Å; F460-I495 HydrophobicContact CE1-CG2 4.2Å; F460-I495 HydrophobicContact CE2-CG2 3.7Å; F460-I495 HydrophobicContact CG-CG2 4.41Å; F460-I495 HydrophobicContact CZ-CG1 4.39Å; F460-I495 HydrophobicContact CZ-CG2 3.8Å; F460-M499 HydrophobicContact CB-CE 3.79Å; F460-M499 HydrophobicContact CD2-CE 3.49Å; F460-M499 VanDerWaalsContact CD2-CE 3.49Å; F460-M499 HydrophobicContact CE2-CE 4.32Å; F460-M499 HydrophobicContact CG-CE 3.81Å; F460-W527 HydrophobicContact CE1-CH2 4.12Å; F460-W527 HydrophobicContact CZ-CH2 4.14Å
461	T	98.1	Very high	97.2	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.043	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	3.5	166.7	56.9	0	0	0	0	114	W457 E458 V459 K464 P488	W457-T461 HydrophobicContact CD2-CG2 3.89Å; W457-T461 HydrophobicContact CE3-CG2 4.2Å; W457-T461 HydrophobicContact CG-CG2 4.47Å; W457-T461 HydrophobicContact CH2-CG2 4.11Å; W457-T461 HydrophobicContact CZ2-CG2 3.79Å; W457-T461 HydrophobicContact CZ3-CG2 4.29Å; W457-T461 WeakPolarHBondContact O-CB 3.46Å; W457-T461 VanDerWaalsContact O-CG2 3.31Å; W457-T461 WeakPolarHBondContact O-CG2 3.38Å; W457-T461 PolarHBondContact O-N 2.81Å; W457-T461 PolarHBondContact O-OG1 3.11Å; E458-T461 PolarHBondContact O-N 3.25Å; E458-T461 PolarHBondContact O-OG1 3.14Å; V459-T461 PolarHBondContact O-N 2.92Å; T461-K464 HydrophobicContact CG2-CD 4.42Å; T461-P488 HydrophobicContact CG2-CB 3.76Å; T461-P488 HydrophobicContact CG2-CG 3.83Å
462	E	97.6	Very high	97	Very high	10 Å²	10	29.9 Å²	29.9	5%	0.047	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	49.5	-178	-54.7	179.7	109.6	0	0	112.4	K359 G360 E458 V459 L490	K359-E462 WeakPolarHBondContact CA-OE1 3.29Å; K359-E462 HydrophobicContact CB-CB 4.32Å; K359-E462 HydrophobicContact CD-CB 4.33Å; K359-E462 HydrophobicContact CG-CB 3.88Å; K359-E462 WeakPolarHBondContact CG-OE2 3.26Å; G360-E462 PolarHBondContact N-OE1 3.19Å; G360-E462 PolarHBondContact N-OE2 2.79Å; E458-E462 PolarHBondContact O-N 3.11Å; E458-E462 VanDerWaalsContact O-N 3.14Å; V459-E462 PolarHBondContact O-N 3.07Å; V459-E462 VanDerWaalsContact O-N 3.11Å; E462-L490 HydrophobicContact CG-CD1 3.85Å
463	G	97.3	Very high	96.8	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.031	18%	0.182	C	C	.	.	S	Bend	trans	80	27.7	171.7	0	0	0	0	0	115.4	R356 E458	R356-G463 VanDerWaalsContact CZ-O 3.3Å; R356-G463 PolarHBondContact NE-O 2.94Å; R356-G463 PolarHBondContact NH2-O 3.36Å; E458-G463 PolarHBondContact O-N 2.86Å
464	K	97.3	Very high	96.7	Very high	62 Å²	62	39.3 Å²	39.3	27%	0.27	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-62.5	152.5	168.1	-80.5	-166.2	162.9	-150.3	0	111.1	W457 T461 P466 E468 Y486	W457-K464 HydrophobicContact CH2-CB 3.82Å; W457-K464 HydrophobicContact CH2-CD 4.28Å; W457-K464 HydrophobicContact CZ3-CB 3.85Å; T461-K464 HydrophobicContact CG2-CD 4.42Å; K464-P466 WeakPolarHBondContact O-CD 3.48Å; K464-E468 IonicContact NZ-OE1 2.78Å; K464-E468 PolarHBondContact NZ-OE1 3.11Å; K464-E468 IonicContact NZ-OE2 2.65Å; K464-Y486 PolarHBondContact NZ-OH 3.48Å
465	M	96.7	Very high	96.6	Very high	79 Å²	79	39.2 Å²	39.2	39%	0.389	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-73.6	124.9	170.4	175.3	59.7	64.9	0	0	109.8	K431 W432 F467 E468	K431-M465 HydrophobicContact CD-SD 4.17Å; W432-M465 HydrophobicContact CH2-SD 3.96Å; M465-F467 PolarHBondContact O-N 3.27Å; M465-E468 HydrophobicContact CB-CB 4.1Å; M465-E468 HydrophobicContact CG-CB 4.42Å; M465-E468 WeakPolarHBondContact O-CB 3.43Å; M465-E468 PolarHBondContact O-N 3.02Å
466	P	97.5	Very high	96.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	134.5	171.6	-26.9	36.1	0	0	0	111.3	K431 W432 V454 W457 E458 K464 E468 L485	K431-P466 HydrophobicContact CB-CB 4.45Å; K431-P466 WeakPolarHBondContact CD-O 3.23Å; K431-P466 PolarHBondContact NZ-O 3.39Å; K431-P466 VanDerWaalsContact NZ-O 3.1Å; W432-P466 HydrophobicContact CH2-CG 4.34Å; W432-P466 HydrophobicContact CZ2-CG 3.8Å; V454-P466 HydrophobicContact CG1-CB 3.89Å; V454-P466 HydrophobicContact CG1-CG 3.54Å; W457-P466 HydrophobicContact CE3-CG 4.29Å; W457-P466 HydrophobicContact CZ3-CB 4.38Å; W457-P466 HydrophobicContact CZ3-CG 4.21Å; E458-P466 HydrophobicContact CG-CG 4.01Å; K464-P466 WeakPolarHBondContact O-CD 3.48Å; P466-E468 VanDerWaalsContact C-N 3.28Å; P466-E468 PolarHBondContact O-N 3.23Å; P466-L485 HydrophobicContact CB-CD1 4.37Å
467	F	95.9	Very high	96.3	Very high	19 Å²	19	45.2 Å²	45.2	8%	0.083	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	45.5	-177.8	-43.1	-87.2	0	0	0	112.8	K431 M465 N469 K470 V475 I479 F483 L485	K431-F467 HydrophobicContact CB-CD2 4.34Å; K431-F467 HydrophobicContact CG-CD2 4.35Å; K431-F467 PolarHBondContact NZ-O 3.38Å; K431-F467 WeakPolarHBondContact O-CE2 3.3Å; M465-F467 PolarHBondContact O-N 3.27Å; F467-N469 PolarHBondContact O-N 2.66Å; F467-K470 HydrophobicContact CB-CB 4.2Å; F467-K470 PolarHBondContact O-N 3.41Å; F467-V475 HydrophobicContact CB-CG2 3.49Å; F467-V475 VanDerWaalsContact CB-CG2 3.49Å; F467-V475 HydrophobicContact CD1-CG2 4.32Å; F467-V475 HydrophobicContact CD2-CG1 3.88Å; F467-V475 HydrophobicContact CD2-CG2 4.01Å; F467-V475 HydrophobicContact CE2-CG1 4.01Å; F467-V475 HydrophobicContact CG-CG1 4.21Å; F467-V475 HydrophobicContact CG-CG2 3.7Å; F467-V475 HydrophobicContact CZ-CG1 4.43Å; F467-I479 HydrophobicContact CE1-CD1 4.49Å; F467-I479 HydrophobicContact CE1-CG1 4.33Å; F467-I479 HydrophobicContact CE2-CD1 4.16Å; F467-I479 HydrophobicContact CZ-CD1 3.81Å; F467-I479 HydrophobicContact CZ-CG1 4.07Å; F467-F483 HydrophobicContact CD1-CD1 4.3Å; F467-F483 AromaticContact CD1-CE1 3.94Å; F467-F483 HydrophobicContact CD1-CE1 3.94Å; F467-F483 AromaticContact CE1-CD1 3.89Å; F467-F483 HydrophobicContact CE1-CD1 3.89Å; F467-F483 AromaticContact CE1-CE1 3.81Å; F467-F483 HydrophobicContact CE1-CE1 3.81Å; F467-L485 HydrophobicContact CD1-CD2 3.74Å; F467-L485 HydrophobicContact CD2-CD2 4.14Å; F467-L485 HydrophobicContact CE1-CD2 3.58Å; F467-L485 HydrophobicContact CE1-CG 3.87Å; F467-L485 HydrophobicContact CE2-CD1 4.21Å; F467-L485 HydrophobicContact CE2-CD2 3.99Å; F467-L485 HydrophobicContact CE2-CG 4.15Å; F467-L485 HydrophobicContact CG-CD2 4.01Å; F467-L485 HydrophobicContact CZ-CD1 4.13Å; F467-L485 HydrophobicContact CZ-CD2 3.72Å; F467-L485 HydrophobicContact CZ-CG 3.66Å
468	E	91.4	Very high	96.2	Very high	87 Å²	87	45.1 Å²	45.1	41%	0.407	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-37.6	-171.9	57.3	-161.8	164.4	0	0	114.4	K464 M465 P466	K464-E468 IonicContact NZ-OE1 2.78Å; K464-E468 PolarHBondContact NZ-OE1 3.11Å; K464-E468 IonicContact NZ-OE2 2.65Å; M465-E468 HydrophobicContact CB-CB 4.1Å; M465-E468 HydrophobicContact CG-CB 4.42Å; M465-E468 WeakPolarHBondContact O-CB 3.43Å; M465-E468 PolarHBondContact O-N 3.02Å; P466-E468 VanDerWaalsContact C-N 3.28Å; P466-E468 PolarHBondContact O-N 3.23Å
469	N	92.1	Very high	96.1	Very high	151 Å²	151	45.2 Å²	45.2	81%	0.807	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	17	-179.2	-58.5	-32.9	0	0	0	115.1	F467	F467-N469 PolarHBondContact O-N 2.66Å
470	K	94.4	Very high	95.9	Very high	68 Å²	68	48.5 Å²	48.5	30%	0.296	25%	0.254	S	S	.	.	S	Bend	trans	-127.4	139.2	178.4	-77	174.8	162.1	-74.3	0	112.1	K431 F467 Q474 V475 A478	K431-K470 WeakPolarHBondContact CE-O 3.34Å; K431-K470 PolarHBondContact NZ-O 2.91Å; F467-K470 HydrophobicContact CB-CB 4.2Å; F467-K470 PolarHBondContact O-N 3.41Å; K470-Q474 HydrophobicContact CB-CB 3.95Å; K470-Q474 HydrophobicContact CD-CB 4.48Å; K470-Q474 WeakPolarHBondContact CD-O 3.46Å; K470-Q474 HydrophobicContact CG-CB 4.04Å; K470-Q474 PolarHBondContact NZ-O 3.3Å; K470-V475 HydrophobicContact CB-CG2 3.71Å; K470-V475 HydrophobicContact CD-CG2 4.37Å; K470-A478 HydrophobicContact CD-CB 4.46Å
471	S	95.7	Very high	95.8	Very high	61 Å²	61	56.2 Å²	56.2	43%	0.427	29%	0.29	S	S	.	.			trans	-68.6	163.5	166.2	80.5	0	0	0	0	111.2	L473 Q474 V475	S471-L473 VanDerWaalsContact C-N 3.25Å; S471-L473 PolarHBondContact O-N 2.78Å; S471-Q474 PolarHBondContact O-N 2.76Å; S471-Q474 VanDerWaalsContact O-N 3.11Å; S471-Q474 WeakPolarHBondContact OG-CG 3.16Å; S471-Q474 PolarHBondContact OG-N 3.31Å; S471-Q474 PolarHBondContact OG-OE1 3.21Å; S471-V475 WeakPolarHBondContact O-CG2 3.28Å; S471-V475 PolarHBondContact O-N 3.04Å
472	N	93.9	Very high	95.7	Very high	74 Å²	74	57.9 Å²	57.9	40%	0.396	31%	0.308	S	S	.	.	H	α-helix	trans	-59.9	-34.6	-179.3	-71.7	-3.3	0	0	0	113	I430 V475 V476	I430-N472 HydrophobicContact CB-CB 4.33Å; I430-N472 HydrophobicContact CD1-CB 3.83Å; I430-N472 HydrophobicContact CG2-CB 4.02Å; N472-V475 PolarHBondContact O-N 3.29Å; N472-V476 WeakPolarHBondContact O-CG2 3.49Å; N472-V476 PolarHBondContact O-N 2.69Å; N472-V476 VanDerWaalsContact O-N 3.08Å
473	L	94.5	Very high	95.7	Very high	113 Å²	113	62.1 Å²	62.1	59%	0.592	33%	0.327	S	S	*	.	H	α-helix	trans	-65.6	-46.7	173.9	-178.7	61.7	0	0	0	111.3	S471 V475 V476 E477	S471-L473 VanDerWaalsContact C-N 3.25Å; S471-L473 PolarHBondContact O-N 2.78Å; L473-V475 PolarHBondContact O-N 2.87Å; L473-V475 VanDerWaalsContact O-N 3.13Å; L473-V476 WeakPolarHBondContact O-CB 3.41Å; L473-V476 PolarHBondContact O-N 3.41Å; L473-V476 VanDerWaalsContact O-N 3.1Å; L473-E477 WeakPolarHBondContact O-CG 3.49Å; L473-E477 PolarHBondContact O-N 2.86Å
474	Q	97	Very high	95.7	Very high	85 Å²	85	63.5 Å²	63.5	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-14.2	176.9	-68	172.5	-36.9	0	0	114.4	K470 S471 E477 A478	K470-Q474 HydrophobicContact CB-CB 3.95Å; K470-Q474 HydrophobicContact CD-CB 4.48Å; K470-Q474 WeakPolarHBondContact CD-O 3.46Å; K470-Q474 HydrophobicContact CG-CB 4.04Å; K470-Q474 PolarHBondContact NZ-O 3.3Å; S471-Q474 PolarHBondContact O-N 2.76Å; S471-Q474 VanDerWaalsContact O-N 3.11Å; S471-Q474 WeakPolarHBondContact OG-CG 3.16Å; S471-Q474 PolarHBondContact OG-N 3.31Å; S471-Q474 PolarHBondContact OG-OE1 3.21Å; Q474-E477 WeakPolarHBondContact CA-OE2 3.34Å; Q474-A478 VanDerWaalsContact O-CB 3.31Å; Q474-A478 WeakPolarHBondContact O-CB 3.44Å; Q474-A478 PolarHBondContact O-N 3.24Å
475	V	96.3	Very high	95.7	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-85.6	-45.6	171.1	170.8	0	0	0	0	110.4	K431 F467 K470 S471 N472 L473 E477 A478 I479	K431-V475 HydrophobicContact CG-CG1 4.41Å; K431-V475 HydrophobicContact CG-CG2 4.28Å; F467-V475 HydrophobicContact CB-CG2 3.49Å; F467-V475 VanDerWaalsContact CB-CG2 3.49Å; F467-V475 HydrophobicContact CD1-CG2 4.32Å; F467-V475 HydrophobicContact CD2-CG1 3.88Å; F467-V475 HydrophobicContact CD2-CG2 4.01Å; F467-V475 HydrophobicContact CE2-CG1 4.01Å; F467-V475 HydrophobicContact CG-CG1 4.21Å; F467-V475 HydrophobicContact CG-CG2 3.7Å; F467-V475 HydrophobicContact CZ-CG1 4.43Å; K470-V475 HydrophobicContact CB-CG2 3.71Å; K470-V475 HydrophobicContact CD-CG2 4.37Å; S471-V475 WeakPolarHBondContact O-CG2 3.28Å; S471-V475 PolarHBondContact O-N 3.04Å; N472-V475 PolarHBondContact O-N 3.29Å; L473-V475 PolarHBondContact O-N 2.87Å; L473-V475 VanDerWaalsContact O-N 3.13Å; V475-E477 PolarHBondContact O-N 2.82Å; V475-A478 PolarHBondContact O-N 2.8Å; V475-I479 HydrophobicContact CG1-CD1 3.48Å; V475-I479 VanDerWaalsContact CG1-CD1 3.48Å; V475-I479 HydrophobicContact CG1-CG1 4.21Å; V475-I479 WeakPolarHBondContact O-CB 3.49Å; V475-I479 VanDerWaalsContact O-CG1 3.26Å; V475-I479 WeakPolarHBondContact O-CG1 3.32Å; V475-I479 PolarHBondContact O-N 3.29Å
476	V	95.4	Very high	95.8	Very high	34 Å²	34	62.5 Å²	62.5	21%	0.206	32%	0.323	C	S	.	.	H	α-helix	trans	-55.9	-49.3	172.6	165.8	0	0	0	0	111	I430 F438 N472 L473 S480	I430-V476 HydrophobicContact CG2-CG2 3.87Å; F438-V476 HydrophobicContact CB-CG2 4.33Å; F438-V476 HydrophobicContact CD1-CG2 4.36Å; F438-V476 HydrophobicContact CD2-CB 4.28Å; F438-V476 HydrophobicContact CD2-CG1 3.79Å; F438-V476 HydrophobicContact CD2-CG2 3.88Å; F438-V476 HydrophobicContact CE2-CB 4.17Å; F438-V476 HydrophobicContact CE2-CG1 3.7Å; F438-V476 HydrophobicContact CE2-CG2 4.2Å; F438-V476 HydrophobicContact CG-CG2 3.98Å; F438-V476 HydrophobicContact CZ-CG1 4.5Å; N472-V476 WeakPolarHBondContact O-CG2 3.49Å; N472-V476 PolarHBondContact O-N 2.69Å; N472-V476 VanDerWaalsContact O-N 3.08Å; L473-V476 WeakPolarHBondContact O-CB 3.41Å; L473-V476 PolarHBondContact O-N 3.41Å; L473-V476 VanDerWaalsContact O-N 3.1Å; V476-S480 WeakPolarHBondContact O-CB 3.43Å; V476-S480 PolarHBondContact O-N 2.66Å; V476-S480 PolarHBondContact O-OG 2.88Å
477	E	96.3	Very high	95.8	Very high	91 Å²	91	68 Å²	68	43%	0.425	34%	0.343	S	S	.	.	H	α-helix	trans	-55.4	-61	175.5	-69.5	164.2	169.4	0	0	110.8	L473 Q474 V475 I479 S480 E481	L473-E477 WeakPolarHBondContact O-CG 3.49Å; L473-E477 PolarHBondContact O-N 2.86Å; Q474-E477 WeakPolarHBondContact CA-OE2 3.34Å; V475-E477 PolarHBondContact O-N 2.82Å; E477-I479 PolarHBondContact O-N 3.07Å; E477-S480 WeakPolarHBondContact O-CA 3.29Å; E477-S480 WeakPolarHBondContact O-CB 3.42Å; E477-S480 PolarHBondContact O-N 3.02Å; E477-S480 VanDerWaalsContact O-N 3.08Å; E477-E481 WeakPolarHBondContact O-CG 3.14Å; E477-E481 PolarHBondContact O-N 2.98Å
478	A	96.8	Very high	95.9	Very high	2 Å²	2	67.1 Å²	67.1	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-39.8	-173.8	0	0	0	0	0	113.6	K470 Q474 V475 S480 E481 G482 F483	K470-A478 HydrophobicContact CD-CB 4.46Å; Q474-A478 VanDerWaalsContact O-CB 3.31Å; Q474-A478 WeakPolarHBondContact O-CB 3.44Å; Q474-A478 PolarHBondContact O-N 3.24Å; V475-A478 PolarHBondContact O-N 2.8Å; A478-S480 PolarHBondContact O-N 3.33Å; A478-E481 CarbonylContact O-C 3.57Å; A478-E481 PolarHBondContact O-N 3.17Å; A478-G482 PolarHBondContact O-N 3.16Å; A478-F483 HydrophobicContact CB-CB 3.88Å; A478-F483 HydrophobicContact CB-CD1 4.4Å; A478-F483 HydrophobicContact CB-CG 4.27Å; A478-F483 WeakPolarHBondContact O-CB 3.39Å; A478-F483 PolarHBondContact O-N 2.99Å
479	I	97.1	Very high	96.1	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-36.4	177.2	-69.8	173.8	0	0	0	110.5	P435 F438 W450 F467 V475 E477 G482 R484	P435-I479 HydrophobicContact CG-CG2 3.93Å; F438-I479 HydrophobicContact CE1-CB 4.25Å; F438-I479 HydrophobicContact CE1-CD1 4.22Å; F438-I479 HydrophobicContact CE1-CG2 3.95Å; F438-I479 HydrophobicContact CZ-CB 4Å; F438-I479 HydrophobicContact CZ-CG2 3.82Å; W450-I479 HydrophobicContact CH2-CG2 3.64Å; W450-I479 HydrophobicContact CZ2-CD1 4.29Å; W450-I479 HydrophobicContact CZ2-CG2 3.59Å; F467-I479 HydrophobicContact CE1-CD1 4.49Å; F467-I479 HydrophobicContact CE1-CG1 4.33Å; F467-I479 HydrophobicContact CE2-CD1 4.16Å; F467-I479 HydrophobicContact CZ-CD1 3.81Å; F467-I479 HydrophobicContact CZ-CG1 4.07Å; V475-I479 HydrophobicContact CG1-CD1 3.48Å; V475-I479 VanDerWaalsContact CG1-CD1 3.48Å; V475-I479 HydrophobicContact CG1-CG1 4.21Å; V475-I479 WeakPolarHBondContact O-CB 3.49Å; V475-I479 VanDerWaalsContact O-CG1 3.26Å; V475-I479 WeakPolarHBondContact O-CG1 3.32Å; V475-I479 PolarHBondContact O-N 3.29Å; E477-I479 PolarHBondContact O-N 3.07Å; I479-G482 PolarHBondContact O-N 3.28Å; I479-G482 VanDerWaalsContact O-N 3.12Å; I479-R484 PolarHBondContact O-NH1 2.78Å
480	S	94.8	Very high	96.2	Very high	69 Å²	69	63.9 Å²	63.9	48%	0.483	32%	0.32	S	S	.	.	H	α-helix	trans	-70.2	-33.4	176.3	-53.6	0	0	0	0	112.4	V476 E477 A478 G482	V476-S480 WeakPolarHBondContact O-CB 3.43Å; V476-S480 PolarHBondContact O-N 2.66Å; V476-S480 PolarHBondContact O-OG 2.88Å; E477-S480 WeakPolarHBondContact O-CA 3.29Å; E477-S480 WeakPolarHBondContact O-CB 3.42Å; E477-S480 PolarHBondContact O-N 3.02Å; E477-S480 VanDerWaalsContact O-N 3.08Å; A478-S480 PolarHBondContact O-N 3.33Å; S480-G482 PolarHBondContact O-N 2.85Å
481	E	96.2	Very high	96.4	Very high	163 Å²	163	60.7 Å²	60.7	76%	0.762	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	1.4	168.6	-65.2	173	154.8	0	0	113.5	E477 A478	E477-E481 WeakPolarHBondContact O-CG 3.14Å; E477-E481 PolarHBondContact O-N 2.98Å; A478-E481 CarbonylContact O-C 3.57Å; A478-E481 PolarHBondContact O-N 3.17Å
482	G	95.4	Very high	96.3	Very high	41 Å²	41	59.4 Å²	59.4	42%	0.423	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	3.1	179.4	0	0	0	0	0	115.3	A478 I479 S480 R484	A478-G482 PolarHBondContact O-N 3.16Å; I479-G482 PolarHBondContact O-N 3.28Å; I479-G482 VanDerWaalsContact O-N 3.12Å; S480-G482 PolarHBondContact O-N 2.85Å; G482-R484 VanDerWaalsContact C-NH1 3.33Å; G482-R484 PolarHBondContact O-NH1 2.64Å
483	F	97	Very high	96.4	Very high	99 Å²	99	60.7 Å²	60.7	43%	0.434	30%	0.301	S	S	.	.			trans	-61.3	141.3	175.9	-176.6	-92.4	0	0	0	111.5	F467 A478	F467-F483 HydrophobicContact CD1-CD1 4.3Å; F467-F483 AromaticContact CD1-CE1 3.94Å; F467-F483 HydrophobicContact CD1-CE1 3.94Å; F467-F483 AromaticContact CE1-CD1 3.89Å; F467-F483 HydrophobicContact CE1-CD1 3.89Å; F467-F483 AromaticContact CE1-CE1 3.81Å; F467-F483 HydrophobicContact CE1-CE1 3.81Å; A478-F483 HydrophobicContact CB-CB 3.88Å; A478-F483 HydrophobicContact CB-CD1 4.4Å; A478-F483 HydrophobicContact CB-CG 4.27Å; A478-F483 WeakPolarHBondContact O-CB 3.39Å; A478-F483 PolarHBondContact O-N 2.99Å
484	R	97.6	Very high	96.5	Very high	32 Å²	32	57.3 Å²	57.3	12%	0.121	29%	0.287	C	S	.	.			trans	-134.1	158.1	178.4	-61	-59.8	-179.3	-96.9	1.6	110.7	I479 G482 Y500 W503	I479-R484 PolarHBondContact O-NH1 2.78Å; G482-R484 VanDerWaalsContact C-NH1 3.33Å; G482-R484 PolarHBondContact O-NH1 2.64Å; R484-Y500 HydrophobicContact CB-CD2 4.37Å; R484-Y500 HydrophobicContact CB-CE2 3.81Å; R484-Y500 HydrophobicContact CG-CE2 3.89Å; R484-W503 HydrophobicContact CB-CE3 4.13Å; R484-W503 PolarHBondContact NE-O 3.26Å; R484-W503 PolarHBondContact NH2-O 3.47Å
485	L	98.2	Very high	96.5	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.037	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-67.1	137	-179.8	-69.4	167	0	0	0	110.7	V454 W457 P466 F467 Y496 W503	V454-L485 HydrophobicContact CG1-CD1 4.13Å; V454-L485 HydrophobicContact CG2-CD1 4.26Å; W457-L485 HydrophobicContact CB-CD1 4.23Å; W457-L485 HydrophobicContact CD2-CB 4.37Å; W457-L485 HydrophobicContact CD2-CD1 3.97Å; W457-L485 HydrophobicContact CD2-CD2 4.45Å; W457-L485 HydrophobicContact CE3-CD1 4.29Å; W457-L485 HydrophobicContact CG-CB 4.11Å; W457-L485 HydrophobicContact CG-CD1 3.94Å; W457-L485 HydrophobicContact CZ2-CD2 4.23Å; P466-L485 HydrophobicContact CB-CD1 4.37Å; F467-L485 HydrophobicContact CD1-CD2 3.74Å; F467-L485 HydrophobicContact CD2-CD2 4.14Å; F467-L485 HydrophobicContact CE1-CD2 3.58Å; F467-L485 HydrophobicContact CE1-CG 3.87Å; F467-L485 HydrophobicContact CE2-CD1 4.21Å; F467-L485 HydrophobicContact CE2-CD2 3.99Å; F467-L485 HydrophobicContact CE2-CG 4.15Å; F467-L485 HydrophobicContact CG-CD2 4.01Å; F467-L485 HydrophobicContact CZ-CD1 4.13Å; F467-L485 HydrophobicContact CZ-CD2 3.72Å; F467-L485 HydrophobicContact CZ-CG 3.66Å; L485-Y496 WeakPolarHBondContact O-CE2 3.05Å; L485-Y496 PolarHBondContact O-OH 3.38Å; L485-Y496 VanDerWaalsContact O-OH 3.11Å; L485-W503 HydrophobicContact CB-CH2 3.68Å; L485-W503 HydrophobicContact CB-CZ2 4.18Å; L485-W503 HydrophobicContact CB-CZ3 4.06Å; L485-W503 HydrophobicContact CD1-CH2 4.28Å; L485-W503 HydrophobicContact CD1-CZ2 3.95Å
486	Y	97.9	Very high	96.6	Very high	114 Å²	114	54.9 Å²	54.9	45%	0.447	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-68.3	154.1	-177.2	67.9	-94	0	0	0	112.6	W457 K464 P488	W457-Y486 VanDerWaalsContact CD1-O 3.28Å; W457-Y486 HydrophobicContact CZ2-CD1 4.37Å; W457-Y486 AromaticContact CZ2-CE1 3.67Å; W457-Y486 HydrophobicContact CZ2-CE1 3.67Å; W457-Y486 AromaticContact CZ2-CZ 3.77Å; W457-Y486 PolarHBondContact NE1-O 3.5Å; K464-Y486 PolarHBondContact NZ-OH 3.48Å; Y486-P488 VanDerWaalsContact O-CD 3.29Å; Y486-P488 WeakPolarHBondContact O-CD 3.18Å
487	R	98.4	Very high	96.8	Very high	115 Å²	115	58.5 Å²	58.5	43%	0.434	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-59.5	119.5	176.7	-177.3	169.2	69.7	72	5.2	112.1	A491 Y496	R487-A491 HydrophobicContact CG-CB 4.4Å; R487-A491 PolarHBondContact NH1-O 2.95Å; R487-Y496 VanDerWaalsContact CA-CD2 3.47Å; R487-Y496 VanDerWaalsContact CA-CE2 3.43Å; R487-Y496 HydrophobicContact CB-CD1 3.83Å; R487-Y496 HydrophobicContact CB-CD2 3.62Å; R487-Y496 HydrophobicContact CB-CE1 4.02Å; R487-Y496 HydrophobicContact CB-CE2 3.81Å; R487-Y496 HydrophobicContact CB-CG 3.61Å; R487-Y496 HydrophobicContact CG-CD1 4.11Å; R487-Y496 HydrophobicContact CG-CD2 3.87Å; R487-Y496 HydrophobicContact CG-CG 3.59Å
488	P	97.5	Very high	96.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-62.6	144.7	174.7	-22.4	33.9	0	0	0	112.4	W457 F460 T461 Y486 L490 A491 M499	W457-P488 HydrophobicContact CG-CG 4.16Å; F460-P488 HydrophobicContact CB-CB 3.82Å; F460-P488 HydrophobicContact CB-CG 3.93Å; F460-P488 WeakPolarHBondContact O-CB 3.46Å; T461-P488 HydrophobicContact CG2-CB 3.76Å; T461-P488 HydrophobicContact CG2-CG 3.83Å; Y486-P488 VanDerWaalsContact O-CD 3.29Å; Y486-P488 WeakPolarHBondContact O-CD 3.18Å; P488-L490 VanDerWaalsContact C-N 3.26Å; P488-L490 PolarHBondContact O-N 2.64Å; P488-A491 HydrophobicContact CB-CB 4.12Å; P488-A491 HydrophobicContact CG-CB 4.32Å; P488-A491 WeakPolarHBondContact O-CB 3.02Å; P488-A491 PolarHBondContact O-N 2.91Å; P488-M499 HydrophobicContact CG-CE 4.38Å; P488-M499 HydrophobicContact CG-SD 4.35Å
489	H	95.2	Very high	97	Very high	142 Å²	142	54.7 Å²	54.7	66%	0.657	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.6	-177.8	74.4	-65.2	0	0	0	114.2
490	L	95.9	Very high	97	Very high	28 Å²	28	60.1 Å²	60.1	15%	0.147	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-24.6	175.8	-60.5	179.4	0	0	0	113	K364 L367 F460 E462 P488 P492	K364-L490 WeakPolarHBondContact CD-O 3.46Å; K364-L490 WeakPolarHBondContact CE-O 3.28Å; L367-L490 HydrophobicContact CD1-CB 4.43Å; L367-L490 HydrophobicContact CD1-CD1 3.67Å; F460-L490 HydrophobicContact CD1-CB 4.12Å; E462-L490 HydrophobicContact CG-CD1 3.85Å; P488-L490 VanDerWaalsContact C-N 3.26Å; P488-L490 PolarHBondContact O-N 2.64Å; L490-P492 WeakPolarHBondContact O-CD 3.35Å
491	A	96.7	Very high	97.2	Very high	1 Å²	1	59 Å²	59	1%	0.008	29%	0.285	C	S	.	.	S	Bend	trans	-78.7	122.3	-176.1	0	0	0	0	0	111.7	F460 R487 P488 I495 M499	F460-A491 HydrophobicContact CB-CB 4.1Å; F460-A491 HydrophobicContact CD1-CB 3.87Å; F460-A491 HydrophobicContact CG-CB 4.05Å; R487-A491 HydrophobicContact CG-CB 4.4Å; R487-A491 PolarHBondContact NH1-O 2.95Å; P488-A491 HydrophobicContact CB-CB 4.12Å; P488-A491 HydrophobicContact CG-CB 4.32Å; P488-A491 WeakPolarHBondContact O-CB 3.02Å; P488-A491 PolarHBondContact O-N 2.91Å; A491-I495 HydrophobicContact CB-CB 4.44Å; A491-I495 HydrophobicContact CB-CG2 3.95Å; A491-M499 HydrophobicContact CB-CE 4.14Å
492	P	94.4	Very high	97.4	Very high	34 Å²	34	51.2 Å²	51.2	22%	0.221	25%	0.249	C	C	.	.			trans	-57.2	165.6	162.6	-20	30.8	0	0	0	112	L490 S494 I495 Y496 W527	L490-P492 WeakPolarHBondContact O-CD 3.35Å; P492-S494 PolarHBondContact O-N 2.66Å; P492-I495 HydrophobicContact CG-CG1 4.21Å; P492-I495 PolarHBondContact O-N 2.64Å; P492-Y496 PolarHBondContact O-N 3.36Å; P492-Y496 VanDerWaalsContact O-N 3.14Å; P492-W527 HydrophobicContact CG-CZ2 3.54Å
493	M	96.2	Very high	97.5	Very high	101 Å²	101	49.5 Å²	49.5	50%	0.498	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-43.3	177.7	-166.4	64.3	-168.6	0	0	112	I495 Y496 E497	M493-I495 VanDerWaalsContact C-N 3.34Å; M493-I495 PolarHBondContact O-N 2.9Å; M493-Y496 HydrophobicContact CE-CD1 4.16Å; M493-Y496 CarbonylContact O-C 3.55Å; M493-Y496 WeakPolarHBondContact O-CA 3.43Å; M493-Y496 WeakPolarHBondContact O-CB 3.45Å; M493-Y496 PolarHBondContact O-N 3.43Å; M493-Y496 HydrophobicContact SD-CD1 4.18Å; M493-E497 HydrophobicContact CE-CG 4.13Å; M493-E497 HydrophobicContact CG-CG 4.36Å; M493-E497 WeakPolarHBondContact CG-OE1 3.11Å; M493-E497 WeakPolarHBondContact O-CG 3.26Å; M493-E497 PolarHBondContact O-N 3.15Å
494	S	96.6	Very high	97.6	Very high	42 Å²	42	48.9 Å²	48.9	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-57.9	-40.7	177.3	52.8	0	0	0	0	113.9	P492 Y496 E497 V498	P492-S494 PolarHBondContact O-N 2.66Å; S494-Y496 VanDerWaalsContact C-N 3.32Å; S494-E497 WeakPolarHBondContact CA-OE2 3.39Å; S494-E497 PolarHBondContact O-N 3.11Å; S494-V498 WeakPolarHBondContact O-CG2 3.35Å; S494-V498 PolarHBondContact O-N 3.5Å
495	I	97.6	Very high	97.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-37	174.1	-69.5	-62.6	0	0	0	111.4	L368 M456 F460 A491 P492 M493 V498 M499 L520 I523 W527	L368-I495 HydrophobicContact CD1-CD1 3.66Å; L368-I495 HydrophobicContact CD2-CD1 4.28Å; M456-I495 HydrophobicContact CE-CG2 4.05Å; F460-I495 HydrophobicContact CD1-CG2 4.49Å; F460-I495 HydrophobicContact CD2-CG2 4.03Å; F460-I495 HydrophobicContact CE1-CG2 4.2Å; F460-I495 HydrophobicContact CE2-CG2 3.7Å; F460-I495 HydrophobicContact CG-CG2 4.41Å; F460-I495 HydrophobicContact CZ-CG1 4.39Å; F460-I495 HydrophobicContact CZ-CG2 3.8Å; A491-I495 HydrophobicContact CB-CB 4.44Å; A491-I495 HydrophobicContact CB-CG2 3.95Å; P492-I495 HydrophobicContact CG-CG1 4.21Å; P492-I495 PolarHBondContact O-N 2.64Å; M493-I495 VanDerWaalsContact C-N 3.34Å; M493-I495 PolarHBondContact O-N 2.9Å; I495-V498 PolarHBondContact O-N 3.2Å; I495-M499 HydrophobicContact CG2-CE 3.57Å; I495-M499 HydrophobicContact CG2-SD 4.5Å; I495-M499 WeakPolarHBondContact O-CG 3.46Å; I495-M499 PolarHBondContact O-N 3.4Å; I495-M499 VanDerWaalsContact O-N 3.07Å; I495-L520 HydrophobicContact CD1-CD2 4.13Å; I495-I523 HydrophobicContact CD1-CB 4.47Å; I495-I523 HydrophobicContact CD1-CD1 3.99Å; I495-I523 HydrophobicContact CD1-CG2 3.81Å; I495-I523 HydrophobicContact CG1-CG2 4.22Å; I495-W527 HydrophobicContact CG1-CZ2 4.49Å
496	Y	98.4	Very high	97.4	Very high	35 Å²	35	59.4 Å²	59.4	14%	0.137	28%	0.276	C	S	.	.	H	α-helix	trans	-74.4	-31.8	177.1	-178	-111.5	0	0	0	113.2	L485 R487 P492 M493 S494 V498 M499 Y500 W503	L485-Y496 WeakPolarHBondContact O-CE2 3.05Å; L485-Y496 PolarHBondContact O-OH 3.38Å; L485-Y496 VanDerWaalsContact O-OH 3.11Å; R487-Y496 VanDerWaalsContact CA-CD2 3.47Å; R487-Y496 VanDerWaalsContact CA-CE2 3.43Å; R487-Y496 HydrophobicContact CB-CD1 3.83Å; R487-Y496 HydrophobicContact CB-CD2 3.62Å; R487-Y496 HydrophobicContact CB-CE1 4.02Å; R487-Y496 HydrophobicContact CB-CE2 3.81Å; R487-Y496 HydrophobicContact CB-CG 3.61Å; R487-Y496 HydrophobicContact CG-CD1 4.11Å; R487-Y496 HydrophobicContact CG-CD2 3.87Å; R487-Y496 HydrophobicContact CG-CG 3.59Å; P492-Y496 PolarHBondContact O-N 3.36Å; P492-Y496 VanDerWaalsContact O-N 3.14Å; M493-Y496 HydrophobicContact CE-CD1 4.16Å; M493-Y496 CarbonylContact O-C 3.55Å; M493-Y496 WeakPolarHBondContact O-CA 3.43Å; M493-Y496 WeakPolarHBondContact O-CB 3.45Å; M493-Y496 PolarHBondContact O-N 3.43Å; M493-Y496 HydrophobicContact SD-CD1 4.18Å; S494-Y496 VanDerWaalsContact C-N 3.32Å; Y496-V498 VanDerWaalsContact C-N 3.3Å; Y496-V498 PolarHBondContact O-N 3.22Å; Y496-M499 HydrophobicContact CD2-CB 4.35Å; Y496-M499 HydrophobicContact CD2-SD 3.96Å; Y496-M499 WeakPolarHBondContact O-CB 3.3Å; Y496-M499 PolarHBondContact O-N 3.26Å; Y496-Y500 HydrophobicContact CE1-CD2 4.26Å; Y496-Y500 AromaticContact CZ-CD2 3.96Å; Y496-Y500 VanDerWaalsContact O-CB 3.26Å; Y496-Y500 WeakPolarHBondContact O-CB 3.25Å; Y496-Y500 PolarHBondContact O-N 2.69Å; Y496-W503 HydrophobicContact CE2-CZ3 4.16Å
497	E	98.4	Very high	97.4	Very high	110 Å²	110	55.7 Å²	55.7	51%	0.514	27%	0.266	S	S	.	.	H	α-helix	trans	-61.9	-40.6	171.5	-72.3	160	175.7	0	0	110.5	M493 S494 Y500 S501	M493-E497 HydrophobicContact CE-CG 4.13Å; M493-E497 HydrophobicContact CG-CG 4.36Å; M493-E497 WeakPolarHBondContact CG-OE1 3.11Å; M493-E497 WeakPolarHBondContact O-CG 3.26Å; M493-E497 PolarHBondContact O-N 3.15Å; S494-E497 WeakPolarHBondContact CA-OE2 3.39Å; S494-E497 PolarHBondContact O-N 3.11Å; E497-Y500 PolarHBondContact O-N 3.25Å; E497-S501 WeakPolarHBondContact O-CB 3.17Å; E497-S501 PolarHBondContact O-N 3.38Å
498	V	98.5	Very high	97.3	Very high	12 Å²	12	60 Å²	60	7%	0.073	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-53	169.9	178.8	0	0	0	0	111.1	M456 S494 I495 Y496 Y500 S501 C502 L516 A519 L520 I523	M456-V498 HydrophobicContact CE-CB 4.45Å; M456-V498 HydrophobicContact CE-CG1 4.16Å; M456-V498 HydrophobicContact SD-CG1 4.05Å; S494-V498 WeakPolarHBondContact O-CG2 3.35Å; S494-V498 PolarHBondContact O-N 3.5Å; I495-V498 PolarHBondContact O-N 3.2Å; Y496-V498 VanDerWaalsContact C-N 3.3Å; Y496-V498 PolarHBondContact O-N 3.22Å; V498-Y500 VanDerWaalsContact C-N 3.26Å; V498-Y500 PolarHBondContact O-N 3.21Å; V498-S501 PolarHBondContact O-N 2.87Å; V498-S501 PolarHBondContact O-OG 3.16Å; V498-C502 PolarHBondContact O-N 3.35Å; V498-C502 PolarHBondContact O-SG 2.79Å; V498-L516 HydrophobicContact CG1-CD2 3.52Å; V498-A519 HydrophobicContact CG2-CB 4.2Å; V498-L520 HydrophobicContact CG1-CD2 4.14Å; V498-L520 HydrophobicContact CG1-CG 4.47Å; V498-I523 HydrophobicContact CG2-CD1 3.96Å
499	M	98.6	Very high	97.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-53	-43.4	176.5	-66.4	166.2	-179.5	0	0	112.5	M456 F460 P488 A491 I495 Y496 C502 W503	M456-M499 HydrophobicContact CB-CE 3.89Å; M456-M499 HydrophobicContact CB-CG 3.81Å; M456-M499 HydrophobicContact CE-CE 4.19Å; M456-M499 HydrophobicContact CE-CG 3.87Å; M456-M499 WeakPolarHBondContact O-CE 3.23Å; M456-M499 HydrophobicContact SD-CG 4.24Å; F460-M499 HydrophobicContact CB-CE 3.79Å; F460-M499 HydrophobicContact CD2-CE 3.49Å; F460-M499 VanDerWaalsContact CD2-CE 3.49Å; F460-M499 HydrophobicContact CE2-CE 4.32Å; F460-M499 HydrophobicContact CG-CE 3.81Å; P488-M499 HydrophobicContact CG-CE 4.38Å; P488-M499 HydrophobicContact CG-SD 4.35Å; A491-M499 HydrophobicContact CB-CE 4.14Å; I495-M499 HydrophobicContact CG2-CE 3.57Å; I495-M499 HydrophobicContact CG2-SD 4.5Å; I495-M499 WeakPolarHBondContact O-CG 3.46Å; I495-M499 PolarHBondContact O-N 3.4Å; I495-M499 VanDerWaalsContact O-N 3.07Å; Y496-M499 HydrophobicContact CD2-CB 4.35Å; Y496-M499 HydrophobicContact CD2-SD 3.96Å; Y496-M499 WeakPolarHBondContact O-CB 3.3Å; Y496-M499 PolarHBondContact O-N 3.26Å; M499-C502 WeakPolarHBondContact O-CB 3.09Å; M499-C502 PolarHBondContact O-N 2.86Å; M499-W503 HydrophobicContact CB-CH2 3.92Å; M499-W503 HydrophobicContact CB-CZ2 4.37Å; M499-W503 HydrophobicContact CB-CZ3 4.19Å; M499-W503 VanDerWaalsContact O-CD2 3.3Å
500	Y	98.6	Very high	97.4	Very high	118 Å²	118	55.3 Å²	55.3	46%	0.463	28%	0.277	S	S	.	.	H	α-helix	trans	-72.4	-34.4	-175.7	-160.9	-88.9	0	0	0	112	R484 Y496 E497 V498 C502 W503	R484-Y500 HydrophobicContact CB-CD2 4.37Å; R484-Y500 HydrophobicContact CB-CE2 3.81Å; R484-Y500 HydrophobicContact CG-CE2 3.89Å; Y496-Y500 HydrophobicContact CE1-CD2 4.26Å; Y496-Y500 AromaticContact CZ-CD2 3.96Å; Y496-Y500 VanDerWaalsContact O-CB 3.26Å; Y496-Y500 WeakPolarHBondContact O-CB 3.25Å; Y496-Y500 PolarHBondContact O-N 2.69Å; E497-Y500 PolarHBondContact O-N 3.25Å; V498-Y500 VanDerWaalsContact C-N 3.26Å; V498-Y500 PolarHBondContact O-N 3.21Å; Y500-C502 VanDerWaalsContact C-N 3.27Å; Y500-C502 PolarHBondContact O-N 3.21Å; Y500-W503 HydrophobicContact CD2-CE3 4.25Å; Y500-W503 PolarHBondContact O-N 2.76Å
501	S	98.6	Very high	97.5	Very high	45 Å²	45	55 Å²	55	32%	0.315	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-35	173.6	76.8	0	0	0	0	112.6	E497 V498 W503 H504	E497-S501 WeakPolarHBondContact O-CB 3.17Å; E497-S501 PolarHBondContact O-N 3.38Å; V498-S501 PolarHBondContact O-N 2.87Å; V498-S501 PolarHBondContact O-OG 3.16Å; S501-W503 PolarHBondContact O-N 3.34Å; S501-H504 PolarHBondContact O-N 2.83Å
502	C	98.8	Very high	97.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-26.1	173.2	-62.1	0	0	0	0	113	V449 W450 V498 M499 Y500 R510	V449-C502 HydrophobicContact CG1-CB 4.04Å; V449-C502 VanDerWaalsContact O-CB 3.31Å; V449-C502 WeakPolarHBondContact O-CB 3.5Å; W450-C502 WeakPolarHBondContact CA-O 3.44Å; V498-C502 PolarHBondContact O-N 3.35Å; V498-C502 PolarHBondContact O-SG 2.79Å; M499-C502 WeakPolarHBondContact O-CB 3.09Å; M499-C502 PolarHBondContact O-N 2.86Å; Y500-C502 VanDerWaalsContact C-N 3.27Å; Y500-C502 PolarHBondContact O-N 3.21Å; C502-R510 VanDerWaalsContact O-CD 3.3Å; C502-R510 WeakPolarHBondContact O-CD 3.49Å
503	W	98.6	Very high	97.8	Very high	5 Å²	5	55.4 Å²	55.4	2%	0.019	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	21.1	-177.8	-48.9	-44.8	0	0	0	114.4	W450 G453 V454 W457 R484 L485 Y496 M499 Y500 S501 E505	W450-W503 HydrophobicContact CD2-CB 4.4Å; W450-W503 AromaticContact CD2-CD1 3.75Å; W450-W503 HydrophobicContact CD2-CG 4.46Å; W450-W503 AromaticContact CE2-CD1 3.85Å; W450-W503 HydrophobicContact CE3-CB 4.08Å; W450-W503 AromaticContact CG-CD1 3.93Å; W450-W503 HydrophobicContact CH2-CB 4.16Å; W450-W503 HydrophobicContact CZ2-CB 4.47Å; W450-W503 HydrophobicContact CZ3-CB 3.96Å; W450-W503 VanDerWaalsContact CZ3-O 3.3Å; W450-W503 WeakPolarHBondContact CZ3-O 3.47Å; W450-W503 PolarHBondContact O-NE1 3.14Å; G453-W503 VanDerWaalsContact C-CZ2 3.46Å; G453-W503 VanDerWaalsContact O-CZ2 3.23Å; G453-W503 WeakPolarHBondContact O-CZ2 3.38Å; V454-W503 HydrophobicContact CG2-CZ2 4.49Å; W457-W503 HydrophobicContact CB-CH2 4.25Å; W457-W503 HydrophobicContact CB-CZ2 4.2Å; R484-W503 HydrophobicContact CB-CE3 4.13Å; R484-W503 PolarHBondContact NE-O 3.26Å; R484-W503 PolarHBondContact NH2-O 3.47Å; L485-W503 HydrophobicContact CB-CH2 3.68Å; L485-W503 HydrophobicContact CB-CZ2 4.18Å; L485-W503 HydrophobicContact CB-CZ3 4.06Å; L485-W503 HydrophobicContact CD1-CH2 4.28Å; L485-W503 HydrophobicContact CD1-CZ2 3.95Å; Y496-W503 HydrophobicContact CE2-CZ3 4.16Å; M499-W503 HydrophobicContact CB-CH2 3.92Å; M499-W503 HydrophobicContact CB-CZ2 4.37Å; M499-W503 HydrophobicContact CB-CZ3 4.19Å; M499-W503 VanDerWaalsContact O-CD2 3.3Å; Y500-W503 HydrophobicContact CD2-CE3 4.25Å; Y500-W503 PolarHBondContact O-N 2.76Å; S501-W503 PolarHBondContact O-N 3.34Å; W503-E505 PolarHBondContact O-N 3.29Å
504	H	98.3	Very high	97.9	Very high	86 Å²	86	52.8 Å²	52.8	40%	0.398	27%	0.272	S	S	.	.			trans	-56	131.8	167.8	-173.7	-83.4	0	0	0	109.9	S501 K506 G509 R510	S501-H504 PolarHBondContact O-N 2.83Å; H504-K506 PolarHBondContact ND1-N 3.34Å; H504-K506 PolarHBondContact ND1-O 3.3Å; H504-K506 PolarHBondContact O-N 3.24Å; H504-G509 WeakPolarHBondContact CB-O 3.4Å; H504-G509 WeakPolarHBondContact ND1-CA 3.09Å; H504-R510 HydrophobicContact CB-CG 3.93Å; H504-R510 PolarHBondContact O-NE 2.94Å
505	E	95.5	Very high	97.9	Very high	123 Å²	123	55.3 Å²	55.3	58%	0.575	28%	0.28	S	S	*	.	S	Bend	trans	-53.1	-59.6	-173.7	-175.3	-153.8	151.4	0	0	111.6	W503 R510	W503-E505 PolarHBondContact O-N 3.29Å; E505-R510 PolarHBondContact O-NH2 3.1Å
506	K	96.9	Very high	98	Very high	136 Å²	136	55.5 Å²	55.5	59%	0.591	28%	0.281	S	S	*	.	S	Bend	trans	-76.4	129.9	178.5	-59.3	174.6	-177.6	173.1	0	110.2	H504 K508 G509	H504-K506 PolarHBondContact ND1-N 3.34Å; H504-K506 PolarHBondContact ND1-O 3.3Å; H504-K506 PolarHBondContact O-N 3.24Å; K506-K508 VanDerWaalsContact C-N 3.26Å; K506-K508 PolarHBondContact O-N 2.8Å; K506-K508 VanDerWaalsContact O-N 3.16Å; K506-G509 PolarHBondContact O-N 3.17Å
507	P	97.2	Very high	97.8	Very high	37 Å²	37	55.6 Å²	55.6	24%	0.24	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-52.5	-38.7	-179	-31.1	36.4	0	0	0	114.8	E436 K446 G509 R510	E436-P507 HydrophobicContact CG-CG 3.95Å; K446-P507 HydrophobicContact CB-CB 3.82Å; K446-P507 HydrophobicContact CG-CB 4.4Å; P507-G509 PolarHBondContact O-N 3.05Å; P507-G509 VanDerWaalsContact O-N 3.17Å; P507-R510 WeakPolarHBondContact O-CB 3.26Å; P507-R510 PolarHBondContact O-N 3.3Å
508	K	96	Very high	97.6	Very high	204 Å²	204	57 Å²	57	89%	0.887	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68.2	-9.3	179.7	-63	-169.5	177.1	-172.5	0	114.9	K506	K506-K508 VanDerWaalsContact C-N 3.26Å; K506-K508 PolarHBondContact O-N 2.8Å; K506-K508 VanDerWaalsContact O-N 3.16Å
509	G	97.4	Very high	97.4	Very high	40 Å²	40	57.7 Å²	57.7	41%	0.412	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-98.3	4.7	171.5	0	0	0	0	0	114	H504 K506 P507	H504-G509 WeakPolarHBondContact CB-O 3.4Å; H504-G509 WeakPolarHBondContact ND1-CA 3.09Å; K506-G509 PolarHBondContact O-N 3.17Å; P507-G509 PolarHBondContact O-N 3.05Å; P507-G509 VanDerWaalsContact O-N 3.17Å
510	R	98.6	Very high	97.2	Very high	5 Å²	5	57.7 Å²	57.7	2%	0.019	29%	0.291	C	S	.	.	S	Bend	trans	-93.5	139.3	173.7	-55.1	173	-162.3	153.5	10.8	109.3	E436 K446 V449 C502 H504 E505 P507	E436-R510 IonicContact OE1-CZ 3.66Å; E436-R510 IonicContact OE1-NH1 3.65Å; E436-R510 PolarHBondContact OE1-NH1 3.04Å; E436-R510 IonicContact OE1-NH2 2.67Å; E436-R510 PolarHBondContact OE1-NH2 2.83Å; E436-R510 IonicContact OE2-CZ 3.26Å; E436-R510 IonicContact OE2-NH1 2.75Å; E436-R510 IonicContact OE2-NH2 2.68Å; E436-R510 PolarHBondContact OE2-NH2 2.95Å; K446-R510 HydrophobicContact CD-CB 4.31Å; K446-R510 PolarHBondContact NZ-O 2.78Å; K446-R510 VanDerWaalsContact O-CD 3.29Å; K446-R510 WeakPolarHBondContact O-CD 3.33Å; K446-R510 PolarHBondContact O-NH1 3.25Å; V449-R510 HydrophobicContact CG1-CB 3.92Å; C502-R510 VanDerWaalsContact O-CD 3.3Å; C502-R510 WeakPolarHBondContact O-CD 3.49Å; H504-R510 HydrophobicContact CB-CG 3.93Å; H504-R510 PolarHBondContact O-NE 2.94Å; E505-R510 PolarHBondContact O-NH2 3.1Å; P507-R510 WeakPolarHBondContact O-CB 3.26Å; P507-R510 PolarHBondContact O-N 3.3Å
511	P	98.5	Very high	96.7	Very high	22 Å²	22	54.4 Å²	54.4	14%	0.143	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-63.5	166.7	179.5	28.3	-36.6	0	0	0	112.5	K446 V449 E515 L516	K446-P511 PolarHBondContact NZ-O 2.99Å; V449-P511 HydrophobicContact CG1-CG 4.42Å; V449-P511 WeakPolarHBondContact CG2-O 3.41Å; P511-E515 VanDerWaalsContact CA-OE2 3.27Å; P511-E515 WeakPolarHBondContact CA-OE2 3.18Å; P511-E515 HydrophobicContact CB-CB 3.98Å; P511-L516 HydrophobicContact CB-CD2 4.33Å; P511-L516 HydrophobicContact CB-CG 4.13Å; P511-L516 HydrophobicContact CG-CD1 4.18Å; P511-L516 HydrophobicContact CG-CD2 3.54Å; P511-L516 HydrophobicContact CG-CG 3.7Å
512	T	98.5	Very high	96.2	Very high	42 Å²	42	55.7 Å²	55.7	26%	0.258	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-78.6	163.8	165.2	61.9	0	0	0	0	110.8	E382 A514 E515 L516	E382-T512 WeakPolarHBondContact OE1-CA 3.44Å; E382-T512 WeakPolarHBondContact OE2-CB 3.48Å; T512-A514 PolarHBondContact O-N 3.23Å; T512-E515 PolarHBondContact N-OE2 2.87Å; T512-E515 PolarHBondContact O-N 3.12Å; T512-E515 WeakPolarHBondContact OG1-CB 3.26Å; T512-E515 VanDerWaalsContact OG1-CG 3.28Å; T512-E515 WeakPolarHBondContact OG1-CG 3.33Å; T512-E515 PolarHBondContact OG1-N 2.94Å; T512-E515 PolarHBondContact OG1-OE2 3.36Å; T512-L516 WeakPolarHBondContact O-CG 3.48Å; T512-L516 PolarHBondContact O-N 2.91Å
513	F	98.5	Very high	95.7	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-29.2	171.7	-77	-74.9	0	0	0	112.3	C375 M378 E379 E382 L391 D448 V449 F452 L516 L517	C375-F513 PolarHBondContact SG-O 3.06Å; M378-F513 HydrophobicContact CB-CB 4.4Å; M378-F513 HydrophobicContact CB-CD1 3.36Å; M378-F513 HydrophobicContact CB-CD2 3.89Å; M378-F513 HydrophobicContact CB-CE1 3.35Å; M378-F513 HydrophobicContact CB-CE2 3.87Å; M378-F513 HydrophobicContact CB-CG 3.62Å; M378-F513 HydrophobicContact CB-CZ 3.61Å; M378-F513 HydrophobicContact CE-CE2 3.85Å; M378-F513 HydrophobicContact CE-CZ 3.86Å; M378-F513 HydrophobicContact CG-CD1 4.23Å; M378-F513 HydrophobicContact CG-CE1 3.73Å; M378-F513 HydrophobicContact CG-CE2 4.45Å; M378-F513 HydrophobicContact CG-CZ 3.84Å; E379-F513 HydrophobicContact CB-CB 3.95Å; E382-F513 HydrophobicContact CB-CD2 4.1Å; E382-F513 HydrophobicContact CG-CD2 4.47Å; E382-F513 PolarHBondContact OE1-N 3.4Å; E382-F513 WeakPolarHBondContact OE2-CB 3.27Å; E382-F513 PolarHBondContact OE2-N 3.3Å; L391-F513 HydrophobicContact CD2-CZ 4.46Å; D448-F513 HydrophobicContact CB-CE2 4.01Å; D448-F513 HydrophobicContact CB-CZ 4.06Å; V449-F513 HydrophobicContact CB-CE2 4.4Å; V449-F513 HydrophobicContact CB-CZ 4.34Å; V449-F513 HydrophobicContact CG2-CD2 3.74Å; V449-F513 HydrophobicContact CG2-CE1 4.27Å; V449-F513 HydrophobicContact CG2-CE2 3.43Å; V449-F513 VanDerWaalsContact CG2-CE2 3.43Å; V449-F513 HydrophobicContact CG2-CG 4.3Å; V449-F513 HydrophobicContact CG2-CZ 3.73Å; F452-F513 HydrophobicContact CB-CE1 3.66Å; F452-F513 HydrophobicContact CB-CZ 4.01Å; F452-F513 HydrophobicContact CD1-CE1 4.06Å; F452-F513 HydrophobicContact CD2-CE1 4.2Å; F452-F513 AromaticContact CG-CE1 3.72Å; F452-F513 HydrophobicContact CG-CE1 3.72Å; F513-L516 HydrophobicContact CD1-CD1 3.98Å; F513-L516 HydrophobicContact CE1-CD1 4.28Å; F513-L516 PolarHBondContact O-N 3.43Å; F513-L517 VanDerWaalsContact O-CB 3.24Å; F513-L517 WeakPolarHBondContact O-CB 3.36Å; F513-L517 PolarHBondContact O-N 2.95Å
514	A	97.2	Very high	95	Very high	46 Å²	46	56.5 Å²	56.5	38%	0.38	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-41.6	170.2	0	0	0	0	0	112.9	E379 T512 R518	E379-A514 HydrophobicContact CG-CB 4.05Å; T512-A514 PolarHBondContact O-N 3.23Å; A514-R518 PolarHBondContact O-N 3.24Å; A514-R518 VanDerWaalsContact O-N 3.14Å
515	E	98	Very high	94	Very high	95 Å²	95	53.5 Å²	53.5	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-66.9	-41.9	175.2	-73.9	171.1	142.2	0	0	112	P511 T512 R518 A519	P511-E515 VanDerWaalsContact CA-OE2 3.27Å; P511-E515 WeakPolarHBondContact CA-OE2 3.18Å; P511-E515 HydrophobicContact CB-CB 3.98Å; T512-E515 PolarHBondContact N-OE2 2.87Å; T512-E515 PolarHBondContact O-N 3.12Å; T512-E515 WeakPolarHBondContact OG1-CB 3.26Å; T512-E515 VanDerWaalsContact OG1-CG 3.28Å; T512-E515 WeakPolarHBondContact OG1-CG 3.33Å; T512-E515 PolarHBondContact OG1-N 2.94Å; T512-E515 PolarHBondContact OG1-OE2 3.36Å; E515-R518 PolarHBondContact O-N 3.32Å; E515-A519 WeakPolarHBondContact O-CB 3.31Å; E515-A519 PolarHBondContact O-N 2.85Å
516	L	98.4	Very high	93	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-46.5	175.1	-71.3	169.3	0	0	0	112	C375 V449 F452 V498 P511 T512 F513 R518 A519 L520	C375-L516 VanDerWaalsContact SG-CB 3.56Å; V449-L516 HydrophobicContact CG1-CD1 4.04Å; V449-L516 HydrophobicContact CG2-CD1 4.29Å; F452-L516 HydrophobicContact CD1-CD1 3.89Å; F452-L516 HydrophobicContact CE1-CD1 4.15Å; V498-L516 HydrophobicContact CG1-CD2 3.52Å; P511-L516 HydrophobicContact CB-CD2 4.33Å; P511-L516 HydrophobicContact CB-CG 4.13Å; P511-L516 HydrophobicContact CG-CD1 4.18Å; P511-L516 HydrophobicContact CG-CD2 3.54Å; P511-L516 HydrophobicContact CG-CG 3.7Å; T512-L516 WeakPolarHBondContact O-CG 3.48Å; T512-L516 PolarHBondContact O-N 2.91Å; F513-L516 HydrophobicContact CD1-CD1 3.98Å; F513-L516 HydrophobicContact CE1-CD1 4.28Å; F513-L516 PolarHBondContact O-N 3.43Å; L516-R518 VanDerWaalsContact C-N 3.3Å; L516-R518 PolarHBondContact O-N 3.15Å; L516-A519 PolarHBondContact O-N 2.89Å; L516-L520 WeakPolarHBondContact O-CB 3.33Å; L516-L520 VanDerWaalsContact O-CG 3.28Å; L516-L520 WeakPolarHBondContact O-CG 3.47Å; L516-L520 PolarHBondContact O-N 3.13Å
517	L	95.3	Very high	91.4	Very high	36 Å²	36	50.4 Å²	50.4	19%	0.188	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-40	-179.7	-178.4	61.6	0	0	0	111.1	C375 E376 E379 F513 T521	C375-L517 HydrophobicContact CB-CD1 4.16Å; C375-L517 PolarHBondContact SG-N 3.49Å; C375-L517 VanDerWaalsContact SG-N 3.37Å; E376-L517 HydrophobicContact CB-CD1 4.1Å; E376-L517 HydrophobicContact CB-CD2 4.21Å; E376-L517 HydrophobicContact CG-CD2 4.26Å; E379-L517 HydrophobicContact CB-CD2 4.49Å; F513-L517 VanDerWaalsContact O-CB 3.24Å; F513-L517 WeakPolarHBondContact O-CB 3.36Å; F513-L517 PolarHBondContact O-N 2.95Å; L517-T521 VanDerWaalsContact O-CB 3.27Å; L517-T521 WeakPolarHBondContact O-CB 3.38Å; L517-T521 PolarHBondContact O-N 3.02Å; L517-T521 PolarHBondContact O-OG1 3.45Å
518	R	92.8	Very high	91.1	Very high	141 Å²	141	51.1 Å²	51.1	53%	0.532	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-51.2	172.6	-177.6	178	63.1	76.7	1	111.2	A514 E515 L516 L520 T521 E522	A514-R518 PolarHBondContact O-N 3.24Å; A514-R518 VanDerWaalsContact O-N 3.14Å; E515-R518 PolarHBondContact O-N 3.32Å; L516-R518 VanDerWaalsContact C-N 3.3Å; L516-R518 PolarHBondContact O-N 3.15Å; R518-L520 PolarHBondContact O-N 3.35Å; R518-T521 PolarHBondContact O-N 2.86Å; R518-T521 VanDerWaalsContact O-N 3.17Å; R518-E522 WeakPolarHBondContact CD-OE1 3.47Å; R518-E522 HydrophobicContact CG-CG 4.46Å; R518-E522 WeakPolarHBondContact CG-OE1 3.35Å; R518-E522 IonicContact CZ-OE1 3.33Å; R518-E522 IonicContact NE-OE1 3.69Å; R518-E522 VanDerWaalsContact NH1-CD 3.33Å; R518-E522 IonicContact NH1-OE1 2.64Å; R518-E522 PolarHBondContact NH1-OE1 3.26Å; R518-E522 IonicContact NH1-OE2 2.69Å; R518-E522 PolarHBondContact NH1-OE2 3.39Å; R518-E522 WeakPolarHBondContact O-CG 3.5Å; R518-E522 PolarHBondContact O-N 3.11Å
519	A	95.6	Very high	90.8	Very high	26 Å²	26	43.1 Å²	43.1	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-43.7	-179.3	0	0	0	0	0	112.7	V498 E515 L516 T521 E522 I523	V498-A519 HydrophobicContact CG2-CB 4.2Å; E515-A519 WeakPolarHBondContact O-CB 3.31Å; E515-A519 PolarHBondContact O-N 2.85Å; L516-A519 PolarHBondContact O-N 2.89Å; A519-T521 VanDerWaalsContact C-N 3.3Å; A519-T521 PolarHBondContact O-N 3.38Å; A519-E522 PolarHBondContact O-N 3.36Å; A519-I523 VanDerWaalsContact O-CG1 3.3Å; A519-I523 WeakPolarHBondContact O-CG1 3.44Å; A519-I523 PolarHBondContact O-N 3.23Å
520	L	93.9	Very high	90.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-35.7	176.5	-66.8	170.3	0	0	0	112.1	L368 C371 Q372 C375 F452 M456 I495 V498 L516 R518 A524	L368-L520 HydrophobicContact CD1-CB 4.19Å; L368-L520 HydrophobicContact CD1-CD2 3.66Å; L368-L520 HydrophobicContact CD1-CG 4.47Å; C371-L520 HydrophobicContact CB-CD1 4.43Å; Q372-L520 HydrophobicContact CG-CB 3.88Å; C375-L520 HydrophobicContact CB-CD1 3.94Å; F452-L520 HydrophobicContact CE1-CD1 4.17Å; F452-L520 HydrophobicContact CZ-CD1 3.88Å; M456-L520 HydrophobicContact CE-CD2 3.81Å; I495-L520 HydrophobicContact CD1-CD2 4.13Å; V498-L520 HydrophobicContact CG1-CD2 4.14Å; V498-L520 HydrophobicContact CG1-CG 4.47Å; L516-L520 WeakPolarHBondContact O-CB 3.33Å; L516-L520 VanDerWaalsContact O-CG 3.28Å; L516-L520 WeakPolarHBondContact O-CG 3.47Å; L516-L520 PolarHBondContact O-N 3.13Å; R518-L520 PolarHBondContact O-N 3.35Å; L520-A524 VanDerWaalsContact O-CB 3.28Å; L520-A524 WeakPolarHBondContact O-CB 3.34Å; L520-A524 PolarHBondContact O-N 2.97Å
521	T	87.7	Confident	90	Very high	48 Å²	48	45.5 Å²	45.5	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-74.4	-36.7	177.6	-58.3	0	0	0	0	112.4	Q372 L517 R518 A519 A524 E525	Q372-T521 PolarHBondContact NE2-OG1 2.86Å; L517-T521 VanDerWaalsContact O-CB 3.27Å; L517-T521 WeakPolarHBondContact O-CB 3.38Å; L517-T521 PolarHBondContact O-N 3.02Å; L517-T521 PolarHBondContact O-OG1 3.45Å; R518-T521 PolarHBondContact O-N 2.86Å; R518-T521 VanDerWaalsContact O-N 3.17Å; A519-T521 VanDerWaalsContact C-N 3.3Å; A519-T521 PolarHBondContact O-N 3.38Å; T521-A524 PolarHBondContact O-N 3.39Å; T521-E525 PolarHBondContact O-N 3.08Å; T521-E525 VanDerWaalsContact O-N 3.17Å
522	E	87.9	Confident	89.4	Confident	73 Å²	73	46.9 Å²	46.9	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-46.5	170.5	-75.5	169	-167.3	0	0	111.1	R179 R518 A519 E525 T526	R179-E522 HydrophobicContact CG-CG 4.13Å; R518-E522 WeakPolarHBondContact CD-OE1 3.47Å; R518-E522 HydrophobicContact CG-CG 4.46Å; R518-E522 WeakPolarHBondContact CG-OE1 3.35Å; R518-E522 IonicContact CZ-OE1 3.33Å; R518-E522 IonicContact NE-OE1 3.69Å; R518-E522 VanDerWaalsContact NH1-CD 3.33Å; R518-E522 IonicContact NH1-OE1 2.64Å; R518-E522 PolarHBondContact NH1-OE1 3.26Å; R518-E522 IonicContact NH1-OE2 2.69Å; R518-E522 PolarHBondContact NH1-OE2 3.39Å; R518-E522 WeakPolarHBondContact O-CG 3.5Å; R518-E522 PolarHBondContact O-N 3.11Å; A519-E522 PolarHBondContact O-N 3.36Å; E522-E525 PolarHBondContact O-N 3.18Å; E522-T526 PolarHBondContact O-N 3.08Å
523	I	89.8	Confident	88.8	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.097	24%	0.241	C	C	.	.	H	α-helix	trans	-62.1	-44.4	175.1	-65.1	165.1	0	0	0	110.9	L368 I495 V498 A519 E525 T526 W527	L368-I523 HydrophobicContact CD2-CG2 4.16Å; I495-I523 HydrophobicContact CD1-CB 4.47Å; I495-I523 HydrophobicContact CD1-CD1 3.99Å; I495-I523 HydrophobicContact CD1-CG2 3.81Å; I495-I523 HydrophobicContact CG1-CG2 4.22Å; V498-I523 HydrophobicContact CG2-CD1 3.96Å; A519-I523 VanDerWaalsContact O-CG1 3.3Å; A519-I523 WeakPolarHBondContact O-CG1 3.44Å; A519-I523 PolarHBondContact O-N 3.23Å; I523-E525 VanDerWaalsContact C-N 3.27Å; I523-E525 PolarHBondContact O-N 2.91Å; I523-T526 PolarHBondContact O-N 3.4Å; I523-T526 PolarHBondContact O-OG1 3Å; I523-W527 PolarHBondContact O-N 3.17Å
524	A	84.1	Confident	88.1	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-25.4	-178.7	0	0	0	0	0	114.4	L368 L520 T521	L368-A524 HydrophobicContact CD2-CB 3.72Å; L368-A524 HydrophobicContact CG-CB 4.39Å; L520-A524 VanDerWaalsContact O-CB 3.28Å; L520-A524 WeakPolarHBondContact O-CB 3.34Å; L520-A524 PolarHBondContact O-N 2.97Å; T521-A524 PolarHBondContact O-N 3.39Å
525	E	75.7	Confident	87.4	Confident	23 Å²	23	50.9 Å²	50.9	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-79.9	-23.5	171.3	-72.4	-137.2	144.6	0	0	113.5	R157 R176 R179 T521 E522 I523	R157-E525 PolarHBondContact NH1-O 2.77Å; R176-E525 IonicContact CZ-OE1 2.67Å; R176-E525 IonicContact NH1-OE1 3.42Å; R176-E525 PolarHBondContact NH1-OE1 2.67Å; R176-E525 IonicContact NH2-OE1 3.95Å; R176-E525 PolarHBondContact NH2-OE1 3.4Å; R176-E525 VanDerWaalsContact NH2-OE1 3.11Å; R179-E525 HydrophobicContact CG-CG 4.24Å; R179-E525 IonicContact CZ-OE2 3.71Å; R179-E525 VanDerWaalsContact CZ-OE2 3.23Å; R179-E525 IonicContact NE-OE2 3.82Å; R179-E525 PolarHBondContact NE-OE2 3.1Å; R179-E525 IonicContact NH2-OE2 2.89Å; R179-E525 PolarHBondContact NH2-OE2 2.82Å; T521-E525 PolarHBondContact O-N 3.08Å; T521-E525 VanDerWaalsContact O-N 3.17Å; E522-E525 PolarHBondContact O-N 3.18Å; I523-E525 VanDerWaalsContact C-N 3.27Å; I523-E525 PolarHBondContact O-N 2.91Å
526	T	74.7	Confident	86.6	Confident	99 Å²	99	47.3 Å²	47.3	61%	0.607	23%	0.232	S	C	*	.	H	α-helix	trans	-89	-6.8	-178.7	60.8	0	0	0	0	115.4	E522 I523	E522-T526 PolarHBondContact O-N 3.08Å; I523-T526 PolarHBondContact O-N 3.4Å; I523-T526 PolarHBondContact O-OG1 3Å
527	W	62.8	Low	85.5	Confident	96 Å²	96	51.2 Å²	51.2	36%	0.364	25%	0.251	S	S	.	.			trans	-78.4	0	175.8	-102.2	-1.6	0	0	0	114.1	R157 K364 E365 L368 F460 P492 I495 I523	R157-W527 PolarHBondContact NH1-O 2.92Å; R157-W527 PolarHBondContact NH2-O 3.36Å; R157-W527 VanDerWaalsContact NH2-O 3.12Å; K364-W527 VanDerWaalsContact C-CH2 3.5Å; K364-W527 HydrophobicContact CB-CH2 3.57Å; K364-W527 HydrophobicContact CB-CZ2 3.91Å; K364-W527 HydrophobicContact CB-CZ3 4.07Å; K364-W527 VanDerWaalsContact O-CH2 3.29Å; K364-W527 WeakPolarHBondContact O-CH2 3.46Å; K364-W527 WeakPolarHBondContact O-CZ3 3.44Å; E365-W527 HydrophobicContact CG-CE3 4.44Å; L368-W527 HydrophobicContact CB-CE3 4.17Å; L368-W527 HydrophobicContact CB-CH2 3.84Å; L368-W527 HydrophobicContact CB-CZ3 3.3Å; L368-W527 HydrophobicContact CD2-CD2 4.34Å; L368-W527 HydrophobicContact CD2-CE3 3.64Å; L368-W527 HydrophobicContact CD2-CH2 4.19Å; L368-W527 HydrophobicContact CD2-CZ3 3.55Å; L368-W527 HydrophobicContact CG-CZ3 4.08Å; F460-W527 HydrophobicContact CE1-CH2 4.12Å; F460-W527 HydrophobicContact CZ-CH2 4.14Å; P492-W527 HydrophobicContact CG-CZ2 3.54Å; I495-W527 HydrophobicContact CG1-CZ2 4.49Å; I523-W527 PolarHBondContact O-N 3.17Å

Retrieved 527 of 527 residues in 263.8 ms (Link to these results)

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