A0A096N4J2_PAPAN Loading...

BMP-binding endothelial regulator protein

Inhibitor of bone morphogenetic protein (BMP) function, it may regulate BMP responsiveness of osteoblasts and chondrocytes.

AlphaFold DB , UniProt , Accession A0A096N4J2, Species PAPAN (Papio anubis, Olive baboon), Gene BMPER, Length 685 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	27.7	Very low	245 Å²	245	141.8 Å²	141.8	100%	1.207	84%	0.839	S	S	*	*				0	143.5	0	-98.5	-176.6	-174	0	0	108.5
2	L	25.8	Very low	27.5	Very low	178 Å²	178	144 Å²	144	93%	0.932	83%	0.834	S	S	*	*			trans	95.3	107.5	179.2	-62.3	165.8	0	0	0	117.2
3	W	26.5	Very low	27.5	Very low	216 Å²	216	151.8 Å²	151.8	82%	0.818	84%	0.841	S	S	*	*			trans	-64.6	165.4	172.7	-74.5	20.4	0	0	0	112.5
4	F	28.1	Very low	27.5	Very low	171 Å²	171	156.3 Å²	156.3	75%	0.75	84%	0.841	S	S	*	*				-164.7	130.6	59.6	-93.7	-97.2	0	0	0	108.9
5	S	27.8	Very low	27.2	Very low	101 Å²	101	150.3 Å²	150.3	71%	0.706	83%	0.831	S	S	*	*				81.5	118	102.6	-58.9	0	0	0	0	116.2
6	G	29.4	Very low	27.2	Very low	78 Å²	78	156.1 Å²	156.1	80%	0.804	84%	0.836	S	S	*	*			trans	-79.1	166.4	179.3	0	0	0	0	0	114.2
7	V	28.6	Very low	27.2	Very low	147 Å²	147	161.2 Å²	161.2	89%	0.891	84%	0.841	S	S	*	*			trans	-138.8	120.4	166.4	-177.9	0	0	0	0	108.3
8	G	24.9	Very low	27.2	Very low	68 Å²	68	158.4 Å²	158.4	70%	0.701	84%	0.837	S	S	*	*			trans	-82.8	167.3	171.3	0	0	0	0	0	112.6
9	A	27.3	Very low	27.9	Very low	95 Å²	95	156.7 Å²	156.7	79%	0.785	84%	0.836	S	S	*	*			trans	-51	153.4	-179.5	0	0	0	0	0	115.1
10	L	25	Very low	27.9	Very low	174 Å²	174	152.3 Å²	152.3	91%	0.911	83%	0.83	S	S	*	*				-170.1	144.9	125.2	-102.5	153.6	0	0	0	112.2
11	A	29	Very low	28	Very low	87 Å²	87	152.5 Å²	152.5	72%	0.719	83%	0.829	S	S	*	*			trans	-70.9	149.5	173.4	0	0	0	0	0	111.7
12	E	25.1	Very low	27.8	Very low	168 Å²	168	146.7 Å²	146.7	79%	0.785	81%	0.807	S	S	*	*			trans	-140	127.1	162.3	-105.7	-178.7	176	0	0	113.8
13	R	27	Very low	27.8	Very low	245 Å²	245	143.5 Å²	143.5	93%	0.925	80%	0.798	S	S	*	*			trans	-62.7	142.5	156.4	-73.6	175.4	176.9	-168.7	-1.7	108.7
14	Y	27.2	Very low	27.9	Very low	215 Å²	215	139.7 Å²	139.7	84%	0.843	80%	0.803	S	S	*	*			trans	-110.1	121.6	164.5	-105.1	-90.1	0	0	0	112.4
15	G	24.3	Very low	28.1	Very low	67 Å²	67	136.6 Å²	136.6	69%	0.691	80%	0.798	S	S	*	*			trans	-105.6	138.3	159	0	0	0	0	0	110.2
16	R	26.8	Very low	28.2	Very low	242 Å²	242	139.7 Å²	139.7	91%	0.913	81%	0.806	S	S	*	*			trans	-18.1	141.8	168.4	-70.7	172.2	166.1	-178.9	-5.3	118.2
17	R	26.7	Very low	28.2	Very low	243 Å²	243	142.2 Å²	142.2	92%	0.917	80%	0.8	S	S	*	*				178.6	135.2	97.4	-96.8	179	179.7	-177.5	-0.1	112.3
18	S	27.7	Very low	28.3	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	79%	0.792	S	S	*	*			trans	-73.1	175.6	159.6	-38.1	0	0	0	0	110.5
19	P	41.1	Very low	28.7	Very low	126 Å²	126	145.1 Å²	145.1	82%	0.818	79%	0.793	S	S	*	*				-136.3	153.7	57.4	24.6	-0.9	0	0	0	114
20	G	26.9	Very low	28.8	Very low	68 Å²	68	146.9 Å²	146.9	70%	0.701	79%	0.789	S	S	*	*				103.8	138	87.4	0	0	0	0	0	108.1
21	I	30.4	Very low	29.1	Very low	157 Å²	157	143.8 Å²	143.8	81%	0.805	78%	0.781	S	S	*	*			cis	176.6	143.9	47.3	-95.6	161.5	0	0	0	106.5
22	T	28	Very low	29.1	Very low	123 Å²	123	145.5 Å²	145.5	76%	0.755	79%	0.788	S	S	*	*			trans	37.5	120.1	158.9	48.7	0	0	0	0	121.7
23	C	26.7	Very low	29.4	Very low	111 Å²	111	141 Å²	141	75%	0.75	79%	0.786	S	S	*	*				79.6	106.5	75.1	-158.3	0	0	0	0	113.5
24	C	27.9	Very low	29.6	Very low	137 Å²	137	136.3 Å²	136.3	93%	0.926	79%	0.785	S	S	*	*			trans	-156.9	138.5	144.1	-111.6	0	0	0	0	110.9
25	V	31.8	Very low	29.9	Very low	105 Å²	105	131.4 Å²	131.4	64%	0.636	78%	0.779	S	S	*	*			trans	-83.2	150.9	-171.2	168.2	0	0	0	0	111.5	L27	V25-L27 HydrophobicContact CG1-CD1 4.26Å
26	L	30.4	Very low	30.7	Very low	166 Å²	166	137.8 Å²	137.8	87%	0.869	79%	0.794	S	S	*	*			trans	175.1	90.7	139.1	-92.4	150.5	0	0	0	108.5
27	L	30.3	Very low	30.9	Very low	132 Å²	132	131 Å²	131	69%	0.691	78%	0.783	S	S	*	*				51.1	103.5	86.5	-99.9	164.5	0	0	0	114.9	V25	V25-L27 HydrophobicContact CG1-CD1 4.26Å
28	L	30.6	Very low	31.3	Very low	136 Å²	136	126.7 Å²	126.7	71%	0.712	78%	0.777	S	S	*	*				161.3	126.1	107.2	-79.6	164.6	0	0	0	112.5
29	L	33.4	Very low	31.4	Very low	139 Å²	139	126.7 Å²	126.7	73%	0.728	78%	0.784	S	S	*	*			trans	49	139.6	135.3	-61.7	161.7	0	0	0	118.8
30	N	29.1	Very low	31.1	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	77%	0.77	S	S	*	*			cis	-168.8	156.2	27.4	-128.6	-21.5	0	0	0	111.5
31	C	30.1	Very low	31.7	Very low	109 Å²	109	126.5 Å²	126.5	74%	0.736	78%	0.775	S	S	*	*			trans	-26	139.1	174.8	-56.8	0	0	0	0	120
32	S	29.3	Very low	32	Very low	124 Å²	124	127.6 Å²	127.6	87%	0.867	77%	0.774	S	S	*	*				169.2	128.7	98.8	43.2	0	0	0	0	113.6
33	G	30.8	Very low	32.6	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	78%	0.782	S	S	*	*			trans	83.6	132.1	143.3	0	0	0	0	0	120.6
34	V	32.2	Very low	33.4	Very low	148 Å²	148	131.7 Å²	131.7	90%	0.897	79%	0.788	S	S	*	*			trans	106.2	135	153.4	-171.3	0	0	0	0	116
35	P	33.7	Very low	34.7	Very low	112 Å²	112	128.7 Å²	128.7	73%	0.727	78%	0.781	S	S	*	*			trans	-95.2	165.6	-147	37.2	-32.6	0	0	0	114.9	S37	P35-S37 PolarHBondContact O-N 3.2Å
36	M	40.2	Very low	36.1	Very low	201 Å²	201	129.5 Å²	129.5	99%	0.99	79%	0.791	S	S	*	*			trans	-51.3	108.5	174.3	-148.6	176.8	-70.7	0	0	111.6
37	S	32.6	Very low	37.8	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	78%	0.776	S	S	*	*			trans	-127.4	111.1	169.5	164.6	0	0	0	0	109.4	P35	P35-S37 PolarHBondContact O-N 3.2Å
38	L	33.4	Very low	39.8	Very low	152 Å²	152	122.2 Å²	122.2	80%	0.796	77%	0.765	S	S	*	*			trans	40.2	99.5	145.5	-68.3	151.7	0	0	0	116.5	S40	L38-S40 PolarHBondContact O-N 2.04Å
39	A	30.1	Very low	42.1	Very low	111 Å²	111	124.5 Å²	124.5	92%	0.917	77%	0.769	S	S	*	*			trans	-64.9	84	153.3	0	0	0	0	0	109.1	S41	A39-S41 PolarHBondContact O-N 3.31Å
40	S	36.2	Very low	44.3	Very low	74 Å²	74	118.5 Å²	118.5	52%	0.517	74%	0.738	S	S	.	*			trans	-74.8	108.8	156.1	49.7	0	0	0	0	107.1	L38 F42	L38-S40 PolarHBondContact O-N 2.04Å; S40-F42 WeakPolarHBondContact O-CD2 3.35Å; S40-F42 PolarHBondContact O-N 2.87Å
41	S	37.8	Very low	46.6	Very low	116 Å²	116	120.7 Å²	120.7	81%	0.811	74%	0.744	S	S	*	*			trans	-56.2	103.5	162.8	45.7	0	0	0	0	108.5	A39 L43	A39-S41 PolarHBondContact O-N 3.31Å; S41-L43 PolarHBondContact O-N 3.18Å
42	F	37	Very low	49.1	Very low	181 Å²	181	120 Å²	120	79%	0.794	73%	0.733	S	S	*	*			trans	-67	111.2	174.8	-77.3	-86.4	0	0	0	108.9	S40 T44	S40-F42 WeakPolarHBondContact O-CD2 3.35Å; S40-F42 PolarHBondContact O-N 2.87Å; F42-T44 PolarHBondContact O-N 3.12Å
43	L	41.8	Very low	51.7	Low	176 Å²	176	119 Å²	119	92%	0.921	71%	0.714	S	S	*	*			trans	-71.2	115.3	158.6	-76.1	160	0	0	0	106.9	S41	S41-L43 PolarHBondContact O-N 3.18Å
44	T	42.1	Very low	54.1	Low	143 Å²	143	117.8 Å²	117.8	88%	0.877	70%	0.703	S	S	*	*			trans	-84.7	124	171.9	32.7	0	0	0	0	109.9	F42	F42-T44 PolarHBondContact O-N 3.12Å
45	G	56.1	Low	56.6	Low	74 Å²	74	114.8 Å²	114.8	76%	0.763	68%	0.679	S	S	*	*			trans	-171.6	154.7	175.8	0	0	0	0	0	111.5
46	S	61.2	Low	58.8	Low	122 Å²	122	114.1 Å²	114.1	85%	0.853	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-81.9	141.9	174.4	43.7	0	0	0	0	111.2	A48	S46-A48 PolarHBondContact O-N 3.05Å
47	V	65.2	Low	60.8	Low	91 Å²	91	106.1 Å²	106.1	55%	0.552	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-70.7	121.6	177.5	-175.3	0	0	0	0	109.3	E76	V47-E76 HydrophobicContact CG1-CB 3.78Å; V47-E76 HydrophobicContact CG1-CG 3.8Å
48	A	72.1	Confident	63	Low	55 Å²	55	108.5 Å²	108.5	46%	0.455	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-71.1	137.4	175.7	0	0	0	0	0	110	S46 V77	S46-A48 PolarHBondContact O-N 3.05Å; A48-V77 HydrophobicContact CB-CB 4.05Å; A48-V77 HydrophobicContact CB-CG2 3.77Å; A48-V77 WeakPolarHBondContact O-CG2 3.1Å; A48-V77 PolarHBondContact O-N 3.17Å
49	K	79.1	Confident	65.2	Low	184 Å²	184	103.4 Å²	103.4	80%	0.8	60%	0.602	S	S	*	*	B	Isolated β-bridge	trans	-96	148.8	178	-65.7	-174.1	177.5	-176.8	0	110.9	K75	K49-K75 WeakPolarHBondContact CA-O 3.06Å
50	C	80.1	Confident	67.3	Low	13 Å²	13	102.4 Å²	102.4	9%	0.088	59%	0.587	C	S	.	*			trans	-136.8	154	-179.9	51	0	0	0	0	111	L57 C72 K75 E76 V77	C50-L57 HydrophobicContact CB-CD1 3.77Å; C50-C72 HydrophobicContact CB-CB 3.72Å; C50-C72 WeakPolarHBondContact CB-SG 3.06Å; C50-C72 WeakPolarHBondContact SG-CA 3.29Å; C50-C72 WeakPolarHBondContact SG-CB 3.23Å; C50-C72 CovalentContact SG-SG 2.01Å; C50-C72 PolarHBondContact SG-SG 2.82Å; C50-K75 PolarHBondContact N-O 2.83Å; C50-E76 PolarHBondContact SG-N 3.37Å; C50-V77 HydrophobicContact CB-CG2 3.98Å
51	E	77.9	Confident	69.1	Low	178 Å²	178	107.8 Å²	107.8	83%	0.832	60%	0.601	S	S	*	*	S	Bend	trans	-94.6	-39.6	-169.6	-64.2	-175.3	166.7	0	0	113.1
52	N	81.9	Confident	70.8	Confident	94 Å²	94	105.8 Å²	105.8	50%	0.503	58%	0.58	S	S	.	*	S	Bend	trans	-105.6	115.6	-175.7	-54.6	-49.2	0	0	0	111.4	G54 E55 C72	N52-G54 PolarHBondContact O-N 3.02Å; N52-E55 HydrophobicContact CB-CB 4.07Å; N52-E55 WeakPolarHBondContact CB-OE2 3.01Å; N52-E55 PolarHBondContact ND2-OE2 3.32Å; N52-E55 WeakPolarHBondContact O-CB 3.21Å; N52-E55 PolarHBondContact O-N 3.23Å; N52-C72 WeakPolarHBondContact O-CB 3.43Å; N52-C72 PolarHBondContact O-SG 3.02Å
53	E	85	Confident	72.7	Confident	102 Å²	102	98 Å²	98	48%	0.477	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	134.1	174	-73.2	-64.9	156.6	0	0	111.9	E55 L73 N74 K75	E53-E55 VanDerWaalsContact C-N 3.29Å; E53-E55 PolarHBondContact O-N 3.06Å; E53-L73 WeakPolarHBondContact OE2-CA 2.98Å; E53-N74 VanDerWaalsContact CD-N 3.3Å; E53-N74 WeakPolarHBondContact OE1-CA 3.28Å; E53-N74 PolarHBondContact OE1-N 3.22Å; E53-N74 PolarHBondContact OE2-N 3.1Å; E53-K75 PolarHBondContact OE1-N 2.83Å
54	G	79.7	Confident	74.4	Confident	48 Å²	48	95 Å²	95	50%	0.495	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-2.9	178.8	0	0	0	0	0	115.5	N52 C72	N52-G54 PolarHBondContact O-N 3.02Å; G54-C72 PolarHBondContact N-O 3.11Å
55	E	84.8	Confident	76.2	Confident	84 Å²	84	91 Å²	91	39%	0.393	51%	0.506	S	S	.	.			trans	-67.8	133.8	176.9	-174.2	177.8	172.5	0	0	111.5	N52 E53 L57 V71 C72	N52-E55 HydrophobicContact CB-CB 4.07Å; N52-E55 WeakPolarHBondContact CB-OE2 3.01Å; N52-E55 PolarHBondContact ND2-OE2 3.32Å; N52-E55 WeakPolarHBondContact O-CB 3.21Å; N52-E55 PolarHBondContact O-N 3.23Å; E53-E55 VanDerWaalsContact C-N 3.29Å; E53-E55 PolarHBondContact O-N 3.06Å; E55-L57 HydrophobicContact CG-CD2 4.35Å; E55-V71 WeakPolarHBondContact O-CA 3.41Å; E55-C72 PolarHBondContact O-N 3.41Å
56	I	81.4	Confident	77.4	Confident	98 Å²	98	90.3 Å²	90.3	50%	0.503	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	115.3	172	-57.8	174.7	0	0	0	108.2	M69 C70 V71	I56-M69 HydrophobicContact CG2-CG 4.39Å; I56-C70 WeakPolarHBondContact CA-O 3.5Å; I56-V71 HydrophobicContact CG1-CG2 4.31Å
57	L	81.1	Confident	78.5	Confident	34 Å²	34	85.3 Å²	85.3	18%	0.178	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.5	-174.8	-65	163.5	0	0	0	110.7	C50 E55 I59 T63 C70 C72 V77	C50-L57 HydrophobicContact CB-CD1 3.77Å; E55-L57 HydrophobicContact CG-CD2 4.35Å; L57-I59 HydrophobicContact CB-CG1 4.38Å; L57-T63 WeakPolarHBondContact O-CG2 3.39Å; L57-C70 PolarHBondContact N-O 3.09Å; L57-C72 HydrophobicContact CD1-CB 4.3Å; L57-V77 HydrophobicContact CD1-CB 4.24Å; L57-V77 HydrophobicContact CD1-CG1 3.99Å; L57-V77 HydrophobicContact CD1-CG2 3.45Å; L57-V77 VanDerWaalsContact CD1-CG2 3.45Å
58	Q	79.9	Confident	79.5	Confident	149 Å²	149	82.9 Å²	82.9	70%	0.696	44%	0.436	S	S	*	.			trans	-90.6	111	171.2	-65.8	-61.2	-32	0	0	109.3	T63	Q58-T63 WeakPolarHBondContact CA-OG1 3.47Å; Q58-T63 PolarHBondContact OE1-OG1 3.24Å
59	I	78.3	Confident	79.9	Confident	44 Å²	44	85.8 Å²	85.8	23%	0.226	44%	0.442	C	S	.	.			trans	-113.4	113.4	-177.9	-51.3	172.3	0	0	0	107.9	L57 F61 I62 T63 C70 V77	L57-I59 HydrophobicContact CB-CG1 4.38Å; I59-F61 PolarHBondContact O-N 2.83Å; I59-I62 HydrophobicContact CB-CB 4.18Å; I59-I62 HydrophobicContact CG2-CB 4.22Å; I59-I62 HydrophobicContact CG2-CD1 3.92Å; I59-I62 HydrophobicContact CG2-CG1 4.19Å; I59-I62 PolarHBondContact O-N 2.83Å; I59-I62 VanDerWaalsContact O-N 3.08Å; I59-T63 HydrophobicContact CB-CG2 4.4Å; I59-T63 PolarHBondContact N-OG1 3.03Å; I59-T63 PolarHBondContact O-N 2.97Å; I59-T63 PolarHBondContact O-OG1 3.06Å; I59-C70 HydrophobicContact CD1-CB 3.92Å; I59-V77 HydrophobicContact CD1-CG1 3.56Å
60	P	75.4	Confident	80.3	Confident	90 Å²	90	77 Å²	77	58%	0.584	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	140.3	178.9	-26.6	34	0	0	0	111.5	I62	P60-I62 PolarHBondContact O-N 2.86Å; P60-I62 VanDerWaalsContact O-N 3.07Å
61	F	72.6	Confident	80.7	Confident	187 Å²	187	78.1 Å²	78.1	82%	0.82	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	-14.6	-177.8	-44.6	-76.5	0	0	0	116.5	I59 D64	I59-F61 PolarHBondContact O-N 2.83Å; F61-D64 WeakPolarHBondContact CA-OD2 3.34Å; F61-D64 PolarHBondContact N-OD2 2.94Å
62	I	74.3	Confident	81	Confident	74 Å²	74	69.6 Å²	69.6	38%	0.379	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-55.5	178.3	-58.7	-176.2	0	0	0	110.5	I59 P60 D64 N65 I68	I59-I62 HydrophobicContact CB-CB 4.18Å; I59-I62 HydrophobicContact CG2-CB 4.22Å; I59-I62 HydrophobicContact CG2-CD1 3.92Å; I59-I62 HydrophobicContact CG2-CG1 4.19Å; I59-I62 PolarHBondContact O-N 2.83Å; I59-I62 VanDerWaalsContact O-N 3.08Å; P60-I62 PolarHBondContact O-N 2.86Å; P60-I62 VanDerWaalsContact O-N 3.07Å; I62-D64 PolarHBondContact O-N 3.45Å; I62-N65 PolarHBondContact O-N 3.23Å; I62-I68 HydrophobicContact CG2-CG2 3.82Å
63	T	76.9	Confident	81.1	Confident	19 Å²	19	68.4 Å²	68.4	12%	0.117	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.3	178.1	61.9	0	0	0	0	113.2	L57 Q58 I59 N65 C70	L57-T63 WeakPolarHBondContact O-CG2 3.39Å; Q58-T63 WeakPolarHBondContact CA-OG1 3.47Å; Q58-T63 PolarHBondContact OE1-OG1 3.24Å; I59-T63 HydrophobicContact CB-CG2 4.4Å; I59-T63 PolarHBondContact N-OG1 3.03Å; I59-T63 PolarHBondContact O-N 2.97Å; I59-T63 PolarHBondContact O-OG1 3.06Å; T63-N65 PolarHBondContact O-N 3.01Å; T63-C70 HydrophobicContact CG2-CB 4.16Å
64	D	77.9	Confident	81.1	Confident	111 Å²	111	70.2 Å²	70.2	59%	0.594	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.6	164.9	-65.2	-18.3	0	0	0	111.5	F61 I62 P66	F61-D64 WeakPolarHBondContact CA-OD2 3.34Å; F61-D64 PolarHBondContact N-OD2 2.94Å; I62-D64 PolarHBondContact O-N 3.45Å; D64-P66 WeakPolarHBondContact O-CD 3.34Å
65	N	79.5	Confident	81.2	Confident	60 Å²	60	74.6 Å²	74.6	32%	0.321	38%	0.382	S	S	.	.	S	Bend	trans	-84.7	114.3	167.9	-172.1	-26.9	0	0	0	109.7	I62 T63 C67 I68	I62-N65 PolarHBondContact O-N 3.23Å; T63-N65 PolarHBondContact O-N 3.01Å; N65-C67 PolarHBondContact O-N 3.35Å; N65-C67 VanDerWaalsContact OD1-CB 3.32Å; N65-C67 WeakPolarHBondContact OD1-CB 3.41Å; N65-C67 PolarHBondContact OD1-N 2.9Å; N65-I68 HydrophobicContact CB-CD1 4.05Å; N65-I68 HydrophobicContact CB-CG1 4.16Å; N65-I68 PolarHBondContact O-N 2.74Å
66	P	80.8	Confident	81.1	Confident	60 Å²	60	75.1 Å²	75.1	39%	0.39	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.6	-177.1	27.8	-36.1	0	0	0	113.9	D64 G99 C101	D64-P66 WeakPolarHBondContact O-CD 3.34Å; P66-G99 WeakPolarHBondContact CB-O 3.15Å; P66-C101 WeakPolarHBondContact O-CB 3.41Å
67	C	85.4	Confident	81.3	Confident	16 Å²	16	71.7 Å²	71.7	11%	0.108	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.5	173.3	-70	0	0	0	0	115	N65 R81 E82 C101	N65-C67 PolarHBondContact O-N 3.35Å; N65-C67 VanDerWaalsContact OD1-CB 3.32Å; N65-C67 WeakPolarHBondContact OD1-CB 3.41Å; N65-C67 PolarHBondContact OD1-N 2.9Å; C67-R81 CarbonylContact O-C 3.57Å; C67-R81 VanDerWaalsContact O-CA 3.31Å; C67-R81 WeakPolarHBondContact O-CA 3.45Å; C67-E82 PolarHBondContact O-N 3.08Å; C67-C101 WeakPolarHBondContact CA-SG 3.48Å; C67-C101 HydrophobicContact CB-CB 3.86Å; C67-C101 WeakPolarHBondContact CB-SG 3.34Å; C67-C101 VanDerWaalsContact SG-C 3.53Å; C67-C101 WeakPolarHBondContact SG-CA 3.26Å; C67-C101 WeakPolarHBondContact SG-CB 3.02Å; C67-C101 PolarHBondContact SG-O 2.75Å; C67-C101 VanDerWaalsContact SG-O 3.33Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 3Å
68	I	84.6	Confident	81.4	Confident	40 Å²	40	72.5 Å²	72.5	21%	0.205	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.6	-178.9	-57.7	178.5	0	0	0	107.7	I62 N65 C79 R81	I62-I68 HydrophobicContact CG2-CG2 3.82Å; N65-I68 HydrophobicContact CB-CD1 4.05Å; N65-I68 HydrophobicContact CB-CG1 4.16Å; N65-I68 PolarHBondContact O-N 2.74Å; I68-C79 HydrophobicContact CG2-CB 4.08Å; I68-R81 HydrophobicContact CG1-CB 4.34Å; I68-R81 HydrophobicContact CG1-CG 4.19Å
69	M	82	Confident	81.5	Confident	117 Å²	117	68 Å²	68	58%	0.576	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.7	-179.5	-145.8	172	50.6	0	0	108.6	I56 C79 K80	I56-M69 HydrophobicContact CG2-CG 4.39Å; M69-C79 WeakPolarHBondContact O-CA 3.47Å; M69-K80 PolarHBondContact N-O 2.03Å; M69-K80 PolarHBondContact O-N 2.84Å
70	C	86.7	Confident	81.8	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.2	-177.9	-58.2	0	0	0	0	109.6	I56 L57 I59 T63 V77 T78 C79	I56-C70 WeakPolarHBondContact CA-O 3.5Å; L57-C70 PolarHBondContact N-O 3.09Å; I59-C70 HydrophobicContact CD1-CB 3.92Å; T63-C70 HydrophobicContact CG2-CB 4.16Å; C70-V77 HydrophobicContact CB-CG1 4.13Å; C70-T78 WeakPolarHBondContact CA-O 3.31Å; C70-C79 HydrophobicContact CB-CB 4.12Å; C70-C79 WeakPolarHBondContact CB-SG 3.39Å; C70-C79 WeakPolarHBondContact SG-CB 3.46Å; C70-C79 CovalentContact SG-SG 2.04Å; C70-C79 PolarHBondContact SG-SG 2.85Å
71	V	87.8	Confident	82.2	Confident	35 Å²	35	77.4 Å²	77.4	21%	0.212	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.7	-179.2	-178.8	0	0	0	0	108.7	E55 I56 L73 T78	E55-V71 WeakPolarHBondContact O-CA 3.41Å; I56-V71 HydrophobicContact CG1-CG2 4.31Å; V71-L73 HydrophobicContact CG1-CD2 4.4Å; V71-L73 HydrophobicContact CG1-CG 4.39Å; V71-L73 PolarHBondContact O-N 3.43Å; V71-T78 PolarHBondContact N-O 2.05Å; V71-T78 PolarHBondContact O-N 3.49Å
72	C	85.4	Confident	82.9	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	117.7	171	-170.4	0	0	0	0	110.1	C50 N52 G54 E55 L57	C50-C72 HydrophobicContact CB-CB 3.72Å; C50-C72 WeakPolarHBondContact CB-SG 3.06Å; C50-C72 WeakPolarHBondContact SG-CA 3.29Å; C50-C72 WeakPolarHBondContact SG-CB 3.23Å; C50-C72 CovalentContact SG-SG 2.01Å; C50-C72 PolarHBondContact SG-SG 2.82Å; N52-C72 WeakPolarHBondContact O-CB 3.43Å; N52-C72 PolarHBondContact O-SG 3.02Å; G54-C72 PolarHBondContact N-O 3.11Å; E55-C72 PolarHBondContact O-N 3.41Å; L57-C72 HydrophobicContact CD1-CB 4.3Å
73	L	83.4	Confident	83.3	Confident	69 Å²	69	79.6 Å²	79.6	36%	0.361	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.2	176.1	-66.9	175	0	0	0	108.7	E53 V71 K75 E76 T78	E53-L73 WeakPolarHBondContact OE2-CA 2.98Å; V71-L73 HydrophobicContact CG1-CD2 4.4Å; V71-L73 HydrophobicContact CG1-CG 4.39Å; V71-L73 PolarHBondContact O-N 3.43Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 3.22Å; L73-E76 PolarHBondContact N-O 3.26Å; L73-E76 PolarHBondContact O-N 3.35Å; L73-E76 VanDerWaalsContact O-N 3.11Å; L73-T78 HydrophobicContact CD1-CG2 4.14Å
74	N	84.5	Confident	83.6	Confident	140 Å²	140	81.6 Å²	81.6	75%	0.749	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	39.5	-178	-54.4	-42.4	0	0	0	113.4	E53 E76	E53-N74 VanDerWaalsContact CD-N 3.3Å; E53-N74 WeakPolarHBondContact OE1-CA 3.28Å; E53-N74 PolarHBondContact OE1-N 3.22Å; E53-N74 PolarHBondContact OE2-N 3.1Å; N74-E76 PolarHBondContact O-N 3.24Å
75	K	81.5	Confident	83.8	Confident	140 Å²	140	80.8 Å²	80.8	61%	0.609	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	17	-176.6	-55.2	-174.3	176.7	-174	0	113.9	K49 C50 E53 L73	K49-K75 WeakPolarHBondContact CA-O 3.06Å; C50-K75 PolarHBondContact N-O 2.83Å; E53-K75 PolarHBondContact OE1-N 2.83Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 3.22Å
76	E	84.1	Confident	83.8	Confident	94 Å²	94	84.8 Å²	84.8	44%	0.439	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.3	176.7	-68.7	-174.9	171.1	0	0	110.8	V47 C50 L73 N74 T78	V47-E76 HydrophobicContact CG1-CB 3.78Å; V47-E76 HydrophobicContact CG1-CG 3.8Å; C50-E76 PolarHBondContact SG-N 3.37Å; L73-E76 PolarHBondContact N-O 3.26Å; L73-E76 PolarHBondContact O-N 3.35Å; L73-E76 VanDerWaalsContact O-N 3.11Å; N74-E76 PolarHBondContact O-N 3.24Å; E76-T78 PolarHBondContact O-N 3.46Å
77	V	84.9	Confident	83.8	Confident	26 Å²	26	83.5 Å²	83.5	16%	0.158	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	112.5	179.9	-179.7	0	0	0	0	109.6	A48 C50 L57 I59 C70	A48-V77 HydrophobicContact CB-CB 4.05Å; A48-V77 HydrophobicContact CB-CG2 3.77Å; A48-V77 WeakPolarHBondContact O-CG2 3.1Å; A48-V77 PolarHBondContact O-N 3.17Å; C50-V77 HydrophobicContact CB-CG2 3.98Å; L57-V77 HydrophobicContact CD1-CB 4.24Å; L57-V77 HydrophobicContact CD1-CG1 3.99Å; L57-V77 HydrophobicContact CD1-CG2 3.45Å; L57-V77 VanDerWaalsContact CD1-CG2 3.45Å; I59-V77 HydrophobicContact CD1-CG1 3.56Å; C70-V77 HydrophobicContact CB-CG1 4.13Å
78	T	82.7	Confident	83.5	Confident	51 Å²	51	86.1 Å²	86.1	31%	0.313	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.3	177	-60	0	0	0	0	110.5	C70 V71 L73 E76	C70-T78 WeakPolarHBondContact CA-O 3.31Å; V71-T78 PolarHBondContact N-O 2.05Å; V71-T78 PolarHBondContact O-N 3.49Å; L73-T78 HydrophobicContact CD1-CG2 4.14Å; E76-T78 PolarHBondContact O-N 3.46Å
79	C	83.7	Confident	83	Confident	55 Å²	55	96 Å²	96	37%	0.372	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126	175.2	-58.8	0	0	0	0	111.2	I68 M69 C70	I68-C79 HydrophobicContact CG2-CB 4.08Å; M69-C79 WeakPolarHBondContact O-CA 3.47Å; C70-C79 HydrophobicContact CB-CB 4.12Å; C70-C79 WeakPolarHBondContact CB-SG 3.39Å; C70-C79 WeakPolarHBondContact SG-CB 3.46Å; C70-C79 CovalentContact SG-SG 2.04Å; C70-C79 PolarHBondContact SG-SG 2.85Å
80	K	82.9	Confident	82.7	Confident	148 Å²	148	95.3 Å²	95.3	64%	0.643	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	134.7	172.2	-69.9	-176.4	-180	175.9	0	109.6	M69	M69-K80 PolarHBondContact N-O 2.03Å; M69-K80 PolarHBondContact O-N 2.84Å
81	R	85.4	Confident	82.7	Confident	184 Å²	184	95.5 Å²	95.5	69%	0.694	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	119.6	173	-176	174.4	177.8	174.3	0.9	109.8	C67 I68	C67-R81 CarbonylContact O-C 3.57Å; C67-R81 VanDerWaalsContact O-CA 3.31Å; C67-R81 WeakPolarHBondContact O-CA 3.45Å; I68-R81 HydrophobicContact CG1-CB 4.34Å; I68-R81 HydrophobicContact CG1-CG 4.19Å
82	E	86.1	Confident	82.6	Confident	113 Å²	113	94.2 Å²	94.2	53%	0.528	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-66.7	134.7	172.1	-173.8	177	176.1	0	0	110.1	C67 C101	C67-E82 PolarHBondContact O-N 3.08Å; E82-C101 WeakPolarHBondContact OE2-CB 3.26Å
83	K	82.8	Confident	82.8	Confident	194 Å²	194	94.7 Å²	94.7	84%	0.843	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-99.6	119.2	175.3	-70.1	-177	-179.3	178	0	108.6
84	C	82.5	Confident	83	Confident	61 Å²	61	91.4 Å²	91.4	41%	0.412	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-73.5	136.2	-179	-63.1	0	0	0	0	112.7	C102	C84-C102 WeakPolarHBondContact CA-SG 3.21Å; C84-C102 HydrophobicContact CB-CB 3.75Å; C84-C102 WeakPolarHBondContact CB-SG 3.37Å; C84-C102 WeakPolarHBondContact SG-CA 3.17Å; C84-C102 WeakPolarHBondContact SG-CB 2.96Å; C84-C102 CovalentContact SG-SG 2.05Å; C84-C102 PolarHBondContact SG-SG 3.48Å
85	P	82.2	Confident	83.1	Confident	94 Å²	94	86.2 Å²	86.2	61%	0.61	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-64.5	144.3	171.9	27.3	-32.7	0	0	0	110.2	L87	P85-L87 PolarHBondContact O-N 3.06Å
86	V	79.9	Confident	83.2	Confident	144 Å²	144	82.4 Å²	82.4	87%	0.873	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-70.6	119.8	174.3	-179.4	0	0	0	0	108.1
87	L	81.2	Confident	82.9	Confident	33 Å²	33	83.1 Å²	83.1	17%	0.173	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-65.3	141.7	175.2	-71.6	177.9	0	0	0	110.7	P85 A94 E103 C105 Q227	P85-L87 PolarHBondContact O-N 3.06Å; L87-A94 HydrophobicContact CD1-CB 3.63Å; L87-E103 HydrophobicContact CD1-CB 4.07Å; L87-E103 HydrophobicContact CD1-CG 3.57Å; L87-E103 HydrophobicContact CG-CG 4.32Å; L87-C105 HydrophobicContact CD2-CB 4.39Å; L87-Q227 VanDerWaalsContact CD1-NE2 3.33Å
88	S	79	Confident	82.4	Confident	70 Å²	70	92.3 Å²	92.3	49%	0.49	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-55.7	140.2	175.8	179.4	0	0	0	0	110.7	D90 C91	S88-D90 PolarHBondContact O-N 3.44Å; S88-D90 PolarHBondContact OG-N 3.37Å; S88-C91 VanDerWaalsContact O-CB 3.28Å; S88-C91 WeakPolarHBondContact O-CB 3.5Å; S88-C91 PolarHBondContact O-N 2.81Å
89	R	74.2	Confident	81.9	Confident	249 Å²	249	93 Å²	93	94%	0.94	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.2	173.2	-68.4	-174.6	175.9	-172.3	-0.4	112.7	C91	R89-C91 VanDerWaalsContact C-N 3.27Å
90	D	75.3	Confident	81.8	Confident	101 Å²	101	92 Å²	92	54%	0.54	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.1	173.9	-70.8	-72.5	0	0	0	113.2	S88 K223	S88-D90 PolarHBondContact O-N 3.44Å; S88-D90 PolarHBondContact OG-N 3.37Å; D90-K223 IonicContact OD1-NZ 3.12Å; D90-K223 PolarHBondContact OD1-NZ 2.94Å
91	C	86.3	Confident	81.9	Confident	5 Å²	5	85.3 Å²	85.3	3%	0.034	43%	0.431	C	S	.	.			trans	-88.9	107.3	175	-176.3	0	0	0	0	110.9	S88 R89 L93 C105 Q227	S88-C91 VanDerWaalsContact O-CB 3.28Å; S88-C91 WeakPolarHBondContact O-CB 3.5Å; S88-C91 PolarHBondContact O-N 2.81Å; R89-C91 VanDerWaalsContact C-N 3.27Å; C91-L93 PolarHBondContact SG-O 2.8Å; C91-L93 VanDerWaalsContact SG-O 3.35Å; C91-C105 HydrophobicContact CB-CB 3.93Å; C91-C105 WeakPolarHBondContact CB-SG 3.42Å; C91-C105 WeakPolarHBondContact SG-CA 3.05Å; C91-C105 WeakPolarHBondContact SG-CB 3.46Å; C91-C105 CovalentContact SG-SG 2.04Å; C91-C105 PolarHBondContact SG-SG 3.31Å; C91-Q227 WeakPolarHBondContact O-CG 3.38Å
92	A	86.9	Confident	81.9	Confident	7 Å²	7	77.2 Å²	77.2	6%	0.058	40%	0.402	C	S	.	.			trans	-90.3	-17.4	-179.9	0	0	0	0	0	114.3	E135 C224 G226 R228	A92-E135 WeakPolarHBondContact CB-OE1 2.98Å; A92-E135 VanDerWaalsContact CB-OE2 3.3Å; A92-E135 WeakPolarHBondContact CB-OE2 3.42Å; A92-E135 PolarHBondContact N-OE1 3.48Å; A92-C224 HydrophobicContact CB-CB 3.23Å; A92-G226 WeakPolarHBondContact CA-O 3.38Å; A92-G226 WeakPolarHBondContact CB-O 3.27Å; A92-R228 WeakPolarHBondContact O-CB 3.38Å; A92-R228 PolarHBondContact O-N 2.85Å
93	L	88.4	Confident	81.9	Confident	10 Å²	10	74.1 Å²	74.1	5%	0.052	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	106.1	174.1	-172.9	62.2	0	0	0	111.3	C91 K106 E135 R228 V230 L239	C91-L93 PolarHBondContact SG-O 2.8Å; C91-L93 VanDerWaalsContact SG-O 3.35Å; L93-K106 HydrophobicContact CB-CB 4.32Å; L93-K106 HydrophobicContact CD2-CB 3.95Å; L93-K106 HydrophobicContact CD2-CG 3.99Å; L93-K106 HydrophobicContact CG-CB 4.01Å; L93-K106 PolarHBondContact O-N 2.89Å; L93-E135 HydrophobicContact CB-CB 3.98Å; L93-E135 HydrophobicContact CB-CG 4.44Å; L93-E135 WeakPolarHBondContact CD2-O 3.47Å; L93-R228 HydrophobicContact CD1-CB 4.27Å; L93-V230 HydrophobicContact CD1-CG2 3.64Å; L93-L239 HydrophobicContact CD1-CD2 4.21Å
94	A	89	Confident	82.2	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.008	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.9	173	0	0	0	0	0	110.4	L87 Q104 Q227 R228 K229 V230	L87-A94 HydrophobicContact CD1-CB 3.63Å; A94-Q104 WeakPolarHBondContact CA-O 3.41Å; A94-Q227 HydrophobicContact CB-CG 4.26Å; A94-R228 PolarHBondContact N-O 2.03Å; A94-K229 HydrophobicContact CB-CG 4.36Å; A94-K229 WeakPolarHBondContact O-CA 3.43Å; A94-V230 PolarHBondContact O-N 2.82Å
95	V	86.5	Confident	82.5	Confident	30 Å²	30	70.7 Å²	70.7	18%	0.182	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.1	178.7	-71.1	0	0	0	0	110.4	E103 Q104 K106 V230	V95-E103 WeakPolarHBondContact O-CA 3.45Å; V95-Q104 PolarHBondContact N-O 3.26Å; V95-Q104 PolarHBondContact O-N 2.92Å; V95-K106 HydrophobicContact CG1-CB 4.15Å; V95-K106 HydrophobicContact CG1-CD 4.01Å; V95-K106 HydrophobicContact CG1-CG 4.35Å; V95-K106 HydrophobicContact CG2-CB 4.16Å; V95-K106 HydrophobicContact CG2-CD 3.96Å; V95-V230 HydrophobicContact CG1-CB 4.46Å
96	K	84.3	Confident	82.9	Confident	61 Å²	61	68 Å²	68	27%	0.265	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	113.6	172.3	-171.5	178.8	-175.7	172.4	0	109.1	A100 C101 E103 V230 F231	K96-A100 WeakPolarHBondContact CE-O 3.42Å; K96-C101 WeakPolarHBondContact CE-O 3.38Å; K96-C101 PolarHBondContact NZ-O 2.86Å; K96-E103 HydrophobicContact CB-CB 4.34Å; K96-V230 PolarHBondContact N-O 3.4Å; K96-V230 VanDerWaalsContact N-O 3.13Å; K96-F231 HydrophobicContact CB-CD1 3.89Å; K96-F231 HydrophobicContact CB-CE1 3.94Å; K96-F231 HydrophobicContact CD-CD1 4.31Å; K96-F231 HydrophobicContact CD-CE1 3.95Å; K96-F231 HydrophobicContact CG-CD1 4.48Å; K96-F231 HydrophobicContact CG-CE1 4.48Å
97	Q	77.6	Confident	83.5	Confident	108 Å²	108	62.3 Å²	62.3	51%	0.505	32%	0.322	S	S	.	.			trans	-79.4	151.7	177.8	-68.5	-66.1	-11	0	0	111.3	G99 A100	Q97-G99 PolarHBondContact O-N 2.66Å; Q97-A100 HydrophobicContact CB-CB 4.38Å; Q97-A100 WeakPolarHBondContact O-CB 3.4Å; Q97-A100 PolarHBondContact O-N 2.89Å
98	R	74.5	Confident	84.1	Confident	220 Å²	220	60.8 Å²	60.8	83%	0.83	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	126.4	175.8	-153.9	170	176.1	-178.6	-1.1	110.4	A100 D232	R98-A100 VanDerWaalsContact C-N 3.33Å; R98-D232 VanDerWaalsContact CB-OD1 3.29Å; R98-D232 WeakPolarHBondContact CB-OD1 3.44Å; R98-D232 PolarHBondContact N-OD1 3.49Å
99	G	71.6	Confident	84.7	Confident	65 Å²	65	60 Å²	60	67%	0.67	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-7.2	-177.4	0	0	0	0	0	115.4	P66 Q97	P66-G99 WeakPolarHBondContact CB-O 3.15Å; Q97-G99 PolarHBondContact O-N 2.66Å
100	A	81.9	Confident	85.6	Confident	34 Å²	34	49 Å²	49	28%	0.281	27%	0.265	S	S	.	.			trans	-80.6	139.3	173.3	0	0	0	0	0	111.6	K96 Q97 R98	K96-A100 WeakPolarHBondContact CE-O 3.42Å; Q97-A100 HydrophobicContact CB-CB 4.38Å; Q97-A100 WeakPolarHBondContact O-CB 3.4Å; Q97-A100 PolarHBondContact O-N 2.89Å; R98-A100 VanDerWaalsContact C-N 3.33Å
101	C	84.3	Confident	86.2	Confident	8 Å²	8	51.4 Å²	51.4	5%	0.054	27%	0.273	C	S	.	.	S	Bend	trans	-66.4	-55.3	173.1	172.2	0	0	0	0	111.6	P66 C67 E82 K96	P66-C101 WeakPolarHBondContact O-CB 3.41Å; C67-C101 WeakPolarHBondContact CA-SG 3.48Å; C67-C101 HydrophobicContact CB-CB 3.86Å; C67-C101 WeakPolarHBondContact CB-SG 3.34Å; C67-C101 VanDerWaalsContact SG-C 3.53Å; C67-C101 WeakPolarHBondContact SG-CA 3.26Å; C67-C101 WeakPolarHBondContact SG-CB 3.02Å; C67-C101 PolarHBondContact SG-O 2.75Å; C67-C101 VanDerWaalsContact SG-O 3.33Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 3Å; E82-C101 WeakPolarHBondContact OE2-CB 3.26Å; K96-C101 WeakPolarHBondContact CE-O 3.38Å; K96-C101 PolarHBondContact NZ-O 2.86Å
102	C	85.4	Confident	86.1	Confident	14 Å²	14	54.7 Å²	54.7	10%	0.095	31%	0.308	C	S	.	.	S	Bend	trans	-107.3	145.3	-167.3	-59.2	0	0	0	0	113.6	C84	C84-C102 WeakPolarHBondContact CA-SG 3.21Å; C84-C102 HydrophobicContact CB-CB 3.75Å; C84-C102 WeakPolarHBondContact CB-SG 3.37Å; C84-C102 WeakPolarHBondContact SG-CA 3.17Å; C84-C102 WeakPolarHBondContact SG-CB 2.96Å; C84-C102 CovalentContact SG-SG 2.05Å; C84-C102 PolarHBondContact SG-SG 3.48Å
103	E	86.9	Confident	86.3	Confident	48 Å²	48	58.7 Å²	58.7	22%	0.224	33%	0.328	C	S	.	.			trans	-76.3	142.4	168.5	51.3	-176.5	-151.2	0	0	110.4	L87 V95 K96 K229	L87-E103 HydrophobicContact CD1-CB 4.07Å; L87-E103 HydrophobicContact CD1-CG 3.57Å; L87-E103 HydrophobicContact CG-CG 4.32Å; V95-E103 WeakPolarHBondContact O-CA 3.45Å; K96-E103 HydrophobicContact CB-CB 4.34Å; E103-K229 WeakPolarHBondContact OE1-CE 3.48Å; E103-K229 IonicContact OE1-NZ 3.98Å; E103-K229 PolarHBondContact OE1-NZ 3.44Å; E103-K229 WeakPolarHBondContact OE2-CD 3.21Å; E103-K229 VanDerWaalsContact OE2-CE 3.26Å; E103-K229 WeakPolarHBondContact OE2-CE 3.03Å; E103-K229 IonicContact OE2-NZ 3.99Å; E103-K229 PolarHBondContact OE2-NZ 3.33Å
104	Q	88.1	Confident	86.4	Confident	139 Å²	139	64 Å²	64	65%	0.65	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.3	178.2	-65.3	-176.7	0.3	0	0	109.9	A94 V95 K106	A94-Q104 WeakPolarHBondContact CA-O 3.41Å; V95-Q104 PolarHBondContact N-O 3.26Å; V95-Q104 PolarHBondContact O-N 2.92Å; Q104-K106 PolarHBondContact O-N 3.38Å
105	C	89.5	Confident	86.6	Confident	43 Å²	43	65.9 Å²	65.9	29%	0.291	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.4	172	-160.5	0	0	0	0	109.3	L87 C91 G107	L87-C105 HydrophobicContact CD2-CB 4.39Å; C91-C105 HydrophobicContact CB-CB 3.93Å; C91-C105 WeakPolarHBondContact CB-SG 3.42Å; C91-C105 WeakPolarHBondContact SG-CA 3.05Å; C91-C105 WeakPolarHBondContact SG-CB 3.46Å; C91-C105 CovalentContact SG-SG 2.04Å; C91-C105 PolarHBondContact SG-SG 3.31Å; C105-G107 PolarHBondContact O-N 2.02Å; C105-G107 VanDerWaalsContact O-N 3.08Å
106	K	90.8	Very high	86.8	Confident	38 Å²	38	71 Å²	71	17%	0.165	39%	0.394	C	S	.	.			trans	-65.6	113.5	-175.1	-178.2	62.2	178.9	-178.3	0	110.6	L93 V95 Q104 E135 G136 S264	L93-K106 HydrophobicContact CB-CB 4.32Å; L93-K106 HydrophobicContact CD2-CB 3.95Å; L93-K106 HydrophobicContact CD2-CG 3.99Å; L93-K106 HydrophobicContact CG-CB 4.01Å; L93-K106 PolarHBondContact O-N 2.89Å; V95-K106 HydrophobicContact CG1-CB 4.15Å; V95-K106 HydrophobicContact CG1-CD 4.01Å; V95-K106 HydrophobicContact CG1-CG 4.35Å; V95-K106 HydrophobicContact CG2-CB 4.16Å; V95-K106 HydrophobicContact CG2-CD 3.96Å; Q104-K106 PolarHBondContact O-N 3.38Å; K106-E135 CarbonylContact O-C 3.55Å; K106-E135 WeakPolarHBondContact O-CA 3.27Å; K106-G136 PolarHBondContact O-N 2.85Å; K106-S264 VanDerWaalsContact CE-O 3.22Å; K106-S264 WeakPolarHBondContact CE-O 3.16Å; K106-S264 PolarHBondContact NZ-O 3.29Å
107	G	91.1	Very high	87.1	Confident	24 Å²	24	69.5 Å²	69.5	25%	0.247	39%	0.391	C	S	.	.			trans	-83.3	-177.2	168.3	0	0	0	0	0	112.4	C105 Y115 G136	C105-G107 PolarHBondContact O-N 2.02Å; C105-G107 VanDerWaalsContact O-N 3.08Å; G107-Y115 CarbonylContact C-O 3.59Å; G107-Y115 VanDerWaalsContact CA-O 3.27Å; G107-Y115 WeakPolarHBondContact CA-O 3.37Å; G107-G136 WeakPolarHBondContact O-CA 3.49Å
108	C	94.2	Very high	87.7	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.007	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.5	177.7	-51.3	0	0	0	0	110.7	Y115 C133 V138 T265	C108-Y115 PolarHBondContact N-O 3.3Å; C108-Y115 PolarHBondContact O-N 3.17Å; C108-C133 HydrophobicContact CB-CB 3.75Å; C108-C133 WeakPolarHBondContact CB-SG 3.26Å; C108-C133 PolarHBondContact N-SG 2.85Å; C108-C133 WeakPolarHBondContact SG-CA 3.27Å; C108-C133 WeakPolarHBondContact SG-CB 3.46Å; C108-C133 CovalentContact SG-SG 2.04Å; C108-C133 PolarHBondContact SG-SG 2.93Å; C108-V138 HydrophobicContact CB-CG2 3.46Å; C108-V138 VanDerWaalsContact CB-CG2 3.46Å; C108-T265 HydrophobicContact CB-CG2 3.73Å
109	T	92.5	Very high	88.5	Confident	54 Å²	54	62.2 Å²	62.2	33%	0.331	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.3	168.3	-51.8	0	0	0	0	108.4	N113 T265	T109-N113 CarbonylContact C-O 3.57Å; T109-N113 WeakPolarHBondContact CA-O 3.18Å; T109-T265 PolarHBondContact N-OG1 3.29Å; T109-T265 WeakPolarHBondContact O-CB 3.4Å; T109-T265 PolarHBondContact O-OG1 2.87Å
110	Y	92.2	Very high	89.5	Confident	17 Å²	17	63.2 Å²	63.2	7%	0.067	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	125.3	-179.5	-174.7	-88.3	0	0	0	109.6	G112 N113 W121 R131 V138 E140 V267	Y110-G112 PolarHBondContact O-N 2.98Å; Y110-N113 PolarHBondContact N-O 2.93Å; Y110-N113 PolarHBondContact O-N 3.48Å; Y110-W121 HydrophobicContact CD1-CZ2 4.12Å; Y110-W121 HydrophobicContact CG-CZ2 4.15Å; Y110-R131 PolarHBondContact OH-NE 3.45Å; Y110-V138 HydrophobicContact CD2-CB 4.37Å; Y110-V138 HydrophobicContact CD2-CG1 3.92Å; Y110-V138 HydrophobicContact CD2-CG2 4.36Å; Y110-V138 HydrophobicContact CE2-CG1 4.25Å; Y110-E140 PolarHBondContact OH-OE2 2.89Å; Y110-V267 HydrophobicContact CD2-CG1 4.2Å; Y110-V267 HydrophobicContact CD2-CG2 4.02Å; Y110-V267 HydrophobicContact CE2-CG1 3.78Å; Y110-V267 HydrophobicContact CE2-CG2 4.39Å
111	E	87.6	Confident	90.1	Very high	153 Å²	153	63.3 Å²	63.3	72%	0.715	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	41.1	-179	-65.2	-177.2	157.8	0	0	114	N113	E111-N113 VanDerWaalsContact C-N 3.26Å; E111-N113 PolarHBondContact O-N 2.87Å
112	G	85.6	Confident	90.3	Very high	74 Å²	74	67.3 Å²	67.3	76%	0.763	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-6.5	179.3	0	0	0	0	0	115.1	Y110	Y110-G112 PolarHBondContact O-N 2.98Å
113	N	90.6	Very high	90.2	Very high	90 Å²	90	69.8 Å²	69.8	48%	0.481	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	148.7	176.9	-63.9	-59	0	0	0	111.9	T109 Y110 E111 Y115	T109-N113 CarbonylContact C-O 3.57Å; T109-N113 WeakPolarHBondContact CA-O 3.18Å; Y110-N113 PolarHBondContact N-O 2.93Å; Y110-N113 PolarHBondContact O-N 3.48Å; E111-N113 VanDerWaalsContact C-N 3.26Å; E111-N113 PolarHBondContact O-N 2.87Å; N113-Y115 HydrophobicContact CB-CE2 3.71Å
114	T	91.4	Very high	90	Very high	122 Å²	122	73.5 Å²	73.5	75%	0.748	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.4	176.3	48.3	0	0	0	0	111.2
115	Y	92.8	Very high	89.7	Confident	41 Å²	41	70.8 Å²	70.8	16%	0.161	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.9	-177.2	-61.2	-81.5	0	0	0	110.6	G107 C108 N113 F119 W121	G107-Y115 CarbonylContact C-O 3.59Å; G107-Y115 VanDerWaalsContact CA-O 3.27Å; G107-Y115 WeakPolarHBondContact CA-O 3.37Å; C108-Y115 PolarHBondContact N-O 3.3Å; C108-Y115 PolarHBondContact O-N 3.17Å; N113-Y115 HydrophobicContact CB-CE2 3.71Å; Y115-F119 AromaticContact CD1-CD1 3.47Å; Y115-F119 HydrophobicContact CD1-CD1 3.47Å; Y115-F119 VanDerWaalsContact CD1-CD1 3.47Å; Y115-F119 AromaticContact CD1-CE1 3.72Å; Y115-F119 HydrophobicContact CD1-CE1 3.72Å; Y115-F119 HydrophobicContact CE1-CD1 4.15Å; Y115-F119 AromaticContact CE1-CE1 3.97Å; Y115-F119 HydrophobicContact CE1-CE1 3.97Å; Y115-F119 HydrophobicContact CG-CD1 4.38Å; Y115-W121 HydrophobicContact CD1-CD2 4.16Å; Y115-W121 HydrophobicContact CD1-CE3 4.01Å; Y115-W121 HydrophobicContact CD1-CH2 4.47Å; Y115-W121 HydrophobicContact CD1-CZ3 4.16Å; Y115-W121 AromaticContact CD2-CH2 3.88Å; Y115-W121 HydrophobicContact CD2-CH2 3.88Å; Y115-W121 AromaticContact CD2-CZ2 3.93Å; Y115-W121 HydrophobicContact CD2-CZ2 3.93Å; Y115-W121 HydrophobicContact CD2-CZ3 4.33Å; Y115-W121 AromaticContact CE1-CD2 3.87Å; Y115-W121 HydrophobicContact CE1-CD2 3.87Å; Y115-W121 AromaticContact CE1-CE2 3.99Å; Y115-W121 HydrophobicContact CE1-CE3 4.2Å; Y115-W121 HydrophobicContact CE1-CG 4.11Å; Y115-W121 HydrophobicContact CE1-CZ2 4.45Å; Y115-W121 AromaticContact CE2-CE2 3.98Å; Y115-W121 HydrophobicContact CE2-CH2 4.22Å; Y115-W121 AromaticContact CE2-CZ2 3.77Å; Y115-W121 HydrophobicContact CE2-CZ2 3.77Å; Y115-W121 HydrophobicContact CG-CE3 4.3Å; Y115-W121 HydrophobicContact CG-CH2 4.01Å; Y115-W121 HydrophobicContact CG-CZ2 4.34Å; Y115-W121 AromaticContact CG-CZ3 3.97Å; Y115-W121 HydrophobicContact CG-CZ3 3.97Å; Y115-W121 AromaticContact CZ-CE2 3.73Å; Y115-W121 AromaticContact CZ-NE1 3.81Å
116	N	91.1	Very high	89.5	Confident	137 Å²	137	72.9 Å²	72.9	73%	0.733	42%	0.418	S	S	*	.			trans	-67.7	151.9	172.7	-69.6	-26.6	0	0	0	110.7	F119	N116-F119 WeakPolarHBondContact O-CB 3.47Å; N116-F119 PolarHBondContact O-N 2.91Å
117	S	90.1	Very high	89.1	Confident	29 Å²	29	73 Å²	73	20%	0.203	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	144.5	173.6	-170.8	0	0	0	0	111	F119 E135	S117-F119 VanDerWaalsContact C-N 3.25Å; S117-F119 PolarHBondContact O-N 3.43Å; S117-E135 WeakPolarHBondContact OG-CG 3.49Å; S117-E135 PolarHBondContact OG-N 3.04Å
118	S	88.6	Confident	88.9	Confident	72 Å²	72	74.3 Å²	74.3	50%	0.503	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	3	-173.5	-48.9	0	0	0	0	116.1	C133	S118-C133 VanDerWaalsContact CA-O 3.24Å; S118-C133 WeakPolarHBondContact CA-O 3.37Å; S118-C133 PolarHBondContact N-O 3.05Å
119	F	92.8	Very high	88.6	Confident	103 Å²	103	75.3 Å²	75.3	45%	0.452	43%	0.433	S	S	.	.			trans	-75.5	135.1	177.6	-166.6	-104.5	0	0	0	111.8	Y115 N116 S117 W121 Q132 C133	Y115-F119 AromaticContact CD1-CD1 3.47Å; Y115-F119 HydrophobicContact CD1-CD1 3.47Å; Y115-F119 VanDerWaalsContact CD1-CD1 3.47Å; Y115-F119 AromaticContact CD1-CE1 3.72Å; Y115-F119 HydrophobicContact CD1-CE1 3.72Å; Y115-F119 HydrophobicContact CE1-CD1 4.15Å; Y115-F119 AromaticContact CE1-CE1 3.97Å; Y115-F119 HydrophobicContact CE1-CE1 3.97Å; Y115-F119 HydrophobicContact CG-CD1 4.38Å; N116-F119 WeakPolarHBondContact O-CB 3.47Å; N116-F119 PolarHBondContact O-N 2.91Å; S117-F119 VanDerWaalsContact C-N 3.25Å; S117-F119 PolarHBondContact O-N 3.43Å; F119-W121 HydrophobicContact CD1-CB 4.36Å; F119-W121 HydrophobicContact CD1-CD2 4.43Å; F119-W121 AromaticContact CD1-CE3 3.74Å; F119-W121 HydrophobicContact CD1-CE3 3.74Å; F119-W121 HydrophobicContact CD1-CZ3 4.42Å; F119-W121 HydrophobicContact CE1-CB 3.88Å; F119-W121 HydrophobicContact CE1-CE3 4.35Å; F119-Q132 WeakPolarHBondContact O-CA 3.45Å; F119-C133 PolarHBondContact O-N 2.79Å
120	K	92.6	Very high	88.4	Confident	87 Å²	87	74.5 Å²	74.5	38%	0.378	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.9	176.8	-67.7	-179.5	178.4	-178.1	0	109.1	L130 R131 Q132 E201	K120-L130 HydrophobicContact CB-CD1 4.4Å; K120-R131 CarbonylContact C-O 3.58Å; K120-R131 WeakPolarHBondContact CA-O 3.29Å; K120-Q132 VanDerWaalsContact CE-CD 3.4Å; K120-Q132 VanDerWaalsContact CE-OE1 3.28Å; K120-Q132 HydrophobicContact CG-CB 4.06Å; K120-Q132 HydrophobicContact CG-CG 3.74Å; K120-E201 IonicContact NZ-OE1 2.89Å; K120-E201 PolarHBondContact NZ-OE1 2.75Å
121	W	93.1	Very high	88.5	Confident	35 Å²	35	74.3 Å²	74.3	13%	0.133	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	158.8	178.2	71.2	103.8	0	0	0	112.3	Y110 Y115 F119 R131 C133 V138	Y110-W121 HydrophobicContact CD1-CZ2 4.12Å; Y110-W121 HydrophobicContact CG-CZ2 4.15Å; Y115-W121 HydrophobicContact CD1-CD2 4.16Å; Y115-W121 HydrophobicContact CD1-CE3 4.01Å; Y115-W121 HydrophobicContact CD1-CH2 4.47Å; Y115-W121 HydrophobicContact CD1-CZ3 4.16Å; Y115-W121 AromaticContact CD2-CH2 3.88Å; Y115-W121 HydrophobicContact CD2-CH2 3.88Å; Y115-W121 AromaticContact CD2-CZ2 3.93Å; Y115-W121 HydrophobicContact CD2-CZ2 3.93Å; Y115-W121 HydrophobicContact CD2-CZ3 4.33Å; Y115-W121 AromaticContact CE1-CD2 3.87Å; Y115-W121 HydrophobicContact CE1-CD2 3.87Å; Y115-W121 AromaticContact CE1-CE2 3.99Å; Y115-W121 HydrophobicContact CE1-CE3 4.2Å; Y115-W121 HydrophobicContact CE1-CG 4.11Å; Y115-W121 HydrophobicContact CE1-CZ2 4.45Å; Y115-W121 AromaticContact CE2-CE2 3.98Å; Y115-W121 HydrophobicContact CE2-CH2 4.22Å; Y115-W121 AromaticContact CE2-CZ2 3.77Å; Y115-W121 HydrophobicContact CE2-CZ2 3.77Å; Y115-W121 HydrophobicContact CG-CE3 4.3Å; Y115-W121 HydrophobicContact CG-CH2 4.01Å; Y115-W121 HydrophobicContact CG-CZ2 4.34Å; Y115-W121 AromaticContact CG-CZ3 3.97Å; Y115-W121 HydrophobicContact CG-CZ3 3.97Å; Y115-W121 AromaticContact CZ-CE2 3.73Å; Y115-W121 AromaticContact CZ-NE1 3.81Å; F119-W121 HydrophobicContact CD1-CB 4.36Å; F119-W121 HydrophobicContact CD1-CD2 4.43Å; F119-W121 AromaticContact CD1-CE3 3.74Å; F119-W121 HydrophobicContact CD1-CE3 3.74Å; F119-W121 HydrophobicContact CD1-CZ3 4.42Å; F119-W121 HydrophobicContact CE1-CB 3.88Å; F119-W121 HydrophobicContact CE1-CE3 4.35Å; W121-R131 HydrophobicContact CD2-CB 3.74Å; W121-R131 HydrophobicContact CE3-CB 4.21Å; W121-R131 HydrophobicContact CG-CB 4.27Å; W121-R131 HydrophobicContact CH2-CB 4.06Å; W121-R131 HydrophobicContact CZ2-CB 3.56Å; W121-R131 HydrophobicContact CZ2-CG 4.42Å; W121-R131 HydrophobicContact CZ3-CB 4.37Å; W121-R131 PolarHBondContact N-O 2.85Å; W121-R131 PolarHBondContact O-N 2.81Å; W121-C133 HydrophobicContact CH2-CB 4.23Å; W121-C133 HydrophobicContact CZ3-CB 3.83Å; W121-V138 HydrophobicContact CH2-CG1 3.83Å; W121-V138 HydrophobicContact CH2-CG2 4.09Å; W121-V138 HydrophobicContact CZ2-CG1 4.07Å
122	Q	88.6	Confident	88.8	Confident	93 Å²	93	67.8 Å²	67.8	44%	0.435	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.6	176.9	-60.3	-170.2	-72.3	0	0	108.9	P127 L130	Q122-P127 PolarHBondContact NE2-O 2.89Å; Q122-L130 HydrophobicContact CG-CD1 3.63Å
123	N	84.4	Confident	89.2	Confident	66 Å²	66	64.2 Å²	64.2	35%	0.353	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.1	173.5	-176.4	-14.6	0	0	0	108.3	A125 E126	N123-A125 PolarHBondContact O-N 3.1Å; N123-A125 VanDerWaalsContact O-N 3.14Å; N123-A125 PolarHBondContact OD1-N 2.84Å; N123-E126 HydrophobicContact CB-CB 4.33Å; N123-E126 CarbonylContact O-C 3.48Å; N123-E126 WeakPolarHBondContact O-CA 3.34Å; N123-E126 PolarHBondContact O-N 2.78Å
124	P	82	Confident	89.3	Confident	125 Å²	125	61 Å²	61	81%	0.812	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-28.5	174.9	-27.1	35	0	0	0	114.4	E126	P124-E126 VanDerWaalsContact C-N 3.34Å
125	A	82.8	Confident	89.3	Confident	83 Å²	83	55.4 Å²	55.4	69%	0.686	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-19.7	175.2	0	0	0	0	0	113.5	N123	N123-A125 PolarHBondContact O-N 3.1Å; N123-A125 VanDerWaalsContact O-N 3.14Å; N123-A125 PolarHBondContact OD1-N 2.84Å
126	E	84.8	Confident	89.2	Confident	87 Å²	87	53.8 Å²	53.8	41%	0.407	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	66.9	179.7	-59.7	-177.8	112.4	0	0	110.3	N123 P124 C128 V129 R131	N123-E126 HydrophobicContact CB-CB 4.33Å; N123-E126 CarbonylContact O-C 3.48Å; N123-E126 WeakPolarHBondContact O-CA 3.34Å; N123-E126 PolarHBondContact O-N 2.78Å; P124-E126 VanDerWaalsContact C-N 3.34Å; E126-C128 PolarHBondContact O-N 2.96Å; E126-V129 HydrophobicContact CB-CB 4.2Å; E126-V129 HydrophobicContact CB-CG2 4.08Å; E126-V129 PolarHBondContact O-N 3.23Å; E126-R131 IonicContact OE2-CZ 3.51Å; E126-R131 IonicContact OE2-NH1 2.75Å; E126-R131 IonicContact OE2-NH2 3.84Å; E126-R131 PolarHBondContact OE2-NH2 2.81Å
127	P	83.3	Confident	89.4	Confident	40 Å²	40	47.3 Å²	47.3	26%	0.26	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-17.6	-172.4	26.1	-35.2	0	0	0	113.5	Q122	Q122-P127 PolarHBondContact NE2-O 2.89Å
128	C	85.1	Confident	89.7	Confident	51 Å²	51	45.9 Å²	45.9	35%	0.345	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-4.7	177	-74.2	0	0	0	0	115.2	E126 E142 V143 C159	E126-C128 PolarHBondContact O-N 2.96Å; C128-E142 CarbonylContact O-C 3.49Å; C128-E142 WeakPolarHBondContact O-CA 3.33Å; C128-V143 WeakPolarHBondContact O-CG2 3.07Å; C128-V143 PolarHBondContact O-N 3.11Å; C128-C159 WeakPolarHBondContact CA-SG 3.15Å; C128-C159 HydrophobicContact CB-CB 3.95Å; C128-C159 WeakPolarHBondContact CB-SG 3.26Å; C128-C159 WeakPolarHBondContact SG-CA 3.32Å; C128-C159 WeakPolarHBondContact SG-CB 3.42Å; C128-C159 CovalentContact SG-SG 2.04Å; C128-C159 PolarHBondContact SG-SG 3.35Å
129	V	87.9	Confident	89.9	Confident	23 Å²	23	42.6 Å²	42.6	14%	0.139	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.5	179.1	-177.8	0	0	0	0	109	E126 R131 E140	E126-V129 HydrophobicContact CB-CB 4.2Å; E126-V129 HydrophobicContact CB-CG2 4.08Å; E126-V129 PolarHBondContact O-N 3.23Å; V129-R131 HydrophobicContact CG1-CG 4.38Å; V129-E140 HydrophobicContact CG1-CG 3.62Å
130	L	89.6	Confident	89.9	Confident	37 Å²	37	38.8 Å²	38.8	19%	0.194	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.8	173.6	-176.2	66.1	0	0	0	110.2	K120 Q122 S141 V143	K120-L130 HydrophobicContact CB-CD1 4.4Å; Q122-L130 HydrophobicContact CG-CD1 3.63Å; L130-S141 PolarHBondContact N-O 2.84Å; L130-S141 PolarHBondContact O-N 2.85Å; L130-S141 PolarHBondContact O-OG 3.02Å; L130-V143 HydrophobicContact CB-CG2 4.2Å
131	R	93	Very high	89.7	Confident	12 Å²	12	35 Å²	35	5%	0.045	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133	174	-63.8	173.8	-179.5	96.5	-6.4	109.1	Y110 K120 W121 E126 V129 T139 E140	Y110-R131 PolarHBondContact OH-NE 3.45Å; K120-R131 CarbonylContact C-O 3.58Å; K120-R131 WeakPolarHBondContact CA-O 3.29Å; W121-R131 HydrophobicContact CD2-CB 3.74Å; W121-R131 HydrophobicContact CE3-CB 4.21Å; W121-R131 HydrophobicContact CG-CB 4.27Å; W121-R131 HydrophobicContact CH2-CB 4.06Å; W121-R131 HydrophobicContact CZ2-CB 3.56Å; W121-R131 HydrophobicContact CZ2-CG 4.42Å; W121-R131 HydrophobicContact CZ3-CB 4.37Å; W121-R131 PolarHBondContact N-O 2.85Å; W121-R131 PolarHBondContact O-N 2.81Å; E126-R131 IonicContact OE2-CZ 3.51Å; E126-R131 IonicContact OE2-NH1 2.75Å; E126-R131 IonicContact OE2-NH2 3.84Å; E126-R131 PolarHBondContact OE2-NH2 2.81Å; V129-R131 HydrophobicContact CG1-CG 4.38Å; R131-T139 WeakPolarHBondContact CA-O 3.32Å; R131-E140 HydrophobicContact CG-CB 4.39Å; R131-E140 HydrophobicContact CG-CG 4.22Å; R131-E140 IonicContact CZ-OE2 3.58Å; R131-E140 IonicContact NE-OE2 3Å; R131-E140 PolarHBondContact NE-OE2 2.69Å; R131-E140 IonicContact NH2-OE2 3.39Å; R131-E140 PolarHBondContact NH2-OE2 2.88Å
132	Q	94	Very high	89.3	Confident	16 Å²	16	36.9 Å²	36.9	8%	0.075	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130	178.1	-178.4	173.2	2.9	0	0	110.7	F119 K120 V138 T139 P204	F119-Q132 WeakPolarHBondContact O-CA 3.45Å; K120-Q132 VanDerWaalsContact CE-CD 3.4Å; K120-Q132 VanDerWaalsContact CE-OE1 3.28Å; K120-Q132 HydrophobicContact CG-CB 4.06Å; K120-Q132 HydrophobicContact CG-CG 3.74Å; Q132-V138 CarbonylContact O-C 3.56Å; Q132-V138 WeakPolarHBondContact O-CA 3.42Å; Q132-T139 PolarHBondContact N-O 2.84Å; Q132-T139 PolarHBondContact O-N 2.82Å; Q132-P204 HydrophobicContact CG-CB 4.28Å
133	C	94.3	Very high	89	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.9	171.5	175.3	0	0	0	0	109.7	C108 S118 F119 W121 V137	C108-C133 HydrophobicContact CB-CB 3.75Å; C108-C133 WeakPolarHBondContact CB-SG 3.26Å; C108-C133 PolarHBondContact N-SG 2.85Å; C108-C133 WeakPolarHBondContact SG-CA 3.27Å; C108-C133 WeakPolarHBondContact SG-CB 3.46Å; C108-C133 CovalentContact SG-SG 2.04Å; C108-C133 PolarHBondContact SG-SG 2.93Å; S118-C133 VanDerWaalsContact CA-O 3.24Å; S118-C133 WeakPolarHBondContact CA-O 3.37Å; S118-C133 PolarHBondContact N-O 3.05Å; F119-C133 PolarHBondContact O-N 2.79Å; W121-C133 HydrophobicContact CH2-CB 4.23Å; W121-C133 HydrophobicContact CZ3-CB 3.83Å; C133-V137 WeakPolarHBondContact CA-O 3.22Å
134	Q	93.6	Very high	88.8	Confident	22 Å²	22	34.7 Å²	34.7	10%	0.103	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	105.8	169.7	-168.6	67.6	37.4	0	0	108.8	G136 V137 P204 L206	Q134-G136 PolarHBondContact O-N 3.25Å; Q134-V137 PolarHBondContact N-O 3.34Å; Q134-V137 WeakPolarHBondContact O-CB 3.19Å; Q134-V137 PolarHBondContact O-N 3.06Å; Q134-P204 HydrophobicContact CB-CB 3.95Å; Q134-P204 HydrophobicContact CG-CB 4.42Å; Q134-L206 HydrophobicContact CG-CD2 3.86Å
135	E	91.3	Very high	88.7	Confident	5 Å²	5	30.9 Å²	30.9	2%	0.023	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	46.8	166.1	-65.9	167.1	-176.4	0	0	114.4	A92 L93 K106 S117	A92-E135 WeakPolarHBondContact CB-OE1 2.98Å; A92-E135 VanDerWaalsContact CB-OE2 3.3Å; A92-E135 WeakPolarHBondContact CB-OE2 3.42Å; A92-E135 PolarHBondContact N-OE1 3.48Å; L93-E135 HydrophobicContact CB-CB 3.98Å; L93-E135 HydrophobicContact CB-CG 4.44Å; L93-E135 WeakPolarHBondContact CD2-O 3.47Å; K106-E135 CarbonylContact O-C 3.55Å; K106-E135 WeakPolarHBondContact O-CA 3.27Å; S117-E135 WeakPolarHBondContact OG-CG 3.49Å; S117-E135 PolarHBondContact OG-N 3.04Å
136	G	90.6	Very high	88.5	Confident	7 Å²	7	29 Å²	29	7%	0.072	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	6.1	-178.6	0	0	0	0	0	115.4	K106 G107 Q134 T265 V266	K106-G136 PolarHBondContact O-N 2.85Å; G107-G136 WeakPolarHBondContact O-CA 3.49Å; Q134-G136 PolarHBondContact O-N 3.25Å; G136-T265 WeakPolarHBondContact O-CA 3.23Å; G136-V266 PolarHBondContact O-N 2.99Å
137	V	94.8	Very high	87.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.8	173.6	-173.1	0	0	0	0	109.7	C133 Q134 I205 F240 V266	C133-V137 WeakPolarHBondContact CA-O 3.22Å; Q134-V137 PolarHBondContact N-O 3.34Å; Q134-V137 WeakPolarHBondContact O-CB 3.19Å; Q134-V137 PolarHBondContact O-N 3.06Å; V137-I205 HydrophobicContact CG1-CB 4.13Å; V137-I205 HydrophobicContact CG1-CG2 4.2Å; V137-I205 WeakPolarHBondContact CG1-O 3.3Å; V137-F240 HydrophobicContact CG1-CE2 4.41Å; V137-F240 HydrophobicContact CG2-CD2 3.97Å; V137-F240 HydrophobicContact CG2-CE2 4.02Å; V137-V266 CarbonylContact C-O 3.54Å; V137-V266 VanDerWaalsContact CA-O 3.3Å; V137-V266 WeakPolarHBondContact CA-O 3.27Å; V137-V266 HydrophobicContact CG1-CB 4.29Å; V137-V266 HydrophobicContact CG1-CG1 4.44Å; V137-V266 HydrophobicContact CG2-CB 4.21Å
138	V	96.3	Very high	86.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.5	168.1	179.5	0	0	0	0	108.5	C108 Y110 W121 Q132 T265 V266 V267 C268	C108-V138 HydrophobicContact CB-CG2 3.46Å; C108-V138 VanDerWaalsContact CB-CG2 3.46Å; Y110-V138 HydrophobicContact CD2-CB 4.37Å; Y110-V138 HydrophobicContact CD2-CG1 3.92Å; Y110-V138 HydrophobicContact CD2-CG2 4.36Å; Y110-V138 HydrophobicContact CE2-CG1 4.25Å; W121-V138 HydrophobicContact CH2-CG1 3.83Å; W121-V138 HydrophobicContact CH2-CG2 4.09Å; W121-V138 HydrophobicContact CZ2-CG1 4.07Å; Q132-V138 CarbonylContact O-C 3.56Å; Q132-V138 WeakPolarHBondContact O-CA 3.42Å; V138-T265 HydrophobicContact CG2-CG2 3.72Å; V138-V266 PolarHBondContact N-O 2.94Å; V138-V267 HydrophobicContact CB-CG2 4.41Å; V138-C268 PolarHBondContact O-N 3.25Å
139	T	94.1	Very high	85.8	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.4	171.4	-53.6	0	0	0	0	108.8	R131 Q132 I205	R131-T139 WeakPolarHBondContact CA-O 3.32Å; Q132-T139 PolarHBondContact N-O 2.84Å; Q132-T139 PolarHBondContact O-N 2.82Å; T139-I205 HydrophobicContact CG2-CD1 4.06Å; T139-I205 HydrophobicContact CG2-CG1 4.19Å; T139-I205 PolarHBondContact OG1-N 2.76Å
140	E	92.5	Very high	84.2	Confident	23 Å²	23	36 Å²	36	11%	0.107	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118.3	172	-176.3	172.6	94	0	0	108.4	Y110 V129 R131 C268 K269 K270	Y110-E140 PolarHBondContact OH-OE2 2.89Å; V129-E140 HydrophobicContact CG1-CG 3.62Å; R131-E140 HydrophobicContact CG-CB 4.39Å; R131-E140 HydrophobicContact CG-CG 4.22Å; R131-E140 IonicContact CZ-OE2 3.58Å; R131-E140 IonicContact NE-OE2 3Å; R131-E140 PolarHBondContact NE-OE2 2.69Å; R131-E140 IonicContact NH2-OE2 3.39Å; R131-E140 PolarHBondContact NH2-OE2 2.88Å; E140-C268 PolarHBondContact N-O 3.3Å; E140-K269 HydrophobicContact CB-CG 4.32Å; E140-K269 VanDerWaalsContact OE1-CD 3.27Å; E140-K269 WeakPolarHBondContact OE1-CD 3.23Å; E140-K269 WeakPolarHBondContact OE1-CE 3.26Å; E140-K269 WeakPolarHBondContact OE1-CG 3.45Å; E140-K269 IonicContact OE1-NZ 3.77Å; E140-K269 PolarHBondContact OE1-NZ 3.3Å; E140-K269 IonicContact OE2-NZ 2.9Å; E140-K270 PolarHBondContact O-N 2.96Å
141	S	88.2	Confident	82.8	Confident	8 Å²	8	40.1 Å²	40.1	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	146	-175	60.8	0	0	0	0	112.1	L130	L130-S141 PolarHBondContact N-O 2.84Å; L130-S141 PolarHBondContact O-N 2.85Å; L130-S141 PolarHBondContact O-OG 3.02Å
142	E	84.3	Confident	81.9	Confident	73 Å²	73	42.1 Å²	42.1	34%	0.341	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.5	171.8	-68	177.4	-179.7	0	0	111.2	C128 R144	C128-E142 CarbonylContact O-C 3.49Å; C128-E142 WeakPolarHBondContact O-CA 3.33Å; E142-R144 PolarHBondContact O-N 3.2Å
143	V	82.1	Confident	80.9	Confident	34 Å²	34	45 Å²	45	21%	0.206	24%	0.235	C	C	.	.			trans	-64.9	132.2	174.8	176.2	0	0	0	0	109.4	C128 L130 C160 V199	C128-V143 WeakPolarHBondContact O-CG2 3.07Å; C128-V143 PolarHBondContact O-N 3.11Å; L130-V143 HydrophobicContact CB-CG2 4.2Å; V143-C160 VanDerWaalsContact CG1-SG 3.52Å; V143-V199 HydrophobicContact CG1-CG1 4.11Å
144	R	79.4	Confident	80.3	Confident	79 Å²	79	53 Å²	53	30%	0.298	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	105.4	179.7	-64.2	-169.4	-174.6	-175.5	7.7	110.9	E142 V199 R200 V202 C272 C286	E142-R144 PolarHBondContact O-N 3.2Å; R144-V199 WeakPolarHBondContact O-CA 3.27Å; R144-R200 HydrophobicContact CB-CB 4.08Å; R144-R200 PolarHBondContact O-N 2.98Å; R144-V202 HydrophobicContact CG-CG2 4.25Å; R144-C272 PolarHBondContact NH2-SG 2.89Å; R144-C286 VanDerWaalsContact NH2-CB 3.3Å; R144-C286 PolarHBondContact NH2-SG 3.37Å
145	C	80.8	Confident	79.7	Confident	46 Å²	46	55.1 Å²	55.1	31%	0.311	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	141.5	179.8	-48.1	0	0	0	0	111.5	C160	C145-C160 WeakPolarHBondContact CA-SG 3.4Å; C145-C160 HydrophobicContact CB-CB 3.71Å; C145-C160 WeakPolarHBondContact CB-SG 3.5Å; C145-C160 WeakPolarHBondContact SG-CA 2.96Å; C145-C160 WeakPolarHBondContact SG-CB 3.31Å; C145-C160 CovalentContact SG-SG 2.04Å; C145-C160 PolarHBondContact SG-SG 3.32Å
146	V	77.7	Confident	79.1	Confident	44 Å²	44	64 Å²	64	27%	0.267	33%	0.329	S	S	.	.			trans	-111.2	101.4	174.9	-180	0	0	0	0	108.9	T187 C198 R200	V146-T187 HydrophobicContact CB-CG2 4.5Å; V146-T187 HydrophobicContact CG2-CG2 4.07Å; V146-C198 HydrophobicContact CB-CB 3.75Å; V146-C198 HydrophobicContact CG1-CB 4.37Å; V146-C198 PolarHBondContact N-O 2.88Å; V146-R200 HydrophobicContact CG2-CB 4.27Å
147	V	72.1	Confident	78.4	Confident	69 Å²	69	66.8 Å²	66.8	42%	0.418	36%	0.358	S	S	.	.			trans	-91.4	125.3	179.2	-175.7	0	0	0	0	109.7	P152 P161	V147-P152 HydrophobicContact CG1-CB 3.89Å; V147-P152 HydrophobicContact CG1-CG 3.98Å; V147-P161 HydrophobicContact CG2-CG 3.81Å
148	H	63.4	Low	77.8	Confident	46 Å²	46	70.9 Å²	70.9	21%	0.213	38%	0.378	C	S	.	.			trans	-125.9	12.9	-175.2	60.2	-80.7	0	0	0	113	F168 T196	H148-F168 HydrophobicContact CB-CD2 4.27Å; H148-F168 HydrophobicContact CB-CE2 3.91Å; H148-F168 AromaticContact CD2-CD2 3.67Å; H148-F168 AromaticContact CE1-CD2 3.83Å; H148-F168 AromaticContact CG-CD2 3.64Å; H148-F168 AromaticContact CG-CE2 3.64Å; H148-F168 AromaticContact ND1-CD2 3.75Å; H148-F168 AromaticContact ND1-CE2 3.68Å; H148-F168 AromaticContact NE2-CD2 3.79Å; H148-T196 PolarHBondContact CE1-OG1 2.96Å; H148-T196 PolarHBondContact NE2-OG1 2.66Å
149	C	62.1	Low	77.2	Confident	35 Å²	35	72.5 Å²	72.5	24%	0.236	39%	0.389	C	S	.	.	S	Bend	trans	-128	158.4	177.5	60	0	0	0	0	110.4	C163	C149-C163 HydrophobicContact CB-CB 3.58Å; C149-C163 WeakPolarHBondContact CB-SG 3.48Å; C149-C163 PolarHBondContact N-SG 3.11Å; C149-C163 WeakPolarHBondContact SG-CA 3.28Å; C149-C163 WeakPolarHBondContact SG-CB 2.83Å; C149-C163 CovalentContact SG-SG 2.04Å; C149-C163 PolarHBondContact SG-SG 2.85Å
150	K	54.6	Low	76.7	Confident	197 Å²	197	72.6 Å²	72.6	86%	0.857	39%	0.39	S	S	*	.	S	Bend	trans	-72.9	-35.3	-178.2	-169.5	175.4	-178.7	178.3	0	113	P152	K150-P152 WeakPolarHBondContact O-CD 3.4Å
151	N	60.2	Low	76.3	Confident	124 Å²	124	72.8 Å²	72.8	66%	0.663	39%	0.393	S	S	*	.	S	Bend	trans	-123.6	78.9	-177.4	-62	-34.1	0	0	0	109.5
152	P	74.4	Confident	76	Confident	53 Å²	53	72.7 Å²	72.7	34%	0.344	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-65.5	141.5	174	27.7	-33.8	0	0	0	110.6	V147 K150 P161	V147-P152 HydrophobicContact CG1-CB 3.89Å; V147-P152 HydrophobicContact CG1-CG 3.98Å; K150-P152 WeakPolarHBondContact O-CD 3.4Å; P152-P161 HydrophobicContact CB-CB 3.81Å; P152-P161 HydrophobicContact CB-CG 4.04Å
153	L	72.3	Confident	75.7	Confident	76 Å²	76	69.4 Å²	69.4	40%	0.398	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-96.6	119	172.5	-90.1	119	0	0	0	110	H155 P161 T162 R195	L153-H155 PolarHBondContact O-CD2 3.39Å; L153-H155 VanDerWaalsContact O-CD2 3.25Å; L153-H155 PolarHBondContact O-NE2 2.8Å; L153-P161 CarbonylContact O-C 3.08Å; L153-P161 VanDerWaalsContact O-CA 3.32Å; L153-P161 WeakPolarHBondContact O-CA 3.5Å; L153-P161 WeakPolarHBondContact O-CB 3.15Å; L153-T162 PolarHBondContact N-O 2.93Å; L153-T162 PolarHBondContact O-N 2.73Å; L153-R195 VanDerWaalsContact CB-NH1 3.32Å
154	E	81.6	Confident	75.1	Confident	169 Å²	169	71.6 Å²	71.6	79%	0.79	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-81.5	141.5	171.7	-65.6	-172.5	174.6	0	0	110.3	P161	E154-P161 HydrophobicContact CG-CB 4.16Å
155	H	80.2	Confident	74.8	Confident	67 Å²	67	69.4 Å²	69.4	31%	0.31	39%	0.394	S	S	.	.			trans	-123.2	131.8	178.8	-58.9	-92	0	0	0	108.9	L153 G157 M158 T162	L153-H155 PolarHBondContact O-CD2 3.39Å; L153-H155 VanDerWaalsContact O-CD2 3.25Å; L153-H155 PolarHBondContact O-NE2 2.8Å; H155-G157 PolarHBondContact O-N 3.24Å; H155-M158 HydrophobicContact CB-CB 4.17Å; H155-M158 HydrophobicContact CB-CE 3.4Å; H155-M158 HydrophobicContact CB-CG 4.09Å; H155-M158 WeakPolarHBondContact CD2-CE 2.99Å; H155-M158 PolarHBondContact O-N 2.74Å; H155-M158 VanDerWaalsContact O-N 3.12Å; H155-T162 PolarHBondContact NE2-OG1 3.3Å
156	L	79.6	Confident	74.6	Confident	191 Å²	191	67.9 Å²	67.9	100%	1	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	125.6	177	-83.2	147.3	0	0	0	110.5	M158	L156-M158 VanDerWaalsContact C-N 3.33Å; L156-M158 PolarHBondContact O-N 2.87Å
157	G	76.3	Confident	74	Confident	66 Å²	66	69.5 Å²	69.5	68%	0.68	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-5	179.7	0	0	0	0	0	115.6	H155	H155-G157 PolarHBondContact O-N 3.24Å
158	M	80.9	Confident	73.6	Confident	85 Å²	85	66.5 Å²	66.5	42%	0.419	38%	0.375	S	S	.	.			trans	-97.4	144.3	170.8	-65.3	-148.1	-69.7	0	0	111.2	H155 L156 T162	H155-M158 HydrophobicContact CB-CB 4.17Å; H155-M158 HydrophobicContact CB-CE 3.4Å; H155-M158 HydrophobicContact CB-CG 4.09Å; H155-M158 WeakPolarHBondContact CD2-CE 2.99Å; H155-M158 PolarHBondContact O-N 2.74Å; H155-M158 VanDerWaalsContact O-N 3.12Å; L156-M158 VanDerWaalsContact C-N 3.33Å; L156-M158 PolarHBondContact O-N 2.87Å; M158-T162 HydrophobicContact CE-CG2 4.07Å
159	C	83.6	Confident	73.7	Confident	34 Å²	34	69.7 Å²	69.7	23%	0.23	39%	0.39	C	S	.	.	S	Bend	trans	-74.2	-45.6	176.2	-175.7	0	0	0	0	113.2	C128	C128-C159 WeakPolarHBondContact CA-SG 3.15Å; C128-C159 HydrophobicContact CB-CB 3.95Å; C128-C159 WeakPolarHBondContact CB-SG 3.26Å; C128-C159 WeakPolarHBondContact SG-CA 3.32Å; C128-C159 WeakPolarHBondContact SG-CB 3.42Å; C128-C159 CovalentContact SG-SG 2.04Å; C128-C159 PolarHBondContact SG-SG 3.35Å
160	C	84.3	Confident	73.7	Confident	6 Å²	6	71.4 Å²	71.4	4%	0.041	41%	0.414	C	S	.	.	S	Bend	trans	-105.3	134.4	-172.9	-67.6	0	0	0	0	112.6	V143 C145 Q197 V199	V143-C160 VanDerWaalsContact CG1-SG 3.52Å; C145-C160 WeakPolarHBondContact CA-SG 3.4Å; C145-C160 HydrophobicContact CB-CB 3.71Å; C145-C160 WeakPolarHBondContact CB-SG 3.5Å; C145-C160 WeakPolarHBondContact SG-CA 2.96Å; C145-C160 WeakPolarHBondContact SG-CB 3.31Å; C145-C160 CovalentContact SG-SG 2.04Å; C145-C160 PolarHBondContact SG-SG 3.32Å; C160-Q197 HydrophobicContact CB-CG 4.13Å; C160-Q197 PolarHBondContact O-NE2 3.14Å; C160-V199 HydrophobicContact CB-CG1 4.26Å
161	P	83.4	Confident	74	Confident	26 Å²	26	65.7 Å²	65.7	17%	0.169	40%	0.395	C	S	.	.			trans	-70.7	161.5	176.3	32.2	-36.5	0	0	0	111.3	V147 P152 L153 E154	V147-P161 HydrophobicContact CG2-CG 3.81Å; P152-P161 HydrophobicContact CB-CB 3.81Å; P152-P161 HydrophobicContact CB-CG 4.04Å; L153-P161 CarbonylContact O-C 3.08Å; L153-P161 VanDerWaalsContact O-CA 3.32Å; L153-P161 WeakPolarHBondContact O-CA 3.5Å; L153-P161 WeakPolarHBondContact O-CB 3.15Å; E154-P161 HydrophobicContact CG-CB 4.16Å
162	T	83.7	Confident	74.8	Confident	6 Å²	6	67.7 Å²	67.7	4%	0.037	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-111.7	146.1	178.9	68.4	0	0	0	0	112.1	L153 H155 M158 T196 Q197	L153-T162 PolarHBondContact N-O 2.93Å; L153-T162 PolarHBondContact O-N 2.73Å; H155-T162 PolarHBondContact NE2-OG1 3.3Å; M158-T162 HydrophobicContact CE-CG2 4.07Å; T162-T196 WeakPolarHBondContact CA-O 3.45Å; T162-Q197 HydrophobicContact CG2-CB 4.03Å; T162-Q197 HydrophobicContact CG2-CG 4.27Å
163	C	76.1	Confident	74.9	Confident	4 Å²	4	67 Å²	67	3%	0.027	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.4	176.7	-75.6	0	0	0	0	110.6	C149 R195 T196	C149-C163 HydrophobicContact CB-CB 3.58Å; C149-C163 WeakPolarHBondContact CB-SG 3.48Å; C149-C163 PolarHBondContact N-SG 3.11Å; C149-C163 WeakPolarHBondContact SG-CA 3.28Å; C149-C163 WeakPolarHBondContact SG-CB 2.83Å; C149-C163 CovalentContact SG-SG 2.04Å; C149-C163 PolarHBondContact SG-SG 2.85Å; C163-R195 CarbonylContact O-C 3.55Å; C163-R195 WeakPolarHBondContact O-CA 2.8Å; C163-R195 VanDerWaalsContact O-CB 3.3Å; C163-R195 WeakPolarHBondContact O-CB 3.18Å; C163-T196 WeakPolarHBondContact CB-OG1 2.99Å; C163-T196 PolarHBondContact N-O 2.85Å; C163-T196 PolarHBondContact O-N 3.26Å; C163-T196 PolarHBondContact O-OG1 2.72Å
164	P	70.5	Confident	75.3	Confident	81 Å²	81	70.6 Å²	70.6	53%	0.526	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.5	178.3	28.8	-33.4	0	0	0	111.6
165	G	72.2	Confident	75.6	Confident	32 Å²	32	68.1 Å²	68.1	33%	0.33	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	84.5	154.9	-177.7	0	0	0	0	0	112.8	G194 T196	G165-G194 CarbonylContact C-O 3.54Å; G165-G194 VanDerWaalsContact CA-O 3.22Å; G165-G194 WeakPolarHBondContact CA-O 3.17Å; G165-G194 PolarHBondContact N-O 2.04Å; G165-T196 WeakPolarHBondContact O-CG2 3.36Å; G165-T196 PolarHBondContact O-OG1 3.18Å
166	C	77.3	Confident	75.8	Confident	15 Å²	15	67.4 Å²	67.4	10%	0.101	41%	0.405	C	S	.	.	S	Bend	trans	-103.1	48.1	177.5	-64.4	0	0	0	0	112.5	Q172 Y173 C191 T196	C166-Q172 WeakPolarHBondContact O-CA 3.2Å; C166-Y173 WeakPolarHBondContact CB-O 3.04Å; C166-Y173 PolarHBondContact O-N 2.71Å; C166-C191 HydrophobicContact CB-CB 3.76Å; C166-C191 WeakPolarHBondContact CB-SG 3.03Å; C166-C191 WeakPolarHBondContact SG-CB 3.34Å; C166-C191 CovalentContact SG-SG 2.01Å; C166-C191 PolarHBondContact SG-SG 2.9Å; C166-T196 HydrophobicContact CB-CG2 4.28Å
167	V	65.5	Low	76.1	Confident	78 Å²	78	61.8 Å²	61.8	47%	0.473	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.1	178.3	-177.6	0	0	0	0	109.4	V171 Q172	V167-V171 VanDerWaalsContact CA-O 3.29Å; V167-V171 WeakPolarHBondContact CA-O 3.29Å; V167-Q172 HydrophobicContact CG2-CB 4.42Å; V167-Q172 HydrophobicContact CG2-CG 4.47Å
168	F	63.6	Low	76.8	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.026	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.2	177.3	-168.5	-84.5	0	0	0	109.2	H148 G170 V171 Y173 F179 P181	H148-F168 HydrophobicContact CB-CD2 4.27Å; H148-F168 HydrophobicContact CB-CE2 3.91Å; H148-F168 AromaticContact CD2-CD2 3.67Å; H148-F168 AromaticContact CE1-CD2 3.83Å; H148-F168 AromaticContact CG-CD2 3.64Å; H148-F168 AromaticContact CG-CE2 3.64Å; H148-F168 AromaticContact ND1-CD2 3.75Å; H148-F168 AromaticContact ND1-CE2 3.68Å; H148-F168 AromaticContact NE2-CD2 3.79Å; F168-G170 PolarHBondContact O-N 3Å; F168-V171 PolarHBondContact N-O 2.03Å; F168-V171 PolarHBondContact O-N 3.15Å; F168-Y173 HydrophobicContact CB-CD2 4.38Å; F168-Y173 HydrophobicContact CB-CE2 3.89Å; F168-F179 HydrophobicContact CB-CE2 3.69Å; F168-F179 HydrophobicContact CB-CZ 3.7Å; F168-F179 HydrophobicContact CD1-CE2 4.03Å; F168-F179 AromaticContact CG-CE2 3.83Å; F168-F179 HydrophobicContact CG-CE2 3.83Å; F168-F179 HydrophobicContact CG-CZ 4.13Å; F168-P181 HydrophobicContact CD1-CB 4.28Å; F168-P181 HydrophobicContact CD1-CG 4Å; F168-P181 HydrophobicContact CE1-CB 3.64Å; F168-P181 HydrophobicContact CE1-CG 3.36Å; F168-P181 HydrophobicContact CZ-CB 4.48Å; F168-P181 HydrophobicContact CZ-CG 3.87Å
169	E	65	Low	76.9	Confident	112 Å²	112	61.3 Å²	61.3	52%	0.523	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	26.3	-177.5	-67.3	-176.8	158.7	0	0	115.3	R292	E169-R292 IonicContact OE1-NH2 2.68Å; E169-R292 PolarHBondContact OE1-NH2 3.18Å
170	G	62.5	Low	76.9	Confident	72 Å²	72	65 Å²	65	74%	0.742	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	2.7	179.5	0	0	0	0	0	114.8	F168	F168-G170 PolarHBondContact O-N 3Å
171	V	61.8	Low	76.2	Confident	76 Å²	76	65.2 Å²	65.2	46%	0.461	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.1	174.9	-177.3	0	0	0	0	109.8	V167 F168 Y173	V167-V171 VanDerWaalsContact CA-O 3.29Å; V167-V171 WeakPolarHBondContact CA-O 3.29Å; F168-V171 PolarHBondContact N-O 2.03Å; F168-V171 PolarHBondContact O-N 3.15Å; V171-Y173 HydrophobicContact CB-CE2 3.83Å; V171-Y173 HydrophobicContact CG1-CE1 4.17Å; V171-Y173 HydrophobicContact CG1-CE2 3.9Å; V171-Y173 WeakPolarHBondContact O-CD2 3.4Å; V171-Y173 WeakPolarHBondContact O-CE2 3.29Å
172	Q	75.6	Confident	75.2	Confident	167 Å²	167	73.2 Å²	73.2	78%	0.78	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.5	177.1	-175.9	173.5	4.6	0	0	110.7	C166 V167	C166-Q172 WeakPolarHBondContact O-CA 3.2Å; V167-Q172 HydrophobicContact CG2-CB 4.42Å; V167-Q172 HydrophobicContact CG2-CG 4.47Å
173	Y	77.6	Confident	74.2	Confident	39 Å²	39	77.1 Å²	77.1	15%	0.153	44%	0.444	C	S	.	.			trans	-109.6	152.8	-178.2	-62.8	-84.5	0	0	0	111.5	C166 F168 V171 E177 F179	C166-Y173 WeakPolarHBondContact CB-O 3.04Å; C166-Y173 PolarHBondContact O-N 2.71Å; F168-Y173 HydrophobicContact CB-CD2 4.38Å; F168-Y173 HydrophobicContact CB-CE2 3.89Å; V171-Y173 HydrophobicContact CB-CE2 3.83Å; V171-Y173 HydrophobicContact CG1-CE1 4.17Å; V171-Y173 HydrophobicContact CG1-CE2 3.9Å; V171-Y173 WeakPolarHBondContact O-CD2 3.4Å; V171-Y173 WeakPolarHBondContact O-CE2 3.29Å; Y173-E177 WeakPolarHBondContact CA-OE2 3.3Å; Y173-E177 HydrophobicContact CD1-CG 4.48Å; Y173-F179 HydrophobicContact CD1-CB 3.84Å; Y173-F179 AromaticContact CD1-CD1 3.47Å; Y173-F179 HydrophobicContact CD1-CD1 3.47Å; Y173-F179 VanDerWaalsContact CD1-CD1 3.47Å; Y173-F179 HydrophobicContact CD1-CD2 4.19Å; Y173-F179 AromaticContact CD1-CE1 4Å; Y173-F179 HydrophobicContact CD1-CE1 4Å; Y173-F179 AromaticContact CD1-CG 3.58Å; Y173-F179 HydrophobicContact CD1-CG 3.58Å; Y173-F179 AromaticContact CD2-CD1 3.99Å; Y173-F179 HydrophobicContact CD2-CD1 3.99Å; Y173-F179 HydrophobicContact CD2-CD2 4.32Å; Y173-F179 AromaticContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE1 3.63Å; Y173-F179 AromaticContact CD2-CE2 3.99Å; Y173-F179 HydrophobicContact CD2-CE2 3.99Å; Y173-F179 HydrophobicContact CD2-CG 4.31Å; Y173-F179 AromaticContact CD2-CZ 3.62Å; Y173-F179 HydrophobicContact CD2-CZ 3.62Å; Y173-F179 HydrophobicContact CE1-CB 3.47Å; Y173-F179 VanDerWaalsContact CE1-CB 3.47Å; Y173-F179 AromaticContact CE1-CD1 3.76Å; Y173-F179 HydrophobicContact CE1-CD1 3.76Å; Y173-F179 AromaticContact CE1-CD2 3.6Å; Y173-F179 HydrophobicContact CE1-CD2 3.6Å; Y173-F179 HydrophobicContact CE1-CE1 4.36Å; Y173-F179 HydrophobicContact CE1-CE2 4.22Å; Y173-F179 AromaticContact CE1-CG 3.33Å; Y173-F179 HydrophobicContact CE1-CG 3.33Å; Y173-F179 HydrophobicContact CE2-CD1 4.25Å; Y173-F179 AromaticContact CE2-CD2 3.76Å; Y173-F179 HydrophobicContact CE2-CD2 3.76Å; Y173-F179 HydrophobicContact CE2-CE1 4.03Å; Y173-F179 AromaticContact CE2-CE2 3.51Å; Y173-F179 HydrophobicContact CE2-CE2 3.51Å; Y173-F179 HydrophobicContact CE2-CG 4.12Å; Y173-F179 AromaticContact CE2-CZ 3.65Å; Y173-F179 HydrophobicContact CE2-CZ 3.65Å; Y173-F179 AromaticContact CG-CD1 3.58Å; Y173-F179 HydrophobicContact CG-CD1 3.58Å; Y173-F179 AromaticContact CG-CE1 3.6Å; Y173-F179 HydrophobicContact CG-CE1 3.6Å; Y173-F179 HydrophobicContact CG-CG 4.05Å; Y173-F179 HydrophobicContact CG-CZ 4.09Å; Y173-F179 AromaticContact CZ-CD2 3.34Å; Y173-F179 AromaticContact CZ-CE2 3.62Å; Y173-F179 AromaticContact CZ-CG 3.61Å
174	Q	80.8	Confident	73.8	Confident	150 Å²	150	78.1 Å²	78.1	70%	0.701	45%	0.451	S	S	*	.			trans	-83	157	-179.6	-60.6	-171.9	-0.8	0	0	112.1	G176 E177 C191	Q174-G176 PolarHBondContact O-N 3.18Å; Q174-E177 HydrophobicContact CB-CB 4.36Å; Q174-E177 PolarHBondContact N-OE2 2.83Å; Q174-E177 WeakPolarHBondContact O-CB 3.47Å; Q174-E177 PolarHBondContact O-N 2.04Å; Q174-C191 WeakPolarHBondContact O-CB 3.16Å; Q174-C191 PolarHBondContact O-SG 3.5Å
175	E	86.6	Confident	74.1	Confident	117 Å²	117	80.1 Å²	80.1	55%	0.547	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	130.1	175.1	179.7	58.8	-146.1	0	0	111	E177 T192 G193 G194	E175-E177 VanDerWaalsContact C-N 3.27Å; E175-T192 VanDerWaalsContact OE1-CA 3.29Å; E175-T192 WeakPolarHBondContact OE1-CA 3.33Å; E175-G193 PolarHBondContact OE1-N 3.44Å; E175-G193 PolarHBondContact OE2-N 3.37Å; E175-G194 PolarHBondContact OE2-N 3.47Å
176	G	84.1	Confident	74.6	Confident	53 Å²	53	80 Å²	80	55%	0.546	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-0.6	-174.2	0	0	0	0	0	114.6	Q174 C191	Q174-G176 PolarHBondContact O-N 3.18Å; G176-C191 VanDerWaalsContact CA-O 3.28Å; G176-C191 WeakPolarHBondContact CA-O 3.42Å; G176-C191 PolarHBondContact N-O 3.24Å
177	E	86.6	Confident	75	Confident	72 Å²	72	79.7 Å²	79.7	34%	0.336	44%	0.443	S	S	.	.			trans	-76	131	-178.4	-166.5	176.1	170.6	0	0	111.8	Y173 Q174 E175 S190 C191	Y173-E177 WeakPolarHBondContact CA-OE2 3.3Å; Y173-E177 HydrophobicContact CD1-CG 4.48Å; Q174-E177 HydrophobicContact CB-CB 4.36Å; Q174-E177 PolarHBondContact N-OE2 2.83Å; Q174-E177 WeakPolarHBondContact O-CB 3.47Å; Q174-E177 PolarHBondContact O-N 2.04Å; E175-E177 VanDerWaalsContact C-N 3.27Å; E177-S190 WeakPolarHBondContact O-CA 3.42Å; E177-C191 PolarHBondContact O-N 2.85Å
178	E	90.4	Very high	76	Confident	126 Å²	126	80.2 Å²	80.2	59%	0.589	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.2	168.1	-63.4	-169.3	138.4	0	0	110	K188 C189	E178-K188 WeakPolarHBondContact OE1-CE 2.99Å; E178-K188 IonicContact OE1-NZ 3.69Å; E178-K188 PolarHBondContact OE1-NZ 3.02Å; E178-K188 WeakPolarHBondContact OE2-CE 3.4Å; E178-K188 IonicContact OE2-NZ 3.27Å; E178-K188 PolarHBondContact OE2-NZ 2.8Å; E178-C189 CarbonylContact C-O 3.54Å; E178-C189 WeakPolarHBondContact CA-O 3.4Å
179	F	84.8	Confident	77.1	Confident	15 Å²	15	80 Å²	80	7%	0.066	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	161.3	-175.9	64.3	-88.6	0	0	0	112.9	F168 Y173 C189 T196	F168-F179 HydrophobicContact CB-CE2 3.69Å; F168-F179 HydrophobicContact CB-CZ 3.7Å; F168-F179 HydrophobicContact CD1-CE2 4.03Å; F168-F179 AromaticContact CG-CE2 3.83Å; F168-F179 HydrophobicContact CG-CE2 3.83Å; F168-F179 HydrophobicContact CG-CZ 4.13Å; Y173-F179 HydrophobicContact CD1-CB 3.84Å; Y173-F179 AromaticContact CD1-CD1 3.47Å; Y173-F179 HydrophobicContact CD1-CD1 3.47Å; Y173-F179 VanDerWaalsContact CD1-CD1 3.47Å; Y173-F179 HydrophobicContact CD1-CD2 4.19Å; Y173-F179 AromaticContact CD1-CE1 4Å; Y173-F179 HydrophobicContact CD1-CE1 4Å; Y173-F179 AromaticContact CD1-CG 3.58Å; Y173-F179 HydrophobicContact CD1-CG 3.58Å; Y173-F179 AromaticContact CD2-CD1 3.99Å; Y173-F179 HydrophobicContact CD2-CD1 3.99Å; Y173-F179 HydrophobicContact CD2-CD2 4.32Å; Y173-F179 AromaticContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE1 3.63Å; Y173-F179 AromaticContact CD2-CE2 3.99Å; Y173-F179 HydrophobicContact CD2-CE2 3.99Å; Y173-F179 HydrophobicContact CD2-CG 4.31Å; Y173-F179 AromaticContact CD2-CZ 3.62Å; Y173-F179 HydrophobicContact CD2-CZ 3.62Å; Y173-F179 HydrophobicContact CE1-CB 3.47Å; Y173-F179 VanDerWaalsContact CE1-CB 3.47Å; Y173-F179 AromaticContact CE1-CD1 3.76Å; Y173-F179 HydrophobicContact CE1-CD1 3.76Å; Y173-F179 AromaticContact CE1-CD2 3.6Å; Y173-F179 HydrophobicContact CE1-CD2 3.6Å; Y173-F179 HydrophobicContact CE1-CE1 4.36Å; Y173-F179 HydrophobicContact CE1-CE2 4.22Å; Y173-F179 AromaticContact CE1-CG 3.33Å; Y173-F179 HydrophobicContact CE1-CG 3.33Å; Y173-F179 HydrophobicContact CE2-CD1 4.25Å; Y173-F179 AromaticContact CE2-CD2 3.76Å; Y173-F179 HydrophobicContact CE2-CD2 3.76Å; Y173-F179 HydrophobicContact CE2-CE1 4.03Å; Y173-F179 AromaticContact CE2-CE2 3.51Å; Y173-F179 HydrophobicContact CE2-CE2 3.51Å; Y173-F179 HydrophobicContact CE2-CG 4.12Å; Y173-F179 AromaticContact CE2-CZ 3.65Å; Y173-F179 HydrophobicContact CE2-CZ 3.65Å; Y173-F179 AromaticContact CG-CD1 3.58Å; Y173-F179 HydrophobicContact CG-CD1 3.58Å; Y173-F179 AromaticContact CG-CE1 3.6Å; Y173-F179 HydrophobicContact CG-CE1 3.6Å; Y173-F179 HydrophobicContact CG-CG 4.05Å; Y173-F179 HydrophobicContact CG-CZ 4.09Å; Y173-F179 AromaticContact CZ-CD2 3.34Å; Y173-F179 AromaticContact CZ-CE2 3.62Å; Y173-F179 AromaticContact CZ-CG 3.61Å; F179-C189 HydrophobicContact CD1-CB 4.06Å; F179-C189 HydrophobicContact CD2-CB 3.85Å; F179-C189 HydrophobicContact CE1-CB 3.6Å; F179-C189 HydrophobicContact CE2-CB 3.36Å; F179-C189 HydrophobicContact CG-CB 4.18Å; F179-C189 HydrophobicContact CZ-CB 3.23Å; F179-C189 PolarHBondContact N-O 3.42Å; F179-C189 PolarHBondContact O-N 2.98Å; F179-T196 HydrophobicContact CZ-CG2 4.48Å
180	Q	82.8	Confident	78.3	Confident	113 Å²	113	75.8 Å²	75.8	53%	0.528	42%	0.421	S	S	.	.			trans	-120.9	125.2	175	-66.3	-178.1	2.1	0	0	109.4
181	P	70.1	Confident	79.5	Confident	10 Å²	10	72.5 Å²	72.5	7%	0.065	39%	0.387	C	S	.	.			trans	-63.1	145.7	-179.7	-25	35.2	0	0	0	114.5	F168 G183 S184 T187	F168-P181 HydrophobicContact CD1-CB 4.28Å; F168-P181 HydrophobicContact CD1-CG 4Å; F168-P181 HydrophobicContact CE1-CB 3.64Å; F168-P181 HydrophobicContact CE1-CG 3.36Å; F168-P181 HydrophobicContact CZ-CB 4.48Å; F168-P181 HydrophobicContact CZ-CG 3.87Å; P181-G183 PolarHBondContact O-N 3.36Å; P181-S184 PolarHBondContact O-N 2.96Å; P181-S184 VanDerWaalsContact O-N 3.09Å; P181-T187 VanDerWaalsContact CD-O 3.25Å; P181-T187 WeakPolarHBondContact CD-O 3.06Å; P181-T187 HydrophobicContact CG-CG2 4.08Å
182	E	61.3	Low	80.7	Confident	193 Å²	193	72.3 Å²	72.3	90%	0.902	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	117.4	179.2	-160.3	169.4	-168.4	0	0	110.2
183	G	62.8	Low	81	Confident	88 Å²	88	67.2 Å²	67.2	91%	0.907	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-7.4	-173.7	0	0	0	0	0	115.3	P181	P181-G183 PolarHBondContact O-N 3.36Å
184	S	67.8	Low	80.9	Confident	25 Å²	25	67.1 Å²	67.1	18%	0.175	39%	0.389	C	S	.	.			trans	-132.7	91.7	174.3	-166.7	0	0	0	0	113	P181 C186 T187	P181-S184 PolarHBondContact O-N 2.96Å; P181-S184 VanDerWaalsContact O-N 3.09Å; S184-C186 PolarHBondContact O-N 2.93Å; S184-C186 VanDerWaalsContact O-N 3.1Å; S184-T187 PolarHBondContact O-N 2.91Å; S184-T187 PolarHBondContact OG-OG1 2.87Å
185	K	77.9	Confident	80.9	Confident	124 Å²	124	63.7 Å²	63.7	54%	0.539	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.9	178.2	-58.3	-175.3	-177.1	-178.7	0	114.6	C220	K185-C220 WeakPolarHBondContact O-CB 3.24Å
186	C	82.8	Confident	80.6	Confident	30 Å²	30	58.1 Å²	58.1	20%	0.203	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-0.8	-175.6	-68.5	0	0	0	0	113.6	S184 R200 E201 C220	S184-C186 PolarHBondContact O-N 2.93Å; S184-C186 VanDerWaalsContact O-N 3.1Å; C186-R200 HydrophobicContact CB-CG 4.33Å; C186-R200 CarbonylContact O-C 3.56Å; C186-R200 WeakPolarHBondContact O-CA 3.21Å; C186-E201 PolarHBondContact O-N 2.86Å; C186-C220 WeakPolarHBondContact CA-SG 3.41Å; C186-C220 HydrophobicContact CB-CB 3.9Å; C186-C220 WeakPolarHBondContact CB-SG 3.45Å; C186-C220 VanDerWaalsContact SG-CA 3.54Å; C186-C220 WeakPolarHBondContact SG-CB 3.18Å; C186-C220 CovalentContact SG-SG 2.02Å; C186-C220 PolarHBondContact SG-SG 3.21Å
187	T	84.5	Confident	80.8	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.043	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124	177.9	-54.7	0	0	0	0	108.2	V146 P181 S184 C198	V146-T187 HydrophobicContact CB-CG2 4.5Å; V146-T187 HydrophobicContact CG2-CG2 4.07Å; P181-T187 VanDerWaalsContact CD-O 3.25Å; P181-T187 WeakPolarHBondContact CD-O 3.06Å; P181-T187 HydrophobicContact CG-CG2 4.08Å; S184-T187 PolarHBondContact O-N 2.91Å; S184-T187 PolarHBondContact OG-OG1 2.87Å; T187-C198 HydrophobicContact CG2-CB 4.47Å
188	K	86.6	Confident	80.7	Confident	89 Å²	89	54.5 Å²	54.5	39%	0.387	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.6	174.3	-166.8	-179	-176.8	-164.6	0	108.3	E178 C198 V199	E178-K188 WeakPolarHBondContact OE1-CE 2.99Å; E178-K188 IonicContact OE1-NZ 3.69Å; E178-K188 PolarHBondContact OE1-NZ 3.02Å; E178-K188 WeakPolarHBondContact OE2-CE 3.4Å; E178-K188 IonicContact OE2-NZ 3.27Å; E178-K188 PolarHBondContact OE2-NZ 2.8Å; K188-C198 WeakPolarHBondContact O-CA 3.37Å; K188-V199 PolarHBondContact N-O 2.85Å; K188-V199 PolarHBondContact O-N 2.77Å
189	C	86.6	Confident	80.3	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.7	176.3	-64.3	0	0	0	0	109.8	E178 F179 Q197 C198	E178-C189 CarbonylContact C-O 3.54Å; E178-C189 WeakPolarHBondContact CA-O 3.4Å; F179-C189 HydrophobicContact CD1-CB 4.06Å; F179-C189 HydrophobicContact CD2-CB 3.85Å; F179-C189 HydrophobicContact CE1-CB 3.6Å; F179-C189 HydrophobicContact CE2-CB 3.36Å; F179-C189 HydrophobicContact CG-CB 4.18Å; F179-C189 HydrophobicContact CZ-CB 3.23Å; F179-C189 PolarHBondContact N-O 3.42Å; F179-C189 PolarHBondContact O-N 2.98Å; C189-Q197 CarbonylContact C-O 3.55Å; C189-Q197 VanDerWaalsContact CA-O 3.22Å; C189-Q197 WeakPolarHBondContact CA-O 3.37Å; C189-C198 HydrophobicContact CB-CB 4.1Å; C189-C198 WeakPolarHBondContact CB-SG 3.11Å; C189-C198 WeakPolarHBondContact SG-CB 3.38Å; C189-C198 CovalentContact SG-SG 2.04Å; C189-C198 PolarHBondContact SG-SG 3.02Å
190	S	90.3	Very high	80.2	Confident	25 Å²	25	54.6 Å²	54.6	18%	0.175	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.4	171	55.9	0	0	0	0	110.3	E177 T196 Q197	E177-S190 WeakPolarHBondContact O-CA 3.42Å; S190-T196 WeakPolarHBondContact O-CA 3.33Å; S190-Q197 PolarHBondContact N-O 3.16Å; S190-Q197 PolarHBondContact O-N 2.92Å
191	C	87.9	Confident	80.2	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.014	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	113.6	169.8	168.6	0	0	0	0	108.7	C166 Q174 G176 E177 R195	C166-C191 HydrophobicContact CB-CB 3.76Å; C166-C191 WeakPolarHBondContact CB-SG 3.03Å; C166-C191 WeakPolarHBondContact SG-CB 3.34Å; C166-C191 CovalentContact SG-SG 2.01Å; C166-C191 PolarHBondContact SG-SG 2.9Å; Q174-C191 WeakPolarHBondContact O-CB 3.16Å; Q174-C191 PolarHBondContact O-SG 3.5Å; G176-C191 VanDerWaalsContact CA-O 3.28Å; G176-C191 WeakPolarHBondContact CA-O 3.42Å; G176-C191 PolarHBondContact N-O 3.24Å; E177-C191 PolarHBondContact O-N 2.85Å; C191-R195 CarbonylContact C-O 3.52Å; C191-R195 WeakPolarHBondContact CA-O 3.3Å
192	T	87.1	Confident	80.9	Confident	72 Å²	72	53.1 Å²	53.1	44%	0.442	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	133.5	176.3	53.3	0	0	0	0	111.2	E175 G194 R195	E175-T192 VanDerWaalsContact OE1-CA 3.29Å; E175-T192 WeakPolarHBondContact OE1-CA 3.33Å; T192-G194 VanDerWaalsContact C-N 3.27Å; T192-G194 PolarHBondContact O-N 2.89Å; T192-R195 PolarHBondContact N-O 3.28Å; T192-R195 WeakPolarHBondContact O-CB 3.32Å; T192-R195 PolarHBondContact O-N 3.21Å
193	G	81.3	Confident	82.2	Confident	61 Å²	61	45.5 Å²	45.5	63%	0.629	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	36.6	-175.7	0	0	0	0	0	113.6	E175 R195	E175-G193 PolarHBondContact OE1-N 3.44Å; E175-G193 PolarHBondContact OE2-N 3.37Å; G193-R195 PolarHBondContact O-N 3.45Å
194	G	76.3	Confident	83.5	Confident	36 Å²	36	41.9 Å²	41.9	37%	0.371	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	23.3	-175.3	0	0	0	0	0	114	G165 E175 T192	G165-G194 CarbonylContact C-O 3.54Å; G165-G194 VanDerWaalsContact CA-O 3.22Å; G165-G194 WeakPolarHBondContact CA-O 3.17Å; G165-G194 PolarHBondContact N-O 2.04Å; E175-G194 PolarHBondContact OE2-N 3.47Å; T192-G194 VanDerWaalsContact C-N 3.27Å; T192-G194 PolarHBondContact O-N 2.89Å
195	R	80.3	Confident	84.6	Confident	78 Å²	78	41.2 Å²	41.2	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.5	-179.5	-65.4	162.4	173.5	-92.3	0.3	110.8	L153 C163 C191 T192 G193	L153-R195 VanDerWaalsContact CB-NH1 3.32Å; C163-R195 CarbonylContact O-C 3.55Å; C163-R195 WeakPolarHBondContact O-CA 2.8Å; C163-R195 VanDerWaalsContact O-CB 3.3Å; C163-R195 WeakPolarHBondContact O-CB 3.18Å; C191-R195 CarbonylContact C-O 3.52Å; C191-R195 WeakPolarHBondContact CA-O 3.3Å; T192-R195 PolarHBondContact N-O 3.28Å; T192-R195 WeakPolarHBondContact O-CB 3.32Å; T192-R195 PolarHBondContact O-N 3.21Å; G193-R195 PolarHBondContact O-N 3.45Å
196	T	81.3	Confident	85.3	Confident	1 Å²	1	36 Å²	36	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.6	178.2	41.9	0	0	0	0	111.6	H148 T162 C163 G165 C166 F179 S190	H148-T196 PolarHBondContact CE1-OG1 2.96Å; H148-T196 PolarHBondContact NE2-OG1 2.66Å; T162-T196 WeakPolarHBondContact CA-O 3.45Å; C163-T196 WeakPolarHBondContact CB-OG1 2.99Å; C163-T196 PolarHBondContact N-O 2.85Å; C163-T196 PolarHBondContact O-N 3.26Å; C163-T196 PolarHBondContact O-OG1 2.72Å; G165-T196 WeakPolarHBondContact O-CG2 3.36Å; G165-T196 PolarHBondContact O-OG1 3.18Å; C166-T196 HydrophobicContact CB-CG2 4.28Å; F179-T196 HydrophobicContact CZ-CG2 4.48Å; S190-T196 WeakPolarHBondContact O-CA 3.33Å
197	Q	87.1	Confident	85.6	Confident	46 Å²	46	34.6 Å²	34.6	22%	0.215	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.4	168.9	-168.3	-179.9	60.4	0	0	108.7	C160 T162 C189 S190	C160-Q197 HydrophobicContact CB-CG 4.13Å; C160-Q197 PolarHBondContact O-NE2 3.14Å; T162-Q197 HydrophobicContact CG2-CB 4.03Å; T162-Q197 HydrophobicContact CG2-CG 4.27Å; C189-Q197 CarbonylContact C-O 3.55Å; C189-Q197 VanDerWaalsContact CA-O 3.22Å; C189-Q197 WeakPolarHBondContact CA-O 3.37Å; S190-Q197 PolarHBondContact N-O 3.16Å; S190-Q197 PolarHBondContact O-N 2.92Å
198	C	84.1	Confident	85.8	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.02	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.7	-179.9	-65	0	0	0	0	110.6	V146 T187 K188 C189	V146-C198 HydrophobicContact CB-CB 3.75Å; V146-C198 HydrophobicContact CG1-CB 4.37Å; V146-C198 PolarHBondContact N-O 2.88Å; T187-C198 HydrophobicContact CG2-CB 4.47Å; K188-C198 WeakPolarHBondContact O-CA 3.37Å; C189-C198 HydrophobicContact CB-CB 4.1Å; C189-C198 WeakPolarHBondContact CB-SG 3.11Å; C189-C198 WeakPolarHBondContact SG-CB 3.38Å; C189-C198 CovalentContact SG-SG 2.04Å; C189-C198 PolarHBondContact SG-SG 3.02Å
199	V	83.8	Confident	85.8	Confident	48 Å²	48	31 Å²	31	29%	0.291	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.8	176.7	-61.6	0	0	0	0	109.9	V143 R144 C160 K188	V143-V199 HydrophobicContact CG1-CG1 4.11Å; R144-V199 WeakPolarHBondContact O-CA 3.27Å; C160-V199 HydrophobicContact CB-CG1 4.26Å; K188-V199 PolarHBondContact N-O 2.85Å; K188-V199 PolarHBondContact O-N 2.77Å
200	R	81.3	Confident	85.6	Confident	95 Å²	95	38.7 Å²	38.7	36%	0.358	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.2	172.7	-164.8	177.1	-177.4	115.6	-11.7	109.3	R144 V146 C186 V202	R144-R200 HydrophobicContact CB-CB 4.08Å; R144-R200 PolarHBondContact O-N 2.98Å; V146-R200 HydrophobicContact CG2-CB 4.27Å; C186-R200 HydrophobicContact CB-CG 4.33Å; C186-R200 CarbonylContact O-C 3.56Å; C186-R200 WeakPolarHBondContact O-CA 3.21Å; R200-V202 PolarHBondContact O-N 2.97Å
201	E	84	Confident	85.2	Confident	77 Å²	77	44.6 Å²	44.6	36%	0.36	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-64.6	127.8	177.1	-174.4	165.3	-154.8	0	0	110.2	K120 C186	K120-E201 IonicContact NZ-OE1 2.89Å; K120-E201 PolarHBondContact NZ-OE1 2.75Å; C186-E201 PolarHBondContact O-N 2.86Å
202	V	84.3	Confident	85.1	Confident	14 Å²	14	47 Å²	47	9%	0.085	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-97.6	123.6	172.3	-177	0	0	0	0	107.7	R144 R200 K270	R144-V202 HydrophobicContact CG-CG2 4.25Å; R200-V202 PolarHBondContact O-N 2.97Å; V202-K270 HydrophobicContact CG1-CD 4.21Å
203	C	87.5	Confident	85.2	Confident	34 Å²	34	45.6 Å²	45.6	23%	0.23	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-74.9	142.8	-175.4	-62.8	0	0	0	0	113.1	C220 C221	C203-C220 VanDerWaalsContact SG-SG 3.69Å; C203-C221 WeakPolarHBondContact CA-SG 3.23Å; C203-C221 HydrophobicContact CB-CB 3.67Å; C203-C221 WeakPolarHBondContact CB-SG 3.09Å; C203-C221 WeakPolarHBondContact SG-CA 3.32Å; C203-C221 WeakPolarHBondContact SG-CB 3.5Å; C203-C221 CovalentContact SG-SG 2.06Å; C203-C221 PolarHBondContact SG-SG 2.77Å
204	P	90.9	Very high	85.5	Confident	12 Å²	12	46.2 Å²	46.2	8%	0.078	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-66	147.7	175	28.8	-34.9	0	0	0	110.6	Q132 Q134 L206	Q132-P204 HydrophobicContact CG-CB 4.28Å; Q134-P204 HydrophobicContact CB-CB 3.95Å; Q134-P204 HydrophobicContact CG-CB 4.42Å; P204-L206 HydrophobicContact CG-CD2 4.47Å
205	I	91.3	Very high	86	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.051	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-79	124.9	170.9	-65.1	161.7	0	0	0	108	V137 T139 F240 Y253 T257 C268	V137-I205 HydrophobicContact CG1-CB 4.13Å; V137-I205 HydrophobicContact CG1-CG2 4.2Å; V137-I205 WeakPolarHBondContact CG1-O 3.3Å; T139-I205 HydrophobicContact CG2-CD1 4.06Å; T139-I205 HydrophobicContact CG2-CG1 4.19Å; T139-I205 PolarHBondContact OG1-N 2.76Å; I205-F240 HydrophobicContact CG2-CE2 3.77Å; I205-F240 HydrophobicContact CG2-CZ 3.67Å; I205-Y253 HydrophobicContact CG2-CD2 3.95Å; I205-Y253 HydrophobicContact CG2-CE2 3.68Å; I205-T257 HydrophobicContact CD1-CG2 3.45Å; I205-T257 VanDerWaalsContact CD1-CG2 3.45Å; I205-C268 HydrophobicContact CD1-CB 3.36Å
206	L	92	Very high	86.3	Confident	14 Å²	14	46.6 Å²	46.6	7%	0.073	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-88	143.3	-176.3	-56.2	-177.8	0	0	0	111.3	Q134 P204 C208 P222	Q134-L206 HydrophobicContact CG-CD2 3.86Å; P204-L206 HydrophobicContact CG-CD2 4.47Å; L206-C208 VanDerWaalsContact C-N 3.27Å; L206-C208 PolarHBondContact O-N 2.86Å; L206-P222 HydrophobicContact CD1-CB 3.98Å; L206-P222 HydrophobicContact CD1-CG 4.08Å
207	S	89.4	Confident	86.3	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.014	28%	0.275	C	S	.	.	S	Bend	trans	-74.3	-14.7	174.3	-169.1	0	0	0	0	113.1	R228 L239 R241	S207-R228 PolarHBondContact O-NH1 2.9Å; S207-L239 PolarHBondContact OG-O 3.28Å; S207-R241 WeakPolarHBondContact O-CA 3.35Å; S207-R241 PolarHBondContact O-N 3.48Å
208	C	89.6	Confident	86	Confident	8 Å²	8	52.9 Å²	52.9	5%	0.054	29%	0.289	C	S	.	.	S	Bend	trans	-81.2	152.7	179.1	59.8	0	0	0	0	113.6	L206 L212 C224	L206-C208 VanDerWaalsContact C-N 3.27Å; L206-C208 PolarHBondContact O-N 2.86Å; C208-L212 HydrophobicContact CB-CB 4.3Å; C208-C224 HydrophobicContact CB-CB 3.81Å; C208-C224 WeakPolarHBondContact CB-SG 3.47Å; C208-C224 VanDerWaalsContact SG-CA 3.52Å; C208-C224 WeakPolarHBondContact SG-CB 3.38Å; C208-C224 CovalentContact SG-SG 2.03Å; C208-C224 PolarHBondContact SG-SG 3.12Å
209	P	85.8	Confident	86	Confident	12 Å²	12	56.8 Å²	56.8	8%	0.078	31%	0.306	C	S	.	.			trans	-56.1	151.1	167.3	-26	34.5	0	0	0	113	H211 L212	P209-H211 VanDerWaalsContact C-N 3.28Å; P209-H211 WeakPolarHBondContact CB-CE1 3.46Å; P209-H211 WeakPolarHBondContact CB-ND1 3.27Å; P209-H211 PolarHBondContact O-N 3.11Å; P209-L212 PolarHBondContact O-N 3.25Å
210	Q	82.6	Confident	86.1	Confident	162 Å²	162	55.3 Å²	55.3	76%	0.757	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-60.4	-31.6	-175.4	-169.2	174.7	6.8	0	0	114.2	L212 S213	Q210-L212 PolarHBondContact O-N 2.85Å; Q210-S213 PolarHBondContact O-N 3.48Å; Q210-S213 VanDerWaalsContact O-N 3.16Å; Q210-S213 PolarHBondContact O-OG 3.08Å
211	H	82.4	Confident	86.4	Confident	150 Å²	150	51.6 Å²	51.6	69%	0.694	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-70.4	-12.4	176.5	67.7	-89	0	0	0	113.5	P209	P209-H211 VanDerWaalsContact C-N 3.28Å; P209-H211 WeakPolarHBondContact CB-CE1 3.46Å; P209-H211 WeakPolarHBondContact CB-ND1 3.27Å; P209-H211 PolarHBondContact O-N 3.11Å
212	L	85.8	Confident	86.7	Confident	51 Å²	51	49.5 Å²	49.5	27%	0.267	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-105.2	7.4	174.6	-60.2	179.3	0	0	0	112	C208 P209 Q210 C224 L225	C208-L212 HydrophobicContact CB-CB 4.3Å; P209-L212 PolarHBondContact O-N 3.25Å; Q210-L212 PolarHBondContact O-N 2.85Å; L212-C224 CarbonylContact O-C 3.6Å; L212-C224 WeakPolarHBondContact O-CA 3.46Å; L212-L225 WeakPolarHBondContact O-CB 3.45Å; L212-L225 PolarHBondContact O-N 2.88Å
213	S	87.6	Confident	87	Confident	44 Å²	44	52.6 Å²	52.6	31%	0.308	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.7	172.4	70.7	0	0	0	0	110.7	Q210	Q210-S213 PolarHBondContact O-N 3.48Å; Q210-S213 VanDerWaalsContact O-N 3.16Å; Q210-S213 PolarHBondContact O-OG 3.08Å
214	H	87.8	Confident	87.1	Confident	73 Å²	73	51.9 Å²	51.9	34%	0.338	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.1	173.9	77.9	-54.1	0	0	0	109.7	P216 P222 K223 L225	H214-P216 WeakPolarHBondContact O-CD 3.34Å; H214-P222 CarbonylContact O-C 3.6Å; H214-P222 VanDerWaalsContact O-CA 3.24Å; H214-P222 WeakPolarHBondContact O-CA 3.48Å; H214-K223 PolarHBondContact N-O 3.39Å; H214-K223 PolarHBondContact ND1-O 2.92Å; H214-K223 PolarHBondContact O-N 3.41Å; H214-L225 HydrophobicContact CB-CD1 4.02Å; H214-L225 HydrophobicContact CB-CD2 4.41Å; H214-L225 HydrophobicContact CB-CG 4.15Å; H214-L225 WeakPolarHBondContact CE1-CD2 3.29Å; H214-L225 VanDerWaalsContact ND1-CD2 3.27Å; H214-L225 WeakPolarHBondContact ND1-CD2 3.27Å; H214-L225 WeakPolarHBondContact ND1-CG 3.42Å
215	I	87.2	Confident	86.9	Confident	104 Å²	104	55.3 Å²	55.3	53%	0.533	30%	0.304	S	S	.	.			trans	-100.7	112.8	173.9	-57.1	174.3	0	0	0	107.3	Q219 P222	I215-Q219 VanDerWaalsContact CG2-O 3.31Å; I215-Q219 WeakPolarHBondContact CG2-O 3.38Å; I215-P222 HydrophobicContact CG1-CB 3.92Å
216	P	86.8	Confident	86.5	Confident	18 Å²	18	57.7 Å²	57.7	12%	0.117	33%	0.331	C	S	.	.			trans	-59	145.6	176.8	-24.4	34.8	0	0	0	111.7	H214 G218 Q219 K223	H214-P216 WeakPolarHBondContact O-CD 3.34Å; P216-G218 PolarHBondContact O-N 3.38Å; P216-Q219 HydrophobicContact CB-CB 4.35Å; P216-Q219 HydrophobicContact CB-CG 4.14Å; P216-Q219 PolarHBondContact O-N 3.45Å; P216-K223 HydrophobicContact CG-CD 4.18Å; P216-K223 HydrophobicContact CG-CG 4.31Å
217	P	82.3	Confident	86.2	Confident	132 Å²	132	60.8 Å²	60.8	86%	0.857	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	125.6	178.5	-24.3	33.3	0	0	0	111.8	Q219	P217-Q219 VanDerWaalsContact C-N 3.34Å
218	G	79.2	Confident	86	Confident	48 Å²	48	63.7 Å²	63.7	50%	0.495	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-3.3	178.3	0	0	0	0	0	115	P216	P216-G218 PolarHBondContact O-N 3.38Å
219	Q	84.9	Confident	85.8	Confident	85 Å²	85	68.2 Å²	68.2	40%	0.397	37%	0.374	S	S	.	.			trans	-98.3	153	175.6	-63.1	-173	6.2	0	0	111.9	I215 P216 P217	I215-Q219 VanDerWaalsContact CG2-O 3.31Å; I215-Q219 WeakPolarHBondContact CG2-O 3.38Å; P216-Q219 HydrophobicContact CB-CB 4.35Å; P216-Q219 HydrophobicContact CB-CG 4.14Å; P216-Q219 PolarHBondContact O-N 3.45Å; P217-Q219 VanDerWaalsContact C-N 3.34Å
220	C	85.8	Confident	85.6	Confident	16 Å²	16	68.9 Å²	68.9	11%	0.108	38%	0.378	C	S	.	.	S	Bend	trans	-74	-48	173.2	172.8	0	0	0	0	111.8	K185 C186 C203	K185-C220 WeakPolarHBondContact O-CB 3.24Å; C186-C220 WeakPolarHBondContact CA-SG 3.41Å; C186-C220 HydrophobicContact CB-CB 3.9Å; C186-C220 WeakPolarHBondContact CB-SG 3.45Å; C186-C220 VanDerWaalsContact SG-CA 3.54Å; C186-C220 WeakPolarHBondContact SG-CB 3.18Å; C186-C220 CovalentContact SG-SG 2.02Å; C186-C220 PolarHBondContact SG-SG 3.21Å; C203-C220 VanDerWaalsContact SG-SG 3.69Å
221	C	88.3	Confident	85.4	Confident	17 Å²	17	66.9 Å²	66.9	12%	0.115	37%	0.367	C	S	.	.	S	Bend	trans	-103.7	146.7	-163.5	-66.3	0	0	0	0	114.2	C203	C203-C221 WeakPolarHBondContact CA-SG 3.23Å; C203-C221 HydrophobicContact CB-CB 3.67Å; C203-C221 WeakPolarHBondContact CB-SG 3.09Å; C203-C221 WeakPolarHBondContact SG-CA 3.32Å; C203-C221 WeakPolarHBondContact SG-CB 3.5Å; C203-C221 CovalentContact SG-SG 2.06Å; C203-C221 PolarHBondContact SG-SG 2.77Å
222	P	90	Very high	85	Confident	34 Å²	34	64 Å²	64	22%	0.221	36%	0.357	C	S	.	.			trans	-69.6	151.7	177.4	30.3	-34.9	0	0	0	111.2	L206 H214 I215	L206-P222 HydrophobicContact CD1-CB 3.98Å; L206-P222 HydrophobicContact CD1-CG 4.08Å; H214-P222 CarbonylContact O-C 3.6Å; H214-P222 VanDerWaalsContact O-CA 3.24Å; H214-P222 WeakPolarHBondContact O-CA 3.48Å; I215-P222 HydrophobicContact CG1-CB 3.92Å
223	K	90.2	Very high	84.6	Confident	79 Å²	79	63.3 Å²	63.3	34%	0.343	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151.4	169.6	-67	-169.4	173.3	-168.6	0	110.1	D90 H214 P216	D90-K223 IonicContact OD1-NZ 3.12Å; D90-K223 PolarHBondContact OD1-NZ 2.94Å; H214-K223 PolarHBondContact N-O 3.39Å; H214-K223 PolarHBondContact ND1-O 2.92Å; H214-K223 PolarHBondContact O-N 3.41Å; P216-K223 HydrophobicContact CG-CD 4.18Å; P216-K223 HydrophobicContact CG-CG 4.31Å
224	C	89.6	Confident	84.3	Confident	19 Å²	19	65 Å²	65	13%	0.128	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145	172.9	-66.1	0	0	0	0	111.2	A92 C208 L212	A92-C224 HydrophobicContact CB-CB 3.23Å; C208-C224 HydrophobicContact CB-CB 3.81Å; C208-C224 WeakPolarHBondContact CB-SG 3.47Å; C208-C224 VanDerWaalsContact SG-CA 3.52Å; C208-C224 WeakPolarHBondContact SG-CB 3.38Å; C208-C224 CovalentContact SG-SG 2.03Å; C208-C224 PolarHBondContact SG-SG 3.12Å; L212-C224 CarbonylContact O-C 3.6Å; L212-C224 WeakPolarHBondContact O-CA 3.46Å
225	L	86.6	Confident	84	Confident	84 Å²	84	71.5 Å²	71.5	44%	0.44	39%	0.391	S	S	.	.			trans	-95.2	127.5	175.6	-73.7	172.2	0	0	0	109.9	L212 H214	L212-L225 WeakPolarHBondContact O-CB 3.45Å; L212-L225 PolarHBondContact O-N 2.88Å; H214-L225 HydrophobicContact CB-CD1 4.02Å; H214-L225 HydrophobicContact CB-CD2 4.41Å; H214-L225 HydrophobicContact CB-CG 4.15Å; H214-L225 WeakPolarHBondContact CE1-CD2 3.29Å; H214-L225 VanDerWaalsContact ND1-CD2 3.27Å; H214-L225 WeakPolarHBondContact ND1-CD2 3.27Å; H214-L225 WeakPolarHBondContact ND1-CG 3.42Å
226	G	83.1	Confident	83.8	Confident	59 Å²	59	66.6 Å²	66.6	61%	0.608	37%	0.366	S	S	*	.	S	Bend	trans	75.4	-179.3	179.3	0	0	0	0	0	113.4	A92	A92-G226 WeakPolarHBondContact CA-O 3.38Å; A92-G226 WeakPolarHBondContact CB-O 3.27Å
227	Q	84.7	Confident	84	Confident	80 Å²	80	66.1 Å²	66.1	37%	0.374	36%	0.363	S	S	.	.			trans	-120.2	118.5	-177	-175.4	176.5	3.4	0	0	109.7	L87 C91 A94	L87-Q227 VanDerWaalsContact CD1-NE2 3.33Å; C91-Q227 WeakPolarHBondContact O-CG 3.38Å; A94-Q227 HydrophobicContact CB-CG 4.26Å
228	R	86.4	Confident	84.4	Confident	62 Å²	62	60 Å²	60	23%	0.234	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	129.5	175.3	-63.8	173.6	66.3	-162.5	7.5	108.9	A92 L93 A94 S207 R241	A92-R228 WeakPolarHBondContact O-CB 3.38Å; A92-R228 PolarHBondContact O-N 2.85Å; L93-R228 HydrophobicContact CD1-CB 4.27Å; A94-R228 PolarHBondContact N-O 2.03Å; S207-R228 PolarHBondContact O-NH1 2.9Å; R228-R241 VanDerWaalsContact CZ-O 3.22Å; R228-R241 PolarHBondContact NH1-O 2.89Å; R228-R241 PolarHBondContact NH2-O 2.76Å
229	K	84.6	Confident	84.9	Confident	103 Å²	103	58.9 Å²	58.9	45%	0.448	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.2	177.1	-61	-171.4	177.4	-153.8	0	109.4	A94 E103 F231	A94-K229 HydrophobicContact CB-CG 4.36Å; A94-K229 WeakPolarHBondContact O-CA 3.43Å; E103-K229 WeakPolarHBondContact OE1-CE 3.48Å; E103-K229 IonicContact OE1-NZ 3.98Å; E103-K229 PolarHBondContact OE1-NZ 3.44Å; E103-K229 WeakPolarHBondContact OE2-CD 3.21Å; E103-K229 VanDerWaalsContact OE2-CE 3.26Å; E103-K229 WeakPolarHBondContact OE2-CE 3.03Å; E103-K229 IonicContact OE2-NZ 3.99Å; E103-K229 PolarHBondContact OE2-NZ 3.33Å; K229-F231 HydrophobicContact CB-CE2 4.07Å; K229-F231 HydrophobicContact CB-CZ 4.14Å
230	V	82.5	Confident	85.1	Confident	26 Å²	26	54.9 Å²	54.9	16%	0.158	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.1	-179.5	-176.1	0	0	0	0	109	L93 A94 V95 K96 L233 L239	L93-V230 HydrophobicContact CD1-CG2 3.64Å; A94-V230 PolarHBondContact O-N 2.82Å; V95-V230 HydrophobicContact CG1-CB 4.46Å; K96-V230 PolarHBondContact N-O 3.4Å; K96-V230 VanDerWaalsContact N-O 3.13Å; V230-L233 HydrophobicContact CG1-CB 4.39Å; V230-L233 HydrophobicContact CG1-CD1 4.09Å; V230-L239 HydrophobicContact CG1-CD2 4.45Å; V230-L239 HydrophobicContact CG2-CD2 3.46Å; V230-L239 VanDerWaalsContact CG2-CD2 3.46Å
231	F	78.1	Confident	85.2	Confident	120 Å²	120	58.1 Å²	58.1	53%	0.526	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	141.5	179.7	-55.2	-82.9	0	0	0	108.8	K96 K229 L233	K96-F231 HydrophobicContact CB-CD1 3.89Å; K96-F231 HydrophobicContact CB-CE1 3.94Å; K96-F231 HydrophobicContact CD-CD1 4.31Å; K96-F231 HydrophobicContact CD-CE1 3.95Å; K96-F231 HydrophobicContact CG-CD1 4.48Å; K96-F231 HydrophobicContact CG-CE1 4.48Å; K229-F231 HydrophobicContact CB-CE2 4.07Å; K229-F231 HydrophobicContact CB-CZ 4.14Å; F231-L233 PolarHBondContact O-N 2.69Å
232	D	72.6	Confident	85	Confident	91 Å²	91	61.2 Å²	61.2	49%	0.487	32%	0.319	S	S	.	.			trans	51.8	46.9	167.1	-56.2	-25.5	0	0	0	114.8	R98	R98-D232 VanDerWaalsContact CB-OD1 3.29Å; R98-D232 WeakPolarHBondContact CB-OD1 3.44Å; R98-D232 PolarHBondContact N-OD1 3.49Å
233	L	78.4	Confident	84.9	Confident	36 Å²	36	63.9 Å²	63.9	19%	0.188	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-65.9	133.6	172.4	-159.3	75.1	0	0	0	109.2	V230 F231 S237 L239 V244	V230-L233 HydrophobicContact CG1-CB 4.39Å; V230-L233 HydrophobicContact CG1-CD1 4.09Å; F231-L233 PolarHBondContact O-N 2.69Å; L233-S237 WeakPolarHBondContact CD2-O 3.35Å; L233-L239 HydrophobicContact CD1-CB 4.31Å; L233-L239 HydrophobicContact CD2-CB 4.31Å; L233-V244 HydrophobicContact CD1-CG1 4.22Å; L233-V244 HydrophobicContact CD1-CG2 4.14Å
234	P	81.3	Confident	84.9	Confident	78 Å²	78	63.8 Å²	63.8	51%	0.506	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-54.3	144.6	179.4	-24.3	32.2	0	0	0	112.2	G236 S237	P234-G236 PolarHBondContact O-N 3.47Å; P234-S237 WeakPolarHBondContact O-CB 3.48Å; P234-S237 PolarHBondContact O-N 2.8Å
235	F	80.5	Confident	84.9	Confident	211 Å²	211	65.7 Å²	65.7	93%	0.925	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	124	-173.2	-171.6	-91.4	0	0	0	111.2	S237	F235-S237 VanDerWaalsContact C-N 3.26Å; F235-S237 PolarHBondContact O-N 3.31Å
236	G	83.6	Confident	85.1	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.01	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-14.4	-179.6	0	0	0	0	0	115	P234 N247 S264	P234-G236 PolarHBondContact O-N 3.47Å; G236-N247 WeakPolarHBondContact O-CB 3.43Å; G236-S264 WeakPolarHBondContact CA-OG 3.46Å; G236-S264 PolarHBondContact N-OG 3.22Å; G236-S264 PolarHBondContact O-N 3.45Å
237	S	90.3	Very high	85.6	Confident	8 Å²	8	68.2 Å²	68.2	6%	0.056	34%	0.342	C	S	.	.			trans	-74.1	151.1	178.5	-59.4	0	0	0	0	112	L233 P234 F235 Y245 S264	L233-S237 WeakPolarHBondContact CD2-O 3.35Å; P234-S237 WeakPolarHBondContact O-CB 3.48Å; P234-S237 PolarHBondContact O-N 2.8Å; F235-S237 VanDerWaalsContact C-N 3.26Å; F235-S237 PolarHBondContact O-N 3.31Å; S237-Y245 CarbonylContact C-O 3.46Å; S237-Y245 VanDerWaalsContact CA-O 3.23Å; S237-Y245 WeakPolarHBondContact CA-O 3.38Å; S237-Y245 WeakPolarHBondContact CB-O 2.97Å; S237-S264 WeakPolarHBondContact O-CA 3.41Å
238	C	91.1	Very high	85.9	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.014	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131	-179.1	-52.5	0	0	0	0	110.7	V244 Y245 C261 T265 V266	C238-V244 WeakPolarHBondContact O-CA 3.23Å; C238-Y245 PolarHBondContact N-O 3.22Å; C238-Y245 PolarHBondContact O-N 3.32Å; C238-C261 HydrophobicContact CB-CB 3.72Å; C238-C261 WeakPolarHBondContact CB-SG 3.22Å; C238-C261 PolarHBondContact N-SG 3.09Å; C238-C261 WeakPolarHBondContact SG-CA 3.21Å; C238-C261 WeakPolarHBondContact SG-CB 3.47Å; C238-C261 CovalentContact SG-SG 2.03Å; C238-C261 PolarHBondContact SG-SG 2.77Å; C238-T265 VanDerWaalsContact SG-C 3.54Å; C238-T265 PolarHBondContact SG-N 3.19Å; C238-T265 VanDerWaalsContact SG-N 3.38Å; C238-T265 PolarHBondContact SG-O 2.88Å; C238-V266 HydrophobicContact CB-CG2 3.56Å
239	L	89.3	Confident	86.2	Confident	25 Å²	25	65.5 Å²	65.5	13%	0.131	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	122.5	166.5	179.7	69.9	0	0	0	109	L93 S207 V230 L233 V244	L93-L239 HydrophobicContact CD1-CD2 4.21Å; S207-L239 PolarHBondContact OG-O 3.28Å; V230-L239 HydrophobicContact CG1-CD2 4.45Å; V230-L239 HydrophobicContact CG2-CD2 3.46Å; V230-L239 VanDerWaalsContact CG2-CD2 3.46Å; L233-L239 HydrophobicContact CD1-CB 4.31Å; L233-L239 HydrophobicContact CD2-CB 4.31Å; L239-V244 HydrophobicContact CD1-CG2 4.02Å
240	F	90.9	Very high	86.6	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	123.7	174.6	-171	-107.6	0	0	0	110.3	V137 I205 S242 D243 Y245 F251 Y253 V266	V137-F240 HydrophobicContact CG1-CE2 4.41Å; V137-F240 HydrophobicContact CG2-CD2 3.97Å; V137-F240 HydrophobicContact CG2-CE2 4.02Å; I205-F240 HydrophobicContact CG2-CE2 3.77Å; I205-F240 HydrophobicContact CG2-CZ 3.67Å; F240-S242 PolarHBondContact O-N 2.87Å; F240-D243 PolarHBondContact N-O 2.68Å; F240-D243 PolarHBondContact O-N 3.39Å; F240-Y245 HydrophobicContact CB-CD2 3.92Å; F240-Y245 HydrophobicContact CB-CE2 3.85Å; F240-Y245 HydrophobicContact CD1-CE2 4.38Å; F240-F251 HydrophobicContact CB-CZ 4.14Å; F240-F251 AromaticContact CD1-CE2 3.46Å; F240-F251 HydrophobicContact CD1-CE2 3.46Å; F240-F251 VanDerWaalsContact CD1-CE2 3.46Å; F240-F251 AromaticContact CD1-CZ 3.54Å; F240-F251 HydrophobicContact CD1-CZ 3.54Å; F240-F251 AromaticContact CE1-CE2 3.63Å; F240-F251 HydrophobicContact CE1-CE2 3.63Å; F240-F251 HydrophobicContact CE1-CZ 4.09Å; F240-F251 HydrophobicContact CG-CE2 4.2Å; F240-F251 AromaticContact CG-CZ 3.82Å; F240-F251 HydrophobicContact CG-CZ 3.82Å; F240-F251 HydrophobicContact CZ-CE2 4.48Å; F240-Y253 AromaticContact CE1-CD2 3.77Å; F240-Y253 HydrophobicContact CE1-CD2 3.77Å; F240-Y253 HydrophobicContact CE1-CE2 4.3Å; F240-Y253 AromaticContact CZ-CD2 3.52Å; F240-Y253 HydrophobicContact CZ-CD2 3.52Å; F240-Y253 AromaticContact CZ-CE2 3.82Å; F240-Y253 HydrophobicContact CZ-CE2 3.82Å; F240-V266 HydrophobicContact CB-CG2 4Å; F240-V266 HydrophobicContact CD2-CB 4.38Å; F240-V266 HydrophobicContact CD2-CG1 4.11Å; F240-V266 HydrophobicContact CD2-CG2 4.08Å; F240-V266 HydrophobicContact CE2-CG1 4.49Å; F240-V266 HydrophobicContact CG-CG2 4.34Å
241	R	87.2	Confident	87.1	Confident	84 Å²	84	65 Å²	65	32%	0.317	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-108.5	-169.8	-59.7	174.8	176.4	179.9	1.1	110.3	S207 R228	S207-R241 WeakPolarHBondContact O-CA 3.35Å; S207-R241 PolarHBondContact O-N 3.48Å; R228-R241 VanDerWaalsContact CZ-O 3.22Å; R228-R241 PolarHBondContact NH1-O 2.89Å; R228-R241 PolarHBondContact NH2-O 2.76Å
242	S	84.4	Confident	87.6	Confident	82 Å²	82	65.4 Å²	65.4	57%	0.573	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-4.2	-179.7	-60.5	0	0	0	0	112.9	F240	F240-S242 PolarHBondContact O-N 2.87Å
243	D	87.6	Confident	88.2	Confident	89 Å²	89	65 Å²	65	48%	0.476	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.8	-168.2	-55.3	-62.6	0	0	0	110.9	F240 Y245	F240-D243 PolarHBondContact N-O 2.68Å; F240-D243 PolarHBondContact O-N 3.39Å; D243-Y245 HydrophobicContact CB-CD2 4.41Å; D243-Y245 HydrophobicContact CB-CE2 3.76Å
244	V	89.9	Confident	88.4	Confident	78 Å²	78	66.1 Å²	66.1	47%	0.473	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.5	175.3	-178	0	0	0	0	108.1	L233 C238 L239	L233-V244 HydrophobicContact CD1-CG1 4.22Å; L233-V244 HydrophobicContact CD1-CG2 4.14Å; C238-V244 WeakPolarHBondContact O-CA 3.23Å; L239-V244 HydrophobicContact CD1-CG2 4.02Å
245	Y	90.8	Very high	88.2	Confident	58 Å²	58	70.1 Å²	70.1	23%	0.227	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.5	-177.6	-73.5	-84.7	0	0	0	109.8	S237 C238 F240 D243 S249 F251	S237-Y245 CarbonylContact C-O 3.46Å; S237-Y245 VanDerWaalsContact CA-O 3.23Å; S237-Y245 WeakPolarHBondContact CA-O 3.38Å; S237-Y245 WeakPolarHBondContact CB-O 2.97Å; C238-Y245 PolarHBondContact N-O 3.22Å; C238-Y245 PolarHBondContact O-N 3.32Å; F240-Y245 HydrophobicContact CB-CD2 3.92Å; F240-Y245 HydrophobicContact CB-CE2 3.85Å; F240-Y245 HydrophobicContact CD1-CE2 4.38Å; D243-Y245 HydrophobicContact CB-CD2 4.41Å; D243-Y245 HydrophobicContact CB-CE2 3.76Å; Y245-S249 WeakPolarHBondContact CB-OG 3.47Å; Y245-F251 AromaticContact CD1-CD1 3.45Å; Y245-F251 HydrophobicContact CD1-CD1 3.45Å; Y245-F251 VanDerWaalsContact CD1-CD1 3.45Å; Y245-F251 AromaticContact CD1-CE1 3.76Å; Y245-F251 HydrophobicContact CD1-CE1 3.76Å; Y245-F251 HydrophobicContact CD1-CG 4.27Å; Y245-F251 HydrophobicContact CD2-CD1 4.35Å; Y245-F251 AromaticContact CD2-CE1 3.85Å; Y245-F251 HydrophobicContact CD2-CE1 3.85Å; Y245-F251 HydrophobicContact CD2-CZ 4.29Å; Y245-F251 HydrophobicContact CE1-CB 3.96Å; Y245-F251 AromaticContact CE1-CD1 3.29Å; Y245-F251 HydrophobicContact CE1-CD1 3.29Å; Y245-F251 HydrophobicContact CE1-CD2 4.41Å; Y245-F251 AromaticContact CE1-CE1 3.81Å; Y245-F251 HydrophobicContact CE1-CE1 3.81Å; Y245-F251 AromaticContact CE1-CG 3.64Å; Y245-F251 HydrophobicContact CE1-CG 3.64Å; Y245-F251 HydrophobicContact CE2-CD1 4.21Å; Y245-F251 AromaticContact CE2-CE1 3.89Å; Y245-F251 HydrophobicContact CE2-CE1 3.89Å; Y245-F251 HydrophobicContact CE2-CE2 4.49Å; Y245-F251 HydrophobicContact CE2-CZ 4.04Å; Y245-F251 AromaticContact CG-CD1 3.99Å; Y245-F251 HydrophobicContact CG-CD1 3.99Å; Y245-F251 AromaticContact CG-CE1 3.77Å; Y245-F251 HydrophobicContact CG-CE1 3.77Å; Y245-F251 AromaticContact CZ-CD1 3.7Å; Y245-F251 AromaticContact CZ-CE1 3.86Å; Y245-F251 AromaticContact CZ-CG 3.85Å
246	D	90.8	Very high	88.1	Confident	117 Å²	117	61.5 Å²	61.5	63%	0.626	34%	0.344	S	S	*	.			trans	-69.1	153.4	175.7	-64.2	-39.6	0	0	0	111.5	G248 S249 C261	D246-G248 PolarHBondContact O-N 2.95Å; D246-S249 PolarHBondContact N-OG 2.97Å; D246-S249 VanDerWaalsContact O-CB 3.28Å; D246-S249 WeakPolarHBondContact O-CB 3.32Å; D246-S249 PolarHBondContact O-N 2.83Å; D246-S249 PolarHBondContact O-OG 2.9Å; D246-C261 WeakPolarHBondContact O-CB 3.39Å
247	N	92.5	Very high	88.2	Confident	80 Å²	80	61.5 Å²	61.5	43%	0.428	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	130.5	178.1	-165.4	14.5	0	0	0	110.7	G236 S249 R262 D263	G236-N247 WeakPolarHBondContact O-CB 3.43Å; N247-S249 VanDerWaalsContact C-N 3.33Å; N247-R262 WeakPolarHBondContact OD1-CA 3.49Å; N247-D263 PolarHBondContact ND2-OD1 3.43Å; N247-D263 PolarHBondContact OD1-N 3.31Å
248	G	90.8	Very high	88.3	Confident	49 Å²	49	63.3 Å²	63.3	51%	0.505	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-11.8	-176.7	0	0	0	0	0	115.1	D246 C261	D246-G248 PolarHBondContact O-N 2.95Å; G248-C261 WeakPolarHBondContact CA-O 3.46Å; G248-C261 PolarHBondContact N-O 2.82Å
249	S	92.9	Very high	88.5	Confident	36 Å²	36	63.2 Å²	63.2	25%	0.252	36%	0.359	S	S	.	.			trans	-65.7	141.1	177	64.3	0	0	0	0	111.7	Y245 D246 N247 T260 C261	Y245-S249 WeakPolarHBondContact CB-OG 3.47Å; D246-S249 PolarHBondContact N-OG 2.97Å; D246-S249 VanDerWaalsContact O-CB 3.28Å; D246-S249 WeakPolarHBondContact O-CB 3.32Å; D246-S249 PolarHBondContact O-N 2.83Å; D246-S249 PolarHBondContact O-OG 2.9Å; N247-S249 VanDerWaalsContact C-N 3.33Å; S249-T260 CarbonylContact O-C 3.51Å; S249-T260 WeakPolarHBondContact O-CA 2.98Å; S249-C261 PolarHBondContact O-N 2.8Å
250	S	93.8	Very high	88.8	Confident	88 Å²	88	63.5 Å²	63.5	62%	0.615	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.5	178.4	-62.8	0	0	0	0	110.6	C259 T260	S250-C259 CarbonylContact C-O 3.57Å; S250-C259 VanDerWaalsContact CA-O 3.31Å; S250-C259 WeakPolarHBondContact CA-O 3.44Å; S250-T260 WeakPolarHBondContact OG-CG2 3.08Å; S250-T260 PolarHBondContact OG-OG1 2.78Å
251	F	93.1	Very high	89	Confident	29 Å²	29	63.4 Å²	63.4	13%	0.127	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	158.9	-178.7	59.6	-89.7	0	0	0	110.6	F240 Y245 C259 V266	F240-F251 HydrophobicContact CB-CZ 4.14Å; F240-F251 AromaticContact CD1-CE2 3.46Å; F240-F251 HydrophobicContact CD1-CE2 3.46Å; F240-F251 VanDerWaalsContact CD1-CE2 3.46Å; F240-F251 AromaticContact CD1-CZ 3.54Å; F240-F251 HydrophobicContact CD1-CZ 3.54Å; F240-F251 AromaticContact CE1-CE2 3.63Å; F240-F251 HydrophobicContact CE1-CE2 3.63Å; F240-F251 HydrophobicContact CE1-CZ 4.09Å; F240-F251 HydrophobicContact CG-CE2 4.2Å; F240-F251 AromaticContact CG-CZ 3.82Å; F240-F251 HydrophobicContact CG-CZ 3.82Å; F240-F251 HydrophobicContact CZ-CE2 4.48Å; Y245-F251 AromaticContact CD1-CD1 3.45Å; Y245-F251 HydrophobicContact CD1-CD1 3.45Å; Y245-F251 VanDerWaalsContact CD1-CD1 3.45Å; Y245-F251 AromaticContact CD1-CE1 3.76Å; Y245-F251 HydrophobicContact CD1-CE1 3.76Å; Y245-F251 HydrophobicContact CD1-CG 4.27Å; Y245-F251 HydrophobicContact CD2-CD1 4.35Å; Y245-F251 AromaticContact CD2-CE1 3.85Å; Y245-F251 HydrophobicContact CD2-CE1 3.85Å; Y245-F251 HydrophobicContact CD2-CZ 4.29Å; Y245-F251 HydrophobicContact CE1-CB 3.96Å; Y245-F251 AromaticContact CE1-CD1 3.29Å; Y245-F251 HydrophobicContact CE1-CD1 3.29Å; Y245-F251 HydrophobicContact CE1-CD2 4.41Å; Y245-F251 AromaticContact CE1-CE1 3.81Å; Y245-F251 HydrophobicContact CE1-CE1 3.81Å; Y245-F251 AromaticContact CE1-CG 3.64Å; Y245-F251 HydrophobicContact CE1-CG 3.64Å; Y245-F251 HydrophobicContact CE2-CD1 4.21Å; Y245-F251 AromaticContact CE2-CE1 3.89Å; Y245-F251 HydrophobicContact CE2-CE1 3.89Å; Y245-F251 HydrophobicContact CE2-CE2 4.49Å; Y245-F251 HydrophobicContact CE2-CZ 4.04Å; Y245-F251 AromaticContact CG-CD1 3.99Å; Y245-F251 HydrophobicContact CG-CD1 3.99Å; Y245-F251 AromaticContact CG-CE1 3.77Å; Y245-F251 HydrophobicContact CG-CE1 3.77Å; Y245-F251 AromaticContact CZ-CD1 3.7Å; Y245-F251 AromaticContact CZ-CE1 3.86Å; Y245-F251 AromaticContact CZ-CG 3.85Å; F251-C259 HydrophobicContact CD1-CB 4.5Å; F251-C259 HydrophobicContact CD2-CB 3.98Å; F251-C259 HydrophobicContact CE1-CB 4.06Å; F251-C259 HydrophobicContact CE2-CB 3.47Å; F251-C259 VanDerWaalsContact CE2-CB 3.47Å; F251-C259 HydrophobicContact CG-CB 4.47Å; F251-C259 HydrophobicContact CZ-CB 3.53Å; F251-C259 PolarHBondContact N-O 3.48Å; F251-C259 PolarHBondContact O-N 3.31Å; F251-C259 VanDerWaalsContact O-O 3.07Å; F251-V266 HydrophobicContact CE1-CG1 4.36Å; F251-V266 HydrophobicContact CZ-CG1 3.81Å
252	L	88.3	Confident	89.3	Confident	130 Å²	130	66.9 Å²	66.9	68%	0.681	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	124.8	175.7	-65	175	0	0	0	109.4	A258	L252-A258 HydrophobicContact CD2-CB 4.06Å
253	Y	84.6	Confident	89.5	Confident	82 Å²	82	67.7 Å²	67.7	32%	0.322	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-42.8	172.3	171.8	-92.7	0	0	0	110.9	I205 F240 T257	I205-Y253 HydrophobicContact CG2-CD2 3.95Å; I205-Y253 HydrophobicContact CG2-CE2 3.68Å; F240-Y253 AromaticContact CE1-CD2 3.77Å; F240-Y253 HydrophobicContact CE1-CD2 3.77Å; F240-Y253 HydrophobicContact CE1-CE2 4.3Å; F240-Y253 AromaticContact CZ-CD2 3.52Å; F240-Y253 HydrophobicContact CZ-CD2 3.52Å; F240-Y253 AromaticContact CZ-CE2 3.82Å; F240-Y253 HydrophobicContact CZ-CE2 3.82Å; Y253-T257 HydrophobicContact CD1-CG2 4.26Å; Y253-T257 HydrophobicContact CG-CG2 4.43Å; Y253-T257 PolarHBondContact N-O 3.24Å
254	D	82.9	Confident	89.6	Confident	60 Å²	60	64.9 Å²	64.9	32%	0.321	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	-176.9	170.5	61.7	32.8	0	0	0	108.9	C256 T257	D254-C256 PolarHBondContact O-N 2.93Å; D254-C256 VanDerWaalsContact OD1-C 3.32Å; D254-C256 VanDerWaalsContact OD1-CA 3.31Å; D254-C256 WeakPolarHBondContact OD1-CA 3.4Å; D254-C256 WeakPolarHBondContact OD1-CB 3.48Å; D254-C256 PolarHBondContact OD1-N 3.45Å; D254-T257 PolarHBondContact O-N 2.86Å; D254-T257 WeakPolarHBondContact OD1-CB 3.46Å; D254-T257 PolarHBondContact OD1-N 3.45Å; D254-T257 PolarHBondContact OD1-OG1 3.12Å; D254-T257 PolarHBondContact OD2-OG1 3.32Å
255	N	76.1	Confident	89.7	Confident	162 Å²	162	61.2 Å²	61.2	87%	0.866	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-10.9	-179.3	-69.3	-6.2	0	0	0	114.2	C285	N255-C285 PolarHBondContact O-SG 3.09Å
256	C	78.3	Confident	89.9	Confident	29 Å²	29	58.5 Å²	58.5	20%	0.196	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-5.2	-170.2	-57.4	0	0	0	0	113.5	D254 K271 C285	D254-C256 PolarHBondContact O-N 2.93Å; D254-C256 VanDerWaalsContact OD1-C 3.32Å; D254-C256 VanDerWaalsContact OD1-CA 3.31Å; D254-C256 WeakPolarHBondContact OD1-CA 3.4Å; D254-C256 WeakPolarHBondContact OD1-CB 3.48Å; D254-C256 PolarHBondContact OD1-N 3.45Å; C256-K271 PolarHBondContact O-N 3.14Å; C256-C285 WeakPolarHBondContact CA-SG 3.48Å; C256-C285 HydrophobicContact CB-CB 3.41Å; C256-C285 VanDerWaalsContact CB-CB 3.41Å; C256-C285 WeakPolarHBondContact CB-SG 3.32Å; C256-C285 WeakPolarHBondContact SG-CA 3.33Å; C256-C285 WeakPolarHBondContact SG-CB 3.37Å; C256-C285 CovalentContact SG-SG 2.02Å; C256-C285 PolarHBondContact SG-SG 3.48Å
257	T	87.1	Confident	90.2	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	111.3	-169	-50.3	0	0	0	0	108.9	I205 Y253 D254 C268 K269	I205-T257 HydrophobicContact CD1-CG2 3.45Å; I205-T257 VanDerWaalsContact CD1-CG2 3.45Å; Y253-T257 HydrophobicContact CD1-CG2 4.26Å; Y253-T257 HydrophobicContact CG-CG2 4.43Å; Y253-T257 PolarHBondContact N-O 3.24Å; D254-T257 PolarHBondContact O-N 2.86Å; D254-T257 WeakPolarHBondContact OD1-CB 3.46Å; D254-T257 PolarHBondContact OD1-N 3.45Å; D254-T257 PolarHBondContact OD1-OG1 3.12Å; D254-T257 PolarHBondContact OD2-OG1 3.32Å; T257-C268 HydrophobicContact CG2-CB 4.08Å; T257-K269 WeakPolarHBondContact CA-O 3.2Å
258	A	92.3	Very high	90.2	Very high	45 Å²	45	49.6 Å²	49.6	37%	0.372	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.6	173.3	0	0	0	0	0	109.2	L252 C268 K269	L252-A258 HydrophobicContact CD2-CB 4.06Å; A258-C268 CarbonylContact O-C 3.51Å; A258-C268 WeakPolarHBondContact O-CA 3.41Å; A258-K269 PolarHBondContact N-O 3.12Å; A258-K269 VanDerWaalsContact N-O 3.11Å; A258-K269 PolarHBondContact O-N 3.27Å
259	C	94.7	Very high	90.2	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.2	179.1	-60.3	0	0	0	0	110.4	S250 F251 V266 V267 C268	S250-C259 CarbonylContact C-O 3.57Å; S250-C259 VanDerWaalsContact CA-O 3.31Å; S250-C259 WeakPolarHBondContact CA-O 3.44Å; F251-C259 HydrophobicContact CD1-CB 4.5Å; F251-C259 HydrophobicContact CD2-CB 3.98Å; F251-C259 HydrophobicContact CE1-CB 4.06Å; F251-C259 HydrophobicContact CE2-CB 3.47Å; F251-C259 VanDerWaalsContact CE2-CB 3.47Å; F251-C259 HydrophobicContact CG-CB 4.47Å; F251-C259 HydrophobicContact CZ-CB 3.53Å; F251-C259 PolarHBondContact N-O 3.48Å; F251-C259 PolarHBondContact O-N 3.31Å; F251-C259 VanDerWaalsContact O-O 3.07Å; C259-V266 HydrophobicContact CB-CG1 3.88Å; C259-V267 CarbonylContact C-O 3.53Å; C259-V267 VanDerWaalsContact CA-O 3.3Å; C259-V267 WeakPolarHBondContact CA-O 3.31Å; C259-C268 HydrophobicContact CB-CB 4.12Å; C259-C268 WeakPolarHBondContact CB-SG 2.96Å; C259-C268 WeakPolarHBondContact SG-CB 3.47Å; C259-C268 CovalentContact SG-SG 2.04Å; C259-C268 PolarHBondContact SG-SG 3.07Å
260	T	95.4	Very high	89.9	Confident	32 Å²	32	53 Å²	53	20%	0.196	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.9	177.2	-56.3	0	0	0	0	109.3	S249 S250 R262 V267	S249-T260 CarbonylContact O-C 3.51Å; S249-T260 WeakPolarHBondContact O-CA 2.98Å; S250-T260 WeakPolarHBondContact OG-CG2 3.08Å; S250-T260 PolarHBondContact OG-OG1 2.78Å; T260-R262 HydrophobicContact CG2-CG 4.04Å; T260-V267 PolarHBondContact N-O 3.1Å; T260-V267 PolarHBondContact O-N 2.92Å
261	C	95.1	Very high	88.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122.8	169.3	176.8	0	0	0	0	109.6	C238 D246 G248 S249	C238-C261 HydrophobicContact CB-CB 3.72Å; C238-C261 WeakPolarHBondContact CB-SG 3.22Å; C238-C261 PolarHBondContact N-SG 3.09Å; C238-C261 WeakPolarHBondContact SG-CA 3.21Å; C238-C261 WeakPolarHBondContact SG-CB 3.47Å; C238-C261 CovalentContact SG-SG 2.03Å; C238-C261 PolarHBondContact SG-SG 2.77Å; D246-C261 WeakPolarHBondContact O-CB 3.39Å; G248-C261 WeakPolarHBondContact CA-O 3.46Å; G248-C261 PolarHBondContact N-O 2.82Å; S249-C261 PolarHBondContact O-N 2.8Å
262	R	93.6	Very high	87.4	Confident	156 Å²	156	56.4 Å²	56.4	59%	0.589	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	115.4	174.7	-68.2	-170	174.5	-163.3	-3.1	109.6	N247 T260 S264 T265	N247-R262 WeakPolarHBondContact OD1-CA 3.49Å; T260-R262 HydrophobicContact CG2-CG 4.04Å; R262-S264 PolarHBondContact O-N 2.94Å; R262-T265 PolarHBondContact N-O 3.39Å; R262-T265 WeakPolarHBondContact O-CA 3.41Å; R262-T265 WeakPolarHBondContact O-CB 3.32Å; R262-T265 PolarHBondContact O-N 3.05Å
263	D	88.9	Confident	85.8	Confident	99 Å²	99	53.9 Å²	53.9	53%	0.529	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	56.3	172.2	-57.4	-37.7	0	0	0	112.9	N247 T265	N247-D263 PolarHBondContact ND2-OD1 3.43Å; N247-D263 PolarHBondContact OD1-N 3.31Å; D263-T265 PolarHBondContact O-N 3.43Å
264	S	88.8	Confident	84	Confident	31 Å²	31	57.3 Å²	57.3	22%	0.217	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	17.2	-178.5	-38.4	0	0	0	0	116.1	K106 G236 S237 R262	K106-S264 VanDerWaalsContact CE-O 3.22Å; K106-S264 WeakPolarHBondContact CE-O 3.16Å; K106-S264 PolarHBondContact NZ-O 3.29Å; G236-S264 WeakPolarHBondContact CA-OG 3.46Å; G236-S264 PolarHBondContact N-OG 3.22Å; G236-S264 PolarHBondContact O-N 3.45Å; S237-S264 WeakPolarHBondContact O-CA 3.41Å; R262-S264 PolarHBondContact O-N 2.94Å
265	T	93.3	Very high	82.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.5	175.7	-56.3	0	0	0	0	110.4	C108 T109 G136 V138 C238 R262 D263	C108-T265 HydrophobicContact CB-CG2 3.73Å; T109-T265 PolarHBondContact N-OG1 3.29Å; T109-T265 WeakPolarHBondContact O-CB 3.4Å; T109-T265 PolarHBondContact O-OG1 2.87Å; G136-T265 WeakPolarHBondContact O-CA 3.23Å; V138-T265 HydrophobicContact CG2-CG2 3.72Å; C238-T265 VanDerWaalsContact SG-C 3.54Å; C238-T265 PolarHBondContact SG-N 3.19Å; C238-T265 VanDerWaalsContact SG-N 3.38Å; C238-T265 PolarHBondContact SG-O 2.88Å; R262-T265 PolarHBondContact N-O 3.39Å; R262-T265 WeakPolarHBondContact O-CA 3.41Å; R262-T265 WeakPolarHBondContact O-CB 3.32Å; R262-T265 PolarHBondContact O-N 3.05Å; D263-T265 PolarHBondContact O-N 3.43Å
266	V	95.3	Very high	80.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	118.9	174	-176.3	0	0	0	0	108.7	G136 V137 V138 C238 F240 F251 C259	G136-V266 PolarHBondContact O-N 2.99Å; V137-V266 CarbonylContact C-O 3.54Å; V137-V266 VanDerWaalsContact CA-O 3.3Å; V137-V266 WeakPolarHBondContact CA-O 3.27Å; V137-V266 HydrophobicContact CG1-CB 4.29Å; V137-V266 HydrophobicContact CG1-CG1 4.44Å; V137-V266 HydrophobicContact CG2-CB 4.21Å; V138-V266 PolarHBondContact N-O 2.94Å; C238-V266 HydrophobicContact CB-CG2 3.56Å; F240-V266 HydrophobicContact CB-CG2 4Å; F240-V266 HydrophobicContact CD2-CB 4.38Å; F240-V266 HydrophobicContact CD2-CG1 4.11Å; F240-V266 HydrophobicContact CD2-CG2 4.08Å; F240-V266 HydrophobicContact CE2-CG1 4.49Å; F240-V266 HydrophobicContact CG-CG2 4.34Å; F251-V266 HydrophobicContact CE1-CG1 4.36Å; F251-V266 HydrophobicContact CZ-CG1 3.81Å; C259-V266 HydrophobicContact CB-CG1 3.88Å
267	V	95.5	Very high	78.7	Confident	10 Å²	10	57.7 Å²	57.7	6%	0.061	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110	175.8	-177.2	0	0	0	0	108.8	Y110 V138 C259 T260	Y110-V267 HydrophobicContact CD2-CG1 4.2Å; Y110-V267 HydrophobicContact CD2-CG2 4.02Å; Y110-V267 HydrophobicContact CE2-CG1 3.78Å; Y110-V267 HydrophobicContact CE2-CG2 4.39Å; V138-V267 HydrophobicContact CB-CG2 4.41Å; C259-V267 CarbonylContact C-O 3.53Å; C259-V267 VanDerWaalsContact CA-O 3.3Å; C259-V267 WeakPolarHBondContact CA-O 3.31Å; T260-V267 PolarHBondContact N-O 3.1Å; T260-V267 PolarHBondContact O-N 2.92Å
268	C	93.8	Very high	76.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122	179.1	-67.4	0	0	0	0	110.9	V138 E140 I205 T257 A258 C259	V138-C268 PolarHBondContact O-N 3.25Å; E140-C268 PolarHBondContact N-O 3.3Å; I205-C268 HydrophobicContact CD1-CB 3.36Å; T257-C268 HydrophobicContact CG2-CB 4.08Å; A258-C268 CarbonylContact O-C 3.51Å; A258-C268 WeakPolarHBondContact O-CA 3.41Å; C259-C268 HydrophobicContact CB-CB 4.12Å; C259-C268 WeakPolarHBondContact CB-SG 2.96Å; C259-C268 WeakPolarHBondContact SG-CB 3.47Å; C259-C268 CovalentContact SG-SG 2.04Å; C259-C268 PolarHBondContact SG-SG 3.07Å
269	K	91	Very high	74.2	Confident	100 Å²	100	67 Å²	67	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.6	177.3	-59.8	-167.9	173.5	-132.4	0	109.9	E140 T257 A258	E140-K269 HydrophobicContact CB-CG 4.32Å; E140-K269 VanDerWaalsContact OE1-CD 3.27Å; E140-K269 WeakPolarHBondContact OE1-CD 3.23Å; E140-K269 WeakPolarHBondContact OE1-CE 3.26Å; E140-K269 WeakPolarHBondContact OE1-CG 3.45Å; E140-K269 IonicContact OE1-NZ 3.77Å; E140-K269 PolarHBondContact OE1-NZ 3.3Å; E140-K269 IonicContact OE2-NZ 2.9Å; T257-K269 WeakPolarHBondContact CA-O 3.2Å; A258-K269 PolarHBondContact N-O 3.12Å; A258-K269 VanDerWaalsContact N-O 3.11Å; A258-K269 PolarHBondContact O-N 3.27Å
270	K	85.4	Confident	72	Confident	56 Å²	56	76.6 Å²	76.6	24%	0.243	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	112.4	179.3	-162	171.6	-168.9	170.7	0	109.6	E140 V202	E140-K270 PolarHBondContact O-N 2.96Å; V202-K270 HydrophobicContact CG1-CD 4.21Å
271	K	71.3	Confident	69.7	Low	163 Å²	163	78.4 Å²	78.4	71%	0.709	45%	0.453	S	S	*	.			trans	-82.8	120.8	174.2	-70.1	-173.3	177.9	-176.3	0	109.2	C256 C285	C256-K271 PolarHBondContact O-N 3.14Å; K271-C285 VanDerWaalsContact O-CB 3.27Å; K271-C285 WeakPolarHBondContact O-CB 3.39Å
272	C	64.3	Low	67.2	Low	26 Å²	26	87.3 Å²	87.3	18%	0.176	49%	0.494	C	S	.	.			trans	-113.6	151.4	166.9	-72.9	0	0	0	0	110.1	R144 C286	R144-C272 PolarHBondContact NH2-SG 2.89Å; C272-C286 WeakPolarHBondContact CA-SG 3.25Å; C272-C286 HydrophobicContact CB-CB 3.88Å; C272-C286 WeakPolarHBondContact CB-SG 3.16Å; C272-C286 WeakPolarHBondContact SG-CB 3.48Å; C272-C286 CovalentContact SG-SG 2.08Å; C272-C286 PolarHBondContact SG-SG 3.32Å
273	S	53.9	Low	65.2	Low	77 Å²	77	90.1 Å²	90.1	54%	0.538	51%	0.511	S	S	.	.			trans	-71.9	139.1	172.4	-44.9	0	0	0	0	110.2	C285	S273-C285 PolarHBondContact N-O 3.46Å; S273-C285 PolarHBondContact OG-O 2.93Å
274	H	46.2	Very low	63.4	Low	155 Å²	155	87 Å²	87	72%	0.718	50%	0.503	S	S	*	.			trans	-54.4	147.4	-177.7	-84.2	-69.4	0	0	0	113.7	G276	H274-G276 PolarHBondContact O-N 2.9Å
275	P	45	Very low	61.9	Low	118 Å²	118	86.9 Å²	86.9	77%	0.766	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	113.5	168.5	17.1	-5.8	0	0	0	109.4
276	G	41.5	Very low	60.1	Low	80 Å²	80	88.8 Å²	88.8	83%	0.825	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	140	-8.4	170.3	0	0	0	0	0	117.1	H274	H274-G276 PolarHBondContact O-N 2.9Å
277	G	39.7	Very low	58	Low	61 Å²	61	97.3 Å²	97.3	63%	0.629	55%	0.554	S	S	*	*			trans	-134.5	94.7	177	0	0	0	0	0	111.5	D279	G277-D279 VanDerWaalsContact C-N 3.3Å; G277-D279 PolarHBondContact O-N 3.48Å
278	C	44.8	Very low	55.5	Low	82 Å²	82	103.4 Å²	103.4	55%	0.554	58%	0.582	S	S	*	*			trans	-84.5	75.6	168.9	-68	0	0	0	0	109.4	Q280	C278-Q280 PolarHBondContact O-N 2.95Å
279	D	40	Very low	53.1	Low	160 Å²	160	107.5 Å²	107.5	86%	0.856	61%	0.609	S	S	*	*			trans	-75.2	115.8	166.4	-102.9	-20.4	0	0	0	109.1	G277 G281	G277-D279 VanDerWaalsContact C-N 3.3Å; G277-D279 PolarHBondContact O-N 3.48Å; D279-G281 PolarHBondContact O-N 3.11Å
280	Q	48.2	Very low	50.8	Low	202 Å²	202	108.6 Å²	108.6	94%	0.944	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	95.9	172.8	-72.7	179.1	-13.5	0	0	108.9	C278	C278-Q280 PolarHBondContact O-N 2.95Å
281	G	47.7	Very low	48.5	Very low	70 Å²	70	112.1 Å²	112.1	72%	0.722	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.8	-8.8	170.6	0	0	0	0	0	121.1	D279	D279-G281 PolarHBondContact O-N 3.11Å
282	Q	43.3	Very low	47.4	Very low	186 Å²	186	112 Å²	112	87%	0.869	64%	0.635	S	S	*	*	S	Bend	trans	-135	141.2	178.8	-75	-176.8	-5.2	0	0	111.6	G284	Q282-G284 PolarHBondContact O-N 3.27Å
283	K	51.1	Low	46.1	Very low	216 Å²	216	116.3 Å²	116.3	94%	0.939	66%	0.66	S	S	*	*			trans	-54.8	85.1	174.2	-76.1	177.9	179.7	176	0	109.5
284	G	51.3	Low	45.7	Very low	34 Å²	34	117 Å²	117	35%	0.351	66%	0.663	S	S	.	*			trans	-76.4	136.3	-178.1	0	0	0	0	0	110.1	Q282	Q282-G284 PolarHBondContact O-N 3.27Å
285	C	57.2	Low	45.7	Very low	27 Å²	27	114.8 Å²	114.8	18%	0.182	66%	0.662	C	S	.	*	S	Bend	trans	-74.5	130.3	168.9	-81.8	0	0	0	0	109.9	N255 C256 K271 S273	N255-C285 PolarHBondContact O-SG 3.09Å; C256-C285 WeakPolarHBondContact CA-SG 3.48Å; C256-C285 HydrophobicContact CB-CB 3.41Å; C256-C285 VanDerWaalsContact CB-CB 3.41Å; C256-C285 WeakPolarHBondContact CB-SG 3.32Å; C256-C285 WeakPolarHBondContact SG-CA 3.33Å; C256-C285 WeakPolarHBondContact SG-CB 3.37Å; C256-C285 CovalentContact SG-SG 2.02Å; C256-C285 PolarHBondContact SG-SG 3.48Å; K271-C285 VanDerWaalsContact O-CB 3.27Å; K271-C285 WeakPolarHBondContact O-CB 3.39Å; S273-C285 PolarHBondContact N-O 3.46Å; S273-C285 PolarHBondContact OG-O 2.93Å
286	C	56.3	Low	45.8	Very low	40 Å²	40	117.6 Å²	117.6	27%	0.27	67%	0.665	S	S	.	*	S	Bend	trans	78.2	56.6	-174.3	-39.6	0	0	0	0	114	R144 C272 E288	R144-C286 VanDerWaalsContact NH2-CB 3.3Å; R144-C286 PolarHBondContact NH2-SG 3.37Å; C272-C286 WeakPolarHBondContact CA-SG 3.25Å; C272-C286 HydrophobicContact CB-CB 3.88Å; C272-C286 WeakPolarHBondContact CB-SG 3.16Å; C272-C286 WeakPolarHBondContact SG-CB 3.48Å; C272-C286 CovalentContact SG-SG 2.08Å; C272-C286 PolarHBondContact SG-SG 3.32Å; C286-E288 PolarHBondContact O-N 2.63Å; C286-E288 VanDerWaalsContact O-N 3.13Å
287	E	50.2	Low	46.3	Very low	181 Å²	181	120.4 Å²	120.4	85%	0.846	66%	0.661	S	S	*	*			trans	-65.2	108.4	164.5	-84.1	-167.5	170.2	0	0	111
288	E	44.1	Very low	46.9	Very low	138 Å²	138	121.5 Å²	121.5	65%	0.645	65%	0.652	S	S	*	*				-174.7	79.9	125.2	-139.9	178.4	-166.8	0	0	107.1	C286 L290	C286-E288 PolarHBondContact O-N 2.63Å; C286-E288 VanDerWaalsContact O-N 3.13Å; E288-L290 HydrophobicContact CG-CD2 4.22Å; E288-L290 HydrophobicContact CG-CG 4.05Å; E288-L290 PolarHBondContact O-N 3.09Å
289	C	42.3	Very low	47.6	Very low	85 Å²	85	123.4 Å²	123.4	57%	0.574	65%	0.651	S	S	*	*			trans	-71.7	88.5	162.7	-87.4	0	0	0	0	107.2	L291	C289-L291 PolarHBondContact O-N 2.92Å
290	L	42.5	Very low	49	Very low	123 Å²	123	118.5 Å²	118.5	64%	0.644	63%	0.627	S	S	*	*			trans	-73.1	66.3	163.7	-67.4	172.8	0	0	0	108.8	E288 R292	E288-L290 HydrophobicContact CG-CD2 4.22Å; E288-L290 HydrophobicContact CG-CG 4.05Å; E288-L290 PolarHBondContact O-N 3.09Å; L290-R292 VanDerWaalsContact C-N 3.28Å; L290-R292 PolarHBondContact O-N 3.32Å
291	L	37.1	Very low	50.2	Low	130 Å²	130	109 Å²	109	68%	0.681	58%	0.582	S	S	*	*			trans	-66.7	98.8	154.1	-78.3	168.9	0	0	0	105.7	C289 V293	C289-L291 PolarHBondContact O-N 2.92Å; L291-V293 VanDerWaalsContact C-N 3.35Å; L291-V293 PolarHBondContact O-N 3.23Å
292	R	49.3	Very low	51.5	Low	161 Å²	161	113.4 Å²	113.4	61%	0.608	58%	0.581	S	S	*	*			trans	-60.1	99.9	168.2	-82	178.4	170.5	153.7	-4.2	107.2	E169 L290	E169-R292 IonicContact OE1-NH2 2.68Å; E169-R292 PolarHBondContact OE1-NH2 3.18Å; L290-R292 VanDerWaalsContact C-N 3.28Å; L290-R292 PolarHBondContact O-N 3.32Å
293	V	35.9	Very low	52.7	Low	117 Å²	117	108 Å²	108	71%	0.709	56%	0.555	S	S	*	*			trans	-58.3	142.9	169.8	178.4	0	0	0	0	108.8	L291	L291-V293 VanDerWaalsContact C-N 3.35Å; L291-V293 PolarHBondContact O-N 3.23Å
294	P	47.1	Very low	53.7	Low	92 Å²	92	101.1 Å²	101.1	60%	0.597	55%	0.545	S	S	*	.			trans	-57.3	153.1	-173.8	-23	33.3	0	0	0	113.8	E296	P294-E296 PolarHBondContact O-N 3.12Å
295	P	44.7	Very low	54.6	Low	107 Å²	107	107.9 Å²	107.9	70%	0.695	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	18.6	-169.8	30.7	-35.9	0	0	0	115.8
296	E	48.2	Very low	54.7	Low	177 Å²	177	113.6 Å²	113.6	83%	0.827	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-7.7	-173	-57.2	-163.2	-153.8	0	0	114.3	P294	P294-E296 PolarHBondContact O-N 3.12Å
297	D	51.1	Low	55.5	Low	139 Å²	139	116.9 Å²	116.9	74%	0.743	61%	0.609	S	S	*	*	S	Bend	trans	-116	11.9	173.1	-86.1	-35.3	0	0	0	114.5	K299	D297-K299 VanDerWaalsContact C-N 3.32Å; D297-K299 PolarHBondContact O-N 3.44Å
298	I	52.5	Low	56.3	Low	84 Å²	84	109.7 Å²	109.7	43%	0.431	58%	0.575	S	S	.	*			trans	-76.3	87.2	178.5	-46.3	-179.8	0	0	0	109.7	V300 R309	I298-V300 HydrophobicContact CB-CG1 4.39Å; I298-V300 HydrophobicContact CG2-CG1 3.45Å; I298-V300 VanDerWaalsContact CG2-CG1 3.45Å; I298-V300 PolarHBondContact O-N 2.9Å; I298-V300 VanDerWaalsContact O-N 3.08Å; I298-R309 HydrophobicContact CG2-CG 4.32Å
299	K	60.2	Low	57.4	Low	122 Å²	122	110.1 Å²	110.1	53%	0.53	57%	0.571	S	S	.	*			trans	-67.6	105	164.9	-62.5	-169.7	-177.7	-178	0	108.4	D297 D310	D297-K299 VanDerWaalsContact C-N 3.32Å; D297-K299 PolarHBondContact O-N 3.44Å; K299-D310 PolarHBondContact O-N 2.89Å
300	V	68.8	Low	58.4	Low	58 Å²	58	110.1 Å²	110.1	35%	0.352	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	145.4	179.3	-64.4	0	0	0	0	111.6	I298 I307 F308	I298-V300 HydrophobicContact CB-CG1 4.39Å; I298-V300 HydrophobicContact CG2-CG1 3.45Å; I298-V300 VanDerWaalsContact CG2-CG1 3.45Å; I298-V300 PolarHBondContact O-N 2.9Å; I298-V300 VanDerWaalsContact O-N 3.08Å; V300-I307 HydrophobicContact CB-CG2 3.61Å; V300-I307 HydrophobicContact CG1-CG2 3.86Å; V300-I307 HydrophobicContact CG2-CG2 3.91Å; V300-F308 CarbonylContact C-O 3.58Å; V300-F308 WeakPolarHBondContact CA-O 3.47Å
301	C	73.6	Confident	59.2	Low	2 Å²	2	107 Å²	107	1%	0.014	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	129.6	170.3	-61.1	0	0	0	0	109.4	F308 W314 C324 R328	C301-F308 HydrophobicContact CB-CB 4.46Å; C301-F308 PolarHBondContact N-O 3.11Å; C301-F308 PolarHBondContact O-N 3.29Å; C301-W314 HydrophobicContact CB-CH2 4.13Å; C301-C324 HydrophobicContact CB-CB 3.64Å; C301-C324 WeakPolarHBondContact CB-SG 3.2Å; C301-C324 PolarHBondContact N-SG 3.4Å; C301-C324 WeakPolarHBondContact SG-CA 3.18Å; C301-C324 WeakPolarHBondContact SG-CB 3.02Å; C301-C324 CovalentContact SG-SG 2.03Å; C301-C324 PolarHBondContact SG-SG 3.16Å; C301-R328 PolarHBondContact SG-N 3.47Å; C301-R328 VanDerWaalsContact SG-N 3.44Å; C301-R328 PolarHBondContact SG-O 3.11Å; C301-R328 VanDerWaalsContact SG-O 3.38Å
302	K	74.1	Confident	60.3	Low	162 Å²	162	104.4 Å²	104.4	70%	0.704	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	121	171.5	-65.9	-177.4	-179.6	178.1	0	108.8
303	F	70.2	Confident	60.9	Low	73 Å²	73	102.6 Å²	102.6	32%	0.32	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	104.1	176.1	-172	-89.1	0	0	0	109.5	K306 F308 W314 T329	F303-K306 PolarHBondContact N-O 3.04Å; F303-K306 PolarHBondContact O-N 3.38Å; F303-F308 HydrophobicContact CB-CD2 3.88Å; F303-F308 HydrophobicContact CB-CE2 3.76Å; F303-F308 HydrophobicContact CD1-CE2 4.45Å; F303-W314 HydrophobicContact CB-CH2 4.48Å; F303-W314 HydrophobicContact CB-CZ2 3.54Å; F303-W314 AromaticContact CD1-CD1 3.85Å; F303-W314 AromaticContact CD1-CE2 3.92Å; F303-W314 HydrophobicContact CD1-CZ2 4.33Å; F303-W314 AromaticContact CD1-NE1 3.06Å; F303-W314 AromaticContact CD2-CZ2 3.79Å; F303-W314 HydrophobicContact CD2-CZ2 3.79Å; F303-W314 AromaticContact CD2-NE1 3.81Å; F303-W314 AromaticContact CE1-NE1 3.38Å; F303-W314 AromaticContact CG-CE2 3.7Å; F303-W314 AromaticContact CG-CZ2 3.64Å; F303-W314 HydrophobicContact CG-CZ2 3.64Å; F303-W314 AromaticContact CG-NE1 3.3Å; F303-W314 VanDerWaalsContact CG-NE1 3.3Å; F303-W314 AromaticContact CZ-NE1 3.88Å; F303-T329 HydrophobicContact CD2-CG2 4Å; F303-T329 HydrophobicContact CE2-CG2 4.41Å
304	G	71.6	Confident	62.8	Low	71 Å²	71	98 Å²	98	73%	0.732	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-135.6	-166.5	0	0	0	0	0	111.6	K306	G304-K306 VanDerWaalsContact C-N 3.26Å; G304-K306 PolarHBondContact O-N 2.98Å
305	N	70.8	Confident	63.5	Low	176 Å²	176	98.5 Å²	98.5	94%	0.941	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	6.4	175.4	-70.2	-6.2	0	0	0	113.5
306	K	57.6	Low	64.3	Low	148 Å²	148	94.7 Å²	94.7	64%	0.643	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.6	-176.1	-66	-173.7	178.7	-173.7	0	110.6	F303 G304 F308	F303-K306 PolarHBondContact N-O 3.04Å; F303-K306 PolarHBondContact O-N 3.38Å; G304-K306 VanDerWaalsContact C-N 3.26Å; G304-K306 PolarHBondContact O-N 2.98Å; K306-F308 HydrophobicContact CB-CD2 4.41Å; K306-F308 HydrophobicContact CB-CE2 3.56Å; K306-F308 HydrophobicContact CB-CZ 3.76Å; K306-F308 HydrophobicContact CD-CZ 4.2Å
307	I	74.1	Confident	64.7	Low	109 Å²	109	94.3 Å²	94.3	56%	0.559	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.6	178.7	-56.6	177.1	0	0	0	106.9	V300	V300-I307 HydrophobicContact CB-CG2 3.61Å; V300-I307 HydrophobicContact CG1-CG2 3.86Å; V300-I307 HydrophobicContact CG2-CG2 3.91Å
308	F	66.7	Low	65.3	Low	29 Å²	29	93.9 Å²	93.9	13%	0.127	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133	-179.8	-63.6	-83	0	0	0	109.4	V300 C301 F303 K306 E312 W314 C324	V300-F308 CarbonylContact C-O 3.58Å; V300-F308 WeakPolarHBondContact CA-O 3.47Å; C301-F308 HydrophobicContact CB-CB 4.46Å; C301-F308 PolarHBondContact N-O 3.11Å; C301-F308 PolarHBondContact O-N 3.29Å; F303-F308 HydrophobicContact CB-CD2 3.88Å; F303-F308 HydrophobicContact CB-CE2 3.76Å; F303-F308 HydrophobicContact CD1-CE2 4.45Å; K306-F308 HydrophobicContact CB-CD2 4.41Å; K306-F308 HydrophobicContact CB-CE2 3.56Å; K306-F308 HydrophobicContact CB-CZ 3.76Å; K306-F308 HydrophobicContact CD-CZ 4.2Å; F308-E312 VanDerWaalsContact CA-OE2 3.22Å; F308-E312 WeakPolarHBondContact CA-OE2 3.01Å; F308-E312 HydrophobicContact CB-CB 4.31Å; F308-E312 HydrophobicContact CD1-CB 4.48Å; F308-W314 HydrophobicContact CB-CE3 3.76Å; F308-W314 HydrophobicContact CB-CH2 4.07Å; F308-W314 HydrophobicContact CB-CZ3 3.46Å; F308-W314 VanDerWaalsContact CB-CZ3 3.46Å; F308-W314 HydrophobicContact CD1-CB 4.07Å; F308-W314 AromaticContact CD1-CD2 3.72Å; F308-W314 HydrophobicContact CD1-CD2 3.72Å; F308-W314 AromaticContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CG 4.04Å; F308-W314 HydrophobicContact CD1-CZ3 4.05Å; F308-W314 AromaticContact CD2-CD2 3.79Å; F308-W314 HydrophobicContact CD2-CD2 3.79Å; F308-W314 AromaticContact CD2-CE2 3.85Å; F308-W314 AromaticContact CD2-CE3 3.83Å; F308-W314 HydrophobicContact CD2-CE3 3.83Å; F308-W314 HydrophobicContact CD2-CG 4.41Å; F308-W314 HydrophobicContact CD2-CH2 4.04Å; F308-W314 AromaticContact CD2-CZ2 3.98Å; F308-W314 HydrophobicContact CD2-CZ2 3.98Å; F308-W314 AromaticContact CD2-CZ3 3.95Å; F308-W314 HydrophobicContact CD2-CZ3 3.95Å; F308-W314 HydrophobicContact CE1-CB 3.41Å; F308-W314 VanDerWaalsContact CE1-CB 3.41Å; F308-W314 AromaticContact CE1-CD2 3.72Å; F308-W314 HydrophobicContact CE1-CD2 3.72Å; F308-W314 AromaticContact CE1-CE3 3.89Å; F308-W314 HydrophobicContact CE1-CE3 3.89Å; F308-W314 AromaticContact CE1-CG 3.54Å; F308-W314 HydrophobicContact CE1-CG 3.54Å; F308-W314 AromaticContact CE2-CD2 3.8Å; F308-W314 HydrophobicContact CE2-CD2 3.8Å; F308-W314 AromaticContact CE2-CE2 3.84Å; F308-W314 HydrophobicContact CE2-CE3 4.29Å; F308-W314 AromaticContact CE2-CG 3.97Å; F308-W314 HydrophobicContact CE2-CG 3.97Å; F308-W314 HydrophobicContact CE2-CZ2 4.36Å; F308-W314 AromaticContact CG-CD2 3.74Å; F308-W314 HydrophobicContact CG-CD2 3.74Å; F308-W314 AromaticContact CG-CE3 3.35Å; F308-W314 HydrophobicContact CG-CE3 3.35Å; F308-W314 HydrophobicContact CG-CG 4.44Å; F308-W314 HydrophobicContact CG-CH2 4.08Å; F308-W314 HydrophobicContact CG-CZ2 4.4Å; F308-W314 AromaticContact CG-CZ3 3.53Å; F308-W314 HydrophobicContact CG-CZ3 3.53Å; F308-W314 HydrophobicContact CZ-CB 3.74Å; F308-W314 AromaticContact CZ-CD1 3.82Å; F308-W314 AromaticContact CZ-CD2 3.75Å; F308-W314 HydrophobicContact CZ-CD2 3.75Å; F308-W314 HydrophobicContact CZ-CE3 4.3Å; F308-W314 AromaticContact CZ-CG 3.48Å; F308-W314 HydrophobicContact CZ-CG 3.48Å; F308-W314 VanDerWaalsContact CZ-CG 3.48Å; F308-C324 HydrophobicContact CB-CB 4.4Å
309	R	66.4	Low	66	Low	148 Å²	148	92.2 Å²	92.2	56%	0.558	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	158.7	176.9	-61.7	178.4	175.6	176.8	1.4	110.9	I298 G311 E312 C324	I298-R309 HydrophobicContact CG2-CG 4.32Å; R309-G311 PolarHBondContact O-N 3.38Å; R309-E312 HydrophobicContact CB-CG 3.98Å; R309-E312 VanDerWaalsContact N-CD 3.33Å; R309-E312 PolarHBondContact N-OE2 3.31Å; R309-E312 VanDerWaalsContact O-CB 3.23Å; R309-E312 WeakPolarHBondContact O-CB 3.41Å; R309-E312 PolarHBondContact O-N 3.49Å; R309-C324 WeakPolarHBondContact O-CB 3.08Å
310	D	63.6	Low	66.7	Low	85 Å²	85	87.6 Å²	87.6	46%	0.455	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	132.7	173.5	-164.5	31.5	0	0	0	111.7	K299 E312 C324 V325 K326	K299-D310 PolarHBondContact O-N 2.89Å; D310-E312 VanDerWaalsContact C-N 3.29Å; D310-E312 PolarHBondContact O-N 2.92Å; D310-C324 VanDerWaalsContact OD1-O 3.12Å; D310-V325 WeakPolarHBondContact OD1-CA 3.28Å; D310-K326 WeakPolarHBondContact OD1-CA 3.29Å; D310-K326 PolarHBondContact OD1-N 3.24Å
311	G	60.4	Low	66.8	Low	56 Å²	56	87.2 Å²	87.2	58%	0.577	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-14.8	-172.5	0	0	0	0	0	115.7	R309 M313 C324	R309-G311 PolarHBondContact O-N 3.38Å; G311-M313 PolarHBondContact O-N 3.18Å; G311-C324 WeakPolarHBondContact CA-O 3.02Å; G311-C324 PolarHBondContact N-O 3.47Å
312	E	58.8	Low	67.1	Low	76 Å²	76	87.2 Å²	87.2	36%	0.355	47%	0.47	S	S	.	.			trans	-69.3	132.8	178.9	-73.9	-177.7	175.8	0	0	111.1	F308 R309 D310 W314 A323 C324	F308-E312 VanDerWaalsContact CA-OE2 3.22Å; F308-E312 WeakPolarHBondContact CA-OE2 3.01Å; F308-E312 HydrophobicContact CB-CB 4.31Å; F308-E312 HydrophobicContact CD1-CB 4.48Å; R309-E312 HydrophobicContact CB-CG 3.98Å; R309-E312 VanDerWaalsContact N-CD 3.33Å; R309-E312 PolarHBondContact N-OE2 3.31Å; R309-E312 VanDerWaalsContact O-CB 3.23Å; R309-E312 WeakPolarHBondContact O-CB 3.41Å; R309-E312 PolarHBondContact O-N 3.49Å; D310-E312 VanDerWaalsContact C-N 3.29Å; D310-E312 PolarHBondContact O-N 2.92Å; E312-W314 WeakPolarHBondContact O-CZ3 3.41Å; E312-A323 CarbonylContact O-C 3.55Å; E312-A323 VanDerWaalsContact O-CA 3.28Å; E312-A323 WeakPolarHBondContact O-CA 3.37Å; E312-C324 PolarHBondContact O-N 2.67Å
313	M	63.3	Low	67.3	Low	123 Å²	123	80.5 Å²	80.5	61%	0.606	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.6	175.8	-66.2	-178.5	-76.1	0	0	110.8	G311 I321 C322 A323	G311-M313 PolarHBondContact O-N 3.18Å; M313-I321 HydrophobicContact CB-CD1 4.3Å; M313-I321 HydrophobicContact CB-CG1 4.28Å; M313-I321 HydrophobicContact SD-CD1 4.07Å; M313-C322 CarbonylContact C-O 3.53Å; M313-C322 WeakPolarHBondContact CA-O 3.48Å; M313-A323 HydrophobicContact CG-CB 3.84Å
314	W	74.9	Confident	67.6	Low	21 Å²	21	77 Å²	77	8%	0.08	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.7	173.5	66.3	99.1	0	0	0	111.6	C301 F303 F308 E312 C322 C324 T329	C301-W314 HydrophobicContact CB-CH2 4.13Å; F303-W314 HydrophobicContact CB-CH2 4.48Å; F303-W314 HydrophobicContact CB-CZ2 3.54Å; F303-W314 AromaticContact CD1-CD1 3.85Å; F303-W314 AromaticContact CD1-CE2 3.92Å; F303-W314 HydrophobicContact CD1-CZ2 4.33Å; F303-W314 AromaticContact CD1-NE1 3.06Å; F303-W314 AromaticContact CD2-CZ2 3.79Å; F303-W314 HydrophobicContact CD2-CZ2 3.79Å; F303-W314 AromaticContact CD2-NE1 3.81Å; F303-W314 AromaticContact CE1-NE1 3.38Å; F303-W314 AromaticContact CG-CE2 3.7Å; F303-W314 AromaticContact CG-CZ2 3.64Å; F303-W314 HydrophobicContact CG-CZ2 3.64Å; F303-W314 AromaticContact CG-NE1 3.3Å; F303-W314 VanDerWaalsContact CG-NE1 3.3Å; F303-W314 AromaticContact CZ-NE1 3.88Å; F308-W314 HydrophobicContact CB-CE3 3.76Å; F308-W314 HydrophobicContact CB-CH2 4.07Å; F308-W314 HydrophobicContact CB-CZ3 3.46Å; F308-W314 VanDerWaalsContact CB-CZ3 3.46Å; F308-W314 HydrophobicContact CD1-CB 4.07Å; F308-W314 AromaticContact CD1-CD2 3.72Å; F308-W314 HydrophobicContact CD1-CD2 3.72Å; F308-W314 AromaticContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CG 4.04Å; F308-W314 HydrophobicContact CD1-CZ3 4.05Å; F308-W314 AromaticContact CD2-CD2 3.79Å; F308-W314 HydrophobicContact CD2-CD2 3.79Å; F308-W314 AromaticContact CD2-CE2 3.85Å; F308-W314 AromaticContact CD2-CE3 3.83Å; F308-W314 HydrophobicContact CD2-CE3 3.83Å; F308-W314 HydrophobicContact CD2-CG 4.41Å; F308-W314 HydrophobicContact CD2-CH2 4.04Å; F308-W314 AromaticContact CD2-CZ2 3.98Å; F308-W314 HydrophobicContact CD2-CZ2 3.98Å; F308-W314 AromaticContact CD2-CZ3 3.95Å; F308-W314 HydrophobicContact CD2-CZ3 3.95Å; F308-W314 HydrophobicContact CE1-CB 3.41Å; F308-W314 VanDerWaalsContact CE1-CB 3.41Å; F308-W314 AromaticContact CE1-CD2 3.72Å; F308-W314 HydrophobicContact CE1-CD2 3.72Å; F308-W314 AromaticContact CE1-CE3 3.89Å; F308-W314 HydrophobicContact CE1-CE3 3.89Å; F308-W314 AromaticContact CE1-CG 3.54Å; F308-W314 HydrophobicContact CE1-CG 3.54Å; F308-W314 AromaticContact CE2-CD2 3.8Å; F308-W314 HydrophobicContact CE2-CD2 3.8Å; F308-W314 AromaticContact CE2-CE2 3.84Å; F308-W314 HydrophobicContact CE2-CE3 4.29Å; F308-W314 AromaticContact CE2-CG 3.97Å; F308-W314 HydrophobicContact CE2-CG 3.97Å; F308-W314 HydrophobicContact CE2-CZ2 4.36Å; F308-W314 AromaticContact CG-CD2 3.74Å; F308-W314 HydrophobicContact CG-CD2 3.74Å; F308-W314 AromaticContact CG-CE3 3.35Å; F308-W314 HydrophobicContact CG-CE3 3.35Å; F308-W314 HydrophobicContact CG-CG 4.44Å; F308-W314 HydrophobicContact CG-CH2 4.08Å; F308-W314 HydrophobicContact CG-CZ2 4.4Å; F308-W314 AromaticContact CG-CZ3 3.53Å; F308-W314 HydrophobicContact CG-CZ3 3.53Å; F308-W314 HydrophobicContact CZ-CB 3.74Å; F308-W314 AromaticContact CZ-CD1 3.82Å; F308-W314 AromaticContact CZ-CD2 3.75Å; F308-W314 HydrophobicContact CZ-CD2 3.75Å; F308-W314 HydrophobicContact CZ-CE3 4.3Å; F308-W314 AromaticContact CZ-CG 3.48Å; F308-W314 HydrophobicContact CZ-CG 3.48Å; F308-W314 VanDerWaalsContact CZ-CG 3.48Å; E312-W314 WeakPolarHBondContact O-CZ3 3.41Å; W314-C322 HydrophobicContact CD2-CB 3.77Å; W314-C322 HydrophobicContact CE3-CB 4.29Å; W314-C322 HydrophobicContact CG-CB 4.28Å; W314-C322 HydrophobicContact CH2-CB 4.05Å; W314-C322 HydrophobicContact CZ2-CB 3.48Å; W314-C322 VanDerWaalsContact CZ2-CB 3.48Å; W314-C322 HydrophobicContact CZ3-CB 4.42Å; W314-C322 PolarHBondContact N-O 2.82Å; W314-C322 PolarHBondContact O-N 2.93Å; W314-C324 HydrophobicContact CH2-CB 4.38Å; W314-C324 HydrophobicContact CZ3-CB 3.98Å; W314-C324 VanDerWaalsContact CZ3-N 3.32Å; W314-T329 HydrophobicContact CH2-CG2 3.72Å; W314-T329 HydrophobicContact CZ2-CG2 3.43Å; W314-T329 VanDerWaalsContact CZ2-CG2 3.43Å
315	S	61.7	Low	68	Low	103 Å²	103	76 Å²	76	72%	0.72	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.6	169.3	57.5	0	0	0	0	109.8	T320	S315-T320 WeakPolarHBondContact CA-O 3.38Å
316	S	61.4	Low	68	Low	26 Å²	26	75 Å²	75	18%	0.182	40%	0.397	C	S	.	.			trans	-84.2	163.6	169.2	176.1	0	0	0	0	110.9	N318 C319 T320	S316-N318 PolarHBondContact O-N 3.37Å; S316-N318 VanDerWaalsContact O-N 3.11Å; S316-C319 PolarHBondContact O-N 3.33Å; S316-T320 WeakPolarHBondContact CB-OG1 3.29Å; S316-T320 PolarHBondContact N-O 3.38Å
317	I	58	Low	68.6	Low	169 Å²	169	69.4 Å²	69.4	87%	0.867	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.6	-177.4	-46.6	168.2	0	0	0	111.4
318	N	63.1	Low	68.7	Low	130 Å²	130	73.5 Å²	73.5	70%	0.695	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	37.1	-176.8	-63.8	-13.9	0	0	0	113.8	S316 T320	S316-N318 PolarHBondContact O-N 3.37Å; S316-N318 VanDerWaalsContact O-N 3.11Å; N318-T320 PolarHBondContact O-N 3.03Å
319	C	67.1	Low	69.4	Low	49 Å²	49	74.8 Å²	74.8	33%	0.331	40%	0.4	S	S	.	.	S	Bend	trans	60.8	21.1	174.2	-127.8	0	0	0	0	115.4	S316 K334 C353	S316-C319 PolarHBondContact O-N 3.33Å; C319-K334 WeakPolarHBondContact O-CB 3.39Å; C319-K334 PolarHBondContact O-N 2.85Å; C319-C353 WeakPolarHBondContact CA-SG 3.49Å; C319-C353 HydrophobicContact CB-CB 4.13Å; C319-C353 WeakPolarHBondContact CB-SG 3.38Å; C319-C353 VanDerWaalsContact SG-C 3.55Å; C319-C353 WeakPolarHBondContact SG-CA 3.35Å; C319-C353 WeakPolarHBondContact SG-CB 3.09Å; C319-C353 PolarHBondContact SG-O 3.15Å; C319-C353 CovalentContact SG-SG 2.04Å; C319-C353 PolarHBondContact SG-SG 3.02Å
320	T	73.9	Confident	70.2	Confident	26 Å²	26	73 Å²	73	16%	0.16	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.7	177.2	31.9	0	0	0	0	108.9	S315 S316 N318 R332 N333	S315-T320 WeakPolarHBondContact CA-O 3.38Å; S316-T320 WeakPolarHBondContact CB-OG1 3.29Å; S316-T320 PolarHBondContact N-O 3.38Å; N318-T320 PolarHBondContact O-N 3.03Å; T320-R332 CarbonylContact C-O 3.59Å; T320-R332 VanDerWaalsContact CA-O 3.3Å; T320-R332 WeakPolarHBondContact CA-O 3.4Å; T320-N333 WeakPolarHBondContact CG2-OD1 3.36Å
321	I	70.6	Confident	71	Confident	50 Å²	50	72.1 Å²	72.1	26%	0.256	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117	164.8	-171.2	167.5	0	0	0	107.1	M313 C331 R332	M313-I321 HydrophobicContact CB-CD1 4.3Å; M313-I321 HydrophobicContact CB-CG1 4.28Å; M313-I321 HydrophobicContact SD-CD1 4.07Å; I321-C331 WeakPolarHBondContact O-CA 3.22Å; I321-R332 HydrophobicContact CG2-CG 3.52Å; I321-R332 PolarHBondContact N-O 3.19Å; I321-R332 PolarHBondContact O-N 2.57Å
322	C	79.9	Confident	71.7	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.007	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	142.7	177	-59.6	0	0	0	0	108.7	M313 W314 T329 E330 C331	M313-C322 CarbonylContact C-O 3.53Å; M313-C322 WeakPolarHBondContact CA-O 3.48Å; W314-C322 HydrophobicContact CD2-CB 3.77Å; W314-C322 HydrophobicContact CE3-CB 4.29Å; W314-C322 HydrophobicContact CG-CB 4.28Å; W314-C322 HydrophobicContact CH2-CB 4.05Å; W314-C322 HydrophobicContact CZ2-CB 3.48Å; W314-C322 VanDerWaalsContact CZ2-CB 3.48Å; W314-C322 HydrophobicContact CZ3-CB 4.42Å; W314-C322 PolarHBondContact N-O 2.82Å; W314-C322 PolarHBondContact O-N 2.93Å; C322-T329 HydrophobicContact CB-CG2 4.1Å; C322-E330 CarbonylContact C-O 3.52Å; C322-E330 VanDerWaalsContact CA-O 3.27Å; C322-E330 WeakPolarHBondContact CA-O 3.37Å; C322-C331 HydrophobicContact CB-CB 4.08Å; C322-C331 WeakPolarHBondContact CB-SG 3.37Å; C322-C331 WeakPolarHBondContact SG-CB 3.42Å; C322-C331 CovalentContact SG-SG 2.04Å; C322-C331 PolarHBondContact SG-SG 3.03Å
323	A	78.9	Confident	72.4	Confident	22 Å²	22	80.3 Å²	80.3	18%	0.182	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.9	171.5	0	0	0	0	0	108.2	E312 M313 V325 E330	E312-A323 CarbonylContact O-C 3.55Å; E312-A323 VanDerWaalsContact O-CA 3.28Å; E312-A323 WeakPolarHBondContact O-CA 3.37Å; M313-A323 HydrophobicContact CG-CB 3.84Å; A323-V325 HydrophobicContact CB-CG2 4.05Å; A323-E330 PolarHBondContact N-O 3.14Å; A323-E330 PolarHBondContact O-N 3.16Å
324	C	77.1	Confident	72.7	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.3	164.7	-171.1	0	0	0	0	107.5	C301 F308 R309 D310 G311 E312 W314	C301-C324 HydrophobicContact CB-CB 3.64Å; C301-C324 WeakPolarHBondContact CB-SG 3.2Å; C301-C324 PolarHBondContact N-SG 3.4Å; C301-C324 WeakPolarHBondContact SG-CA 3.18Å; C301-C324 WeakPolarHBondContact SG-CB 3.02Å; C301-C324 CovalentContact SG-SG 2.03Å; C301-C324 PolarHBondContact SG-SG 3.16Å; F308-C324 HydrophobicContact CB-CB 4.4Å; R309-C324 WeakPolarHBondContact O-CB 3.08Å; D310-C324 VanDerWaalsContact OD1-O 3.12Å; G311-C324 WeakPolarHBondContact CA-O 3.02Å; G311-C324 PolarHBondContact N-O 3.47Å; E312-C324 PolarHBondContact O-N 2.67Å; W314-C324 HydrophobicContact CH2-CB 4.38Å; W314-C324 HydrophobicContact CZ3-CB 3.98Å; W314-C324 VanDerWaalsContact CZ3-N 3.32Å
325	V	78.8	Confident	72.4	Confident	50 Å²	50	87.6 Å²	87.6	30%	0.303	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	108.2	179.1	-173.8	0	0	0	0	107.8	D310 A323 G327 R328 E330	D310-V325 WeakPolarHBondContact OD1-CA 3.28Å; A323-V325 HydrophobicContact CB-CG2 4.05Å; V325-G327 PolarHBondContact O-N 2.96Å; V325-R328 PolarHBondContact N-O 3.46Å; V325-R328 PolarHBondContact O-N 3.04Å; V325-E330 HydrophobicContact CB-CG 4.15Å; V325-E330 HydrophobicContact CG2-CB 4.15Å; V325-E330 HydrophobicContact CG2-CG 4.11Å
326	K	72.4	Confident	72.9	Confident	154 Å²	154	84.9 Å²	84.9	67%	0.67	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	41	-177.6	-58.1	179.4	179.5	179.4	0	113.1	D310 R328	D310-K326 WeakPolarHBondContact OD1-CA 3.29Å; D310-K326 PolarHBondContact OD1-N 3.24Å; K326-R328 VanDerWaalsContact C-N 3.34Å
327	G	69.7	Low	73.3	Confident	31 Å²	31	90.6 Å²	90.6	32%	0.32	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	6.5	-178.7	0	0	0	0	0	115.1	V325	V325-G327 PolarHBondContact O-N 2.96Å
328	R	74.8	Confident	74	Confident	194 Å²	194	88.3 Å²	88.3	73%	0.732	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.8	171.3	-66.6	-176.7	179.8	-178.8	-0.1	110.7	C301 V325 K326 E330	C301-R328 PolarHBondContact SG-N 3.47Å; C301-R328 VanDerWaalsContact SG-N 3.44Å; C301-R328 PolarHBondContact SG-O 3.11Å; C301-R328 VanDerWaalsContact SG-O 3.38Å; V325-R328 PolarHBondContact N-O 3.46Å; V325-R328 PolarHBondContact O-N 3.04Å; K326-R328 VanDerWaalsContact C-N 3.34Å; R328-E330 PolarHBondContact O-N 3.39Å
329	T	82.3	Confident	74.6	Confident	56 Å²	56	84.9 Å²	84.9	34%	0.344	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	114.5	173.6	-60.8	0	0	0	0	109.6	F303 W314 C322 C331	F303-T329 HydrophobicContact CD2-CG2 4Å; F303-T329 HydrophobicContact CE2-CG2 4.41Å; W314-T329 HydrophobicContact CH2-CG2 3.72Å; W314-T329 HydrophobicContact CZ2-CG2 3.43Å; W314-T329 VanDerWaalsContact CZ2-CG2 3.43Å; C322-T329 HydrophobicContact CB-CG2 4.1Å; T329-C331 VanDerWaalsContact CG2-SG 3.56Å
330	E	82.6	Confident	75	Confident	112 Å²	112	88.4 Å²	88.4	52%	0.523	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.5	173.5	-68.2	-171.8	-172.6	0	0	110	C322 A323 V325 R328	C322-E330 CarbonylContact C-O 3.52Å; C322-E330 VanDerWaalsContact CA-O 3.27Å; C322-E330 WeakPolarHBondContact CA-O 3.37Å; A323-E330 PolarHBondContact N-O 3.14Å; A323-E330 PolarHBondContact O-N 3.16Å; V325-E330 HydrophobicContact CB-CG 4.15Å; V325-E330 HydrophobicContact CG2-CB 4.15Å; V325-E330 HydrophobicContact CG2-CG 4.11Å; R328-E330 PolarHBondContact O-N 3.39Å
331	C	80.6	Confident	75.3	Confident	66 Å²	66	91.6 Å²	91.6	45%	0.446	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.2	-179.7	-57.8	0	0	0	0	111.5	I321 C322 T329	I321-C331 WeakPolarHBondContact O-CA 3.22Å; C322-C331 HydrophobicContact CB-CB 4.08Å; C322-C331 WeakPolarHBondContact CB-SG 3.37Å; C322-C331 WeakPolarHBondContact SG-CB 3.42Å; C322-C331 CovalentContact SG-SG 2.04Å; C322-C331 PolarHBondContact SG-SG 3.03Å; T329-C331 VanDerWaalsContact CG2-SG 3.56Å
332	R	75.4	Confident	75.8	Confident	177 Å²	177	90.7 Å²	90.7	67%	0.668	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.6	168.9	64.2	-177.9	177.6	-178.5	-2	110.7	T320 I321 K334	T320-R332 CarbonylContact C-O 3.59Å; T320-R332 VanDerWaalsContact CA-O 3.3Å; T320-R332 WeakPolarHBondContact CA-O 3.4Å; I321-R332 HydrophobicContact CG2-CG 3.52Å; I321-R332 PolarHBondContact N-O 3.19Å; I321-R332 PolarHBondContact O-N 2.57Å; R332-K334 PolarHBondContact O-N 3.29Å
333	N	73.6	Confident	75.7	Confident	126 Å²	126	94.6 Å²	94.6	67%	0.674	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	135.1	173.9	-69.8	-25.1	0	0	0	109.8	T320 Q335	T320-N333 WeakPolarHBondContact CG2-OD1 3.36Å; N333-Q335 PolarHBondContact O-N 2.95Å; N333-Q335 VanDerWaalsContact O-N 3.16Å
334	K	69.1	Low	75.3	Confident	105 Å²	105	103.2 Å²	103.2	46%	0.457	54%	0.542	S	S	.	.			trans	-66.9	114.9	177.9	-169.8	176	-177.5	-177.2	0	109.1	C319 R332 C336 C354	C319-K334 WeakPolarHBondContact O-CB 3.39Å; C319-K334 PolarHBondContact O-N 2.85Å; R332-K334 PolarHBondContact O-N 3.29Å; K334-C336 PolarHBondContact O-N 3.5Å; K334-C354 VanDerWaalsContact CD-SG 3.53Å; K334-C354 WeakPolarHBondContact CE-SG 3.24Å
335	Q	70.1	Confident	74.8	Confident	192 Å²	192	105.3 Å²	105.3	90%	0.897	56%	0.564	S	S	*	*			trans	-78	109.4	171.5	-70.9	-179.3	-15.8	0	0	108.7	N333	N333-Q335 PolarHBondContact O-N 2.95Å; N333-Q335 VanDerWaalsContact O-N 3.16Å
336	C	70.3	Confident	74.9	Confident	47 Å²	47	107.2 Å²	107.2	32%	0.318	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-86.1	139.4	177.7	-56.7	0	0	0	0	110.3	K334 C353 C354	K334-C336 PolarHBondContact O-N 3.5Å; C336-C353 PolarHBondContact SG-O 2.02Å; C336-C354 HydrophobicContact CB-CB 3.77Å; C336-C354 WeakPolarHBondContact CB-SG 3.36Å; C336-C354 WeakPolarHBondContact SG-CA 3.38Å; C336-C354 WeakPolarHBondContact SG-CB 3.47Å; C336-C354 CovalentContact SG-SG 2.05Å; C336-C354 PolarHBondContact SG-SG 3.39Å
337	I	71.2	Confident	75.1	Confident	145 Å²	145	103.3 Å²	103.3	74%	0.744	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-68.8	127.2	170.9	-59.9	168	0	0	0	107.7	I339	I337-I339 PolarHBondContact O-N 2.82Å
338	P	73.3	Confident	75.5	Confident	121 Å²	121	104.6 Å²	104.6	79%	0.786	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-61.6	124.6	176	-19.4	30.7	0	0	0	110.5
339	I	75.4	Confident	75.5	Confident	58 Å²	58	97.7 Å²	97.7	30%	0.297	53%	0.53	S	S	.	.			trans	-97	111.6	171.3	-57.7	179	0	0	0	107.4	I337 S341 L348 P355	I337-I339 PolarHBondContact O-N 2.82Å; I339-S341 WeakPolarHBondContact CG2-O 3.28Å; I339-L348 HydrophobicContact CB-CD1 3.85Å; I339-L348 HydrophobicContact CD1-CD1 3.94Å; I339-L348 HydrophobicContact CG1-CD1 4.46Å; I339-L348 HydrophobicContact CG2-CD1 3.77Å; I339-P355 HydrophobicContact CD1-CB 4.41Å; I339-P355 HydrophobicContact CD1-CG 4.45Å; I339-P355 WeakPolarHBondContact CD1-O 3.33Å
340	S	75.5	Confident	75	Confident	124 Å²	124	104.6 Å²	104.6	87%	0.867	55%	0.55	S	S	*	*			trans	-74.7	-41.6	177.5	52.1	0	0	0	0	112.3
341	S	80.6	Confident	74.1	Confident	93 Å²	93	108 Å²	108	65%	0.65	56%	0.563	S	S	*	*			trans	-153.4	154.5	176	62.7	0	0	0	0	111.5	I339	I339-S341 WeakPolarHBondContact CG2-O 3.28Å
342	C	79.6	Confident	73.3	Confident	31 Å²	31	107.9 Å²	107.9	21%	0.209	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-93.9	150	174.6	-73.2	0	0	0	0	111.3	K346 C357	C342-K346 HydrophobicContact CB-CB 4.07Å; C342-C357 WeakPolarHBondContact CA-SG 3.19Å; C342-C357 HydrophobicContact CB-CB 3.77Å; C342-C357 WeakPolarHBondContact CB-SG 2.96Å; C342-C357 VanDerWaalsContact SG-CA 3.5Å; C342-C357 WeakPolarHBondContact SG-CB 2.95Å; C342-C357 CovalentContact SG-SG 2.04Å; C342-C357 PolarHBondContact SG-SG 2.84Å
343	P	78.5	Confident	73.1	Confident	82 Å²	82	101.9 Å²	101.9	53%	0.532	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-54.7	154.8	170.2	-24	33.5	0	0	0	112.1	G345 K346	P343-G345 PolarHBondContact O-N 3.03Å; P343-K346 WeakPolarHBondContact O-CB 3.44Å; P343-K346 PolarHBondContact O-N 3.14Å
344	Q	69.6	Low	72.9	Confident	203 Å²	203	97.1 Å²	97.1	95%	0.949	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	134.4	-179.5	-165.6	175	-0.7	0	0	111.6	K346	Q344-K346 VanDerWaalsContact C-N 3.29Å; Q344-K346 PolarHBondContact O-N 3.38Å
345	G	67.5	Low	73.1	Confident	44 Å²	44	94 Å²	94	45%	0.454	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	0.9	-176.4	0	0	0	0	0	115.1	P343 K360	P343-G345 PolarHBondContact O-N 3.03Å; G345-K360 PolarHBondContact O-N 2.86Å
346	K	80.4	Confident	73.6	Confident	91 Å²	91	89.2 Å²	89.2	40%	0.396	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149.6	172.8	-61.1	-172.7	178.5	-175	0	111.4	C342 P343 Q344 C357 T358	C342-K346 HydrophobicContact CB-CB 4.07Å; P343-K346 WeakPolarHBondContact O-CB 3.44Å; P343-K346 PolarHBondContact O-N 3.14Å; Q344-K346 VanDerWaalsContact C-N 3.29Å; Q344-K346 PolarHBondContact O-N 3.38Å; K346-C357 HydrophobicContact CB-CB 4.06Å; K346-C357 HydrophobicContact CD-CB 4.13Å; K346-T358 CarbonylContact C-O 3.59Å; K346-T358 WeakPolarHBondContact CA-O 2.88Å; K346-T358 VanDerWaalsContact CB-O 3.26Å; K346-T358 WeakPolarHBondContact CB-O 3.31Å
347	I	77.8	Confident	74	Confident	71 Å²	71	88.7 Å²	88.7	36%	0.364	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.3	174.9	51	167.5	0	0	0	110.5	N349 C357 T358 K360	I347-N349 PolarHBondContact O-N 2.88Å; I347-N349 VanDerWaalsContact O-N 3.11Å; I347-C357 WeakPolarHBondContact O-CA 3.36Å; I347-T358 PolarHBondContact N-O 3.45Å; I347-T358 PolarHBondContact O-N 3.36Å; I347-K360 HydrophobicContact CB-CG 4.42Å; I347-K360 HydrophobicContact CG1-CG 4.34Å; I347-K360 HydrophobicContact CG2-CD 4.17Å; I347-K360 HydrophobicContact CG2-CG 3.5Å; I347-K360 VanDerWaalsContact CG2-CG 3.5Å
348	L	78.4	Confident	74.4	Confident	59 Å²	59	83.6 Å²	83.6	31%	0.309	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	103.1	177.1	-169.5	70.4	0	0	0	109.3	I339 R350 P355	I339-L348 HydrophobicContact CB-CD1 3.85Å; I339-L348 HydrophobicContact CD1-CD1 3.94Å; I339-L348 HydrophobicContact CG1-CD1 4.46Å; I339-L348 HydrophobicContact CG2-CD1 3.77Å; L348-R350 HydrophobicContact CD2-CG 4.28Å; L348-R350 HydrophobicContact CG-CG 4.32Å; L348-R350 PolarHBondContact O-N 2.98Å; L348-P355 HydrophobicContact CD1-CB 3.75Å; L348-P355 HydrophobicContact CG-CB 4.14Å
349	N	73.1	Confident	74.9	Confident	48 Å²	48	81.5 Å²	81.5	26%	0.257	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.8	171.9	-171.3	1.9	0	0	0	109.2	I347 K351 P355 I356 T358	I347-N349 PolarHBondContact O-N 2.88Å; I347-N349 VanDerWaalsContact O-N 3.11Å; N349-K351 WeakPolarHBondContact OD1-CB 3.4Å; N349-K351 WeakPolarHBondContact OD1-CG 3.13Å; N349-K351 PolarHBondContact OD1-N 3.43Å; N349-P355 WeakPolarHBondContact O-CA 3.32Å; N349-I356 HydrophobicContact CB-CG1 4.28Å; N349-I356 PolarHBondContact N-O 2.96Å; N349-I356 PolarHBondContact O-N 3.41Å; N349-T358 HydrophobicContact CB-CG2 3.75Å
350	R	72.7	Confident	75.3	Confident	201 Å²	201	82.2 Å²	82.2	76%	0.758	46%	0.457	S	S	*	.			trans	-91.1	0.2	174.6	-60.2	-175.3	-178.6	-168.6	0.6	113	L348 G352	L348-R350 HydrophobicContact CD2-CG 4.28Å; L348-R350 HydrophobicContact CG-CG 4.32Å; L348-R350 PolarHBondContact O-N 2.98Å; R350-G352 PolarHBondContact O-N 3.02Å
351	K	63.3	Low	76	Confident	183 Å²	183	78.2 Å²	78.2	80%	0.796	43%	0.429	S	S	*	.	S	Bend	trans	-76.8	115.2	174.6	-60.7	-176.8	177.9	178.8	0	108.7	N349	N349-K351 WeakPolarHBondContact OD1-CB 3.4Å; N349-K351 WeakPolarHBondContact OD1-CG 3.13Å; N349-K351 PolarHBondContact OD1-N 3.43Å
352	G	64.9	Low	76.6	Confident	65 Å²	65	74.1 Å²	74.1	67%	0.67	40%	0.401	S	S	*	.	S	Bend	trans	119.6	-174.1	-175.3	0	0	0	0	0	111.4	R350	R350-G352 PolarHBondContact O-N 3.02Å
353	C	70.3	Confident	77.3	Confident	50 Å²	50	73.9 Å²	73.9	34%	0.338	40%	0.398	S	S	.	.	S	Bend	trans	-76.3	-41.5	-172.2	179.5	0	0	0	0	114	C319 C336	C319-C353 WeakPolarHBondContact CA-SG 3.49Å; C319-C353 HydrophobicContact CB-CB 4.13Å; C319-C353 WeakPolarHBondContact CB-SG 3.38Å; C319-C353 VanDerWaalsContact SG-C 3.55Å; C319-C353 WeakPolarHBondContact SG-CA 3.35Å; C319-C353 WeakPolarHBondContact SG-CB 3.09Å; C319-C353 PolarHBondContact SG-O 3.15Å; C319-C353 CovalentContact SG-SG 2.04Å; C319-C353 PolarHBondContact SG-SG 3.02Å; C336-C353 PolarHBondContact SG-O 2.02Å
354	C	68.7	Low	78.2	Confident	26 Å²	26	70 Å²	70	18%	0.176	37%	0.373	C	S	.	.	S	Bend	trans	-118.2	143.7	174.1	-67.8	0	0	0	0	110.2	K334 C336 I356	K334-C354 VanDerWaalsContact CD-SG 3.53Å; K334-C354 WeakPolarHBondContact CE-SG 3.24Å; C336-C354 HydrophobicContact CB-CB 3.77Å; C336-C354 WeakPolarHBondContact CB-SG 3.36Å; C336-C354 WeakPolarHBondContact SG-CA 3.38Å; C336-C354 WeakPolarHBondContact SG-CB 3.47Å; C336-C354 CovalentContact SG-SG 2.05Å; C336-C354 PolarHBondContact SG-SG 3.39Å; C354-I356 PolarHBondContact O-N 2.88Å
355	P	74.4	Confident	79.4	Confident	39 Å²	39	60.8 Å²	60.8	25%	0.253	33%	0.331	S	S	.	.			trans	-62.5	137	174.4	28	-33.8	0	0	0	109.7	I339 L348 N349	I339-P355 HydrophobicContact CD1-CB 4.41Å; I339-P355 HydrophobicContact CD1-CG 4.45Å; I339-P355 WeakPolarHBondContact CD1-O 3.33Å; L348-P355 HydrophobicContact CD1-CB 3.75Å; L348-P355 HydrophobicContact CG-CB 4.14Å; N349-P355 WeakPolarHBondContact O-CA 3.32Å
356	I	80	Confident	80.7	Confident	93 Å²	93	58.8 Å²	58.8	48%	0.477	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.3	175.1	57.2	166.7	0	0	0	109.8	N349 C354 T358	N349-I356 HydrophobicContact CB-CG1 4.28Å; N349-I356 PolarHBondContact N-O 2.96Å; N349-I356 PolarHBondContact O-N 3.41Å; C354-I356 PolarHBondContact O-N 2.88Å; I356-T358 HydrophobicContact CD1-CG2 3.8Å; I356-T358 HydrophobicContact CG1-CG2 3.98Å; I356-T358 PolarHBondContact O-N 3.15Å
357	C	78.5	Confident	81.1	Confident	35 Å²	35	54.5 Å²	54.5	24%	0.236	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	105.9	172.7	-64.7	0	0	0	0	109.8	C342 K346 I347	C342-C357 WeakPolarHBondContact CA-SG 3.19Å; C342-C357 HydrophobicContact CB-CB 3.77Å; C342-C357 WeakPolarHBondContact CB-SG 2.96Å; C342-C357 VanDerWaalsContact SG-CA 3.5Å; C342-C357 WeakPolarHBondContact SG-CB 2.95Å; C342-C357 CovalentContact SG-SG 2.04Å; C342-C357 PolarHBondContact SG-SG 2.84Å; K346-C357 HydrophobicContact CB-CB 4.06Å; K346-C357 HydrophobicContact CD-CB 4.13Å; I347-C357 WeakPolarHBondContact O-CA 3.36Å
358	T	80.1	Confident	81.2	Confident	38 Å²	38	51.1 Å²	51.1	23%	0.233	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	156.8	173.4	57.3	0	0	0	0	110.3	K346 I347 N349 I356	K346-T358 CarbonylContact C-O 3.59Å; K346-T358 WeakPolarHBondContact CA-O 2.88Å; K346-T358 VanDerWaalsContact CB-O 3.26Å; K346-T358 WeakPolarHBondContact CB-O 3.31Å; I347-T358 PolarHBondContact N-O 3.45Å; I347-T358 PolarHBondContact O-N 3.36Å; N349-T358 HydrophobicContact CB-CG2 3.75Å; I356-T358 HydrophobicContact CD1-CG2 3.8Å; I356-T358 HydrophobicContact CG1-CG2 3.98Å; I356-T358 PolarHBondContact O-N 3.15Å
359	E	83.5	Confident	80.9	Confident	77 Å²	77	48.4 Å²	48.4	36%	0.36	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	148	172	-59.2	-165.3	177.1	0	0	111.1	P487 K490	E359-P487 HydrophobicContact CB-CB 4.03Å; E359-P487 HydrophobicContact CB-CG 4.09Å; E359-P487 VanDerWaalsContact O-CG 3.23Å; E359-P487 WeakPolarHBondContact O-CG 3.41Å; E359-K490 IonicContact OE1-NZ 3.88Å; E359-K490 WeakPolarHBondContact OE2-CD 3.08Å; E359-K490 IonicContact OE2-NZ 3.43Å; E359-K490 PolarHBondContact OE2-NZ 3.16Å
360	K	83.6	Confident	80.9	Confident	73 Å²	73	46.1 Å²	46.1	32%	0.317	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-63	139.8	169.4	-80.7	-175.3	169.1	-166.7	0	109.8	G345 I347 E612	G345-K360 PolarHBondContact O-N 2.86Å; I347-K360 HydrophobicContact CB-CG 4.42Å; I347-K360 HydrophobicContact CG1-CG 4.34Å; I347-K360 HydrophobicContact CG2-CD 4.17Å; I347-K360 HydrophobicContact CG2-CG 3.5Å; I347-K360 VanDerWaalsContact CG2-CG 3.5Å; K360-E612 IonicContact NZ-OE1 2.73Å; K360-E612 PolarHBondContact NZ-OE1 3Å; K360-E612 IonicContact NZ-OE2 2.9Å; K360-E612 PolarHBondContact NZ-OE2 3.39Å
361	P	90.4	Very high	81.8	Confident	41 Å²	41	36.6 Å²	36.6	27%	0.266	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-63.5	146.5	171.4	29	-34.3	0	0	0	110.4	M484 A485	P361-M484 HydrophobicContact CB-CG 3.61Å; P361-M484 HydrophobicContact CB-SD 3.9Å; P361-M484 HydrophobicContact CG-CE 4.48Å; P361-M484 HydrophobicContact CG-CG 3.92Å; P361-M484 HydrophobicContact CG-SD 3.55Å; P361-M484 VanDerWaalsContact CG-SD 3.55Å; P361-A485 CarbonylContact C-O 3.6Å; P361-A485 VanDerWaalsContact CA-O 3.26Å; P361-A485 WeakPolarHBondContact CA-O 3.23Å; P361-A485 WeakPolarHBondContact CB-O 3.39Å
362	G	92.8	Very high	83.2	Confident	6 Å²	6	27.9 Å²	27.9	6%	0.062	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	143.2	173.6	0	0	0	0	0	110	M484 A485 Y500	G362-M484 CarbonylContact O-C 3.59Å; G362-M484 WeakPolarHBondContact O-CA 3.28Å; G362-A485 PolarHBondContact N-O 3.41Å; G362-A485 PolarHBondContact O-N 2.88Å; G362-Y500 VanDerWaalsContact CA-CE2 3.44Å; G362-Y500 PolarHBondContact N-OH 2.9Å
363	V	95.3	Very high	84.6	Confident	26 Å²	26	25.6 Å²	25.6	16%	0.158	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.5	179.8	-176.1	0	0	0	0	110.1	T365 E482 M484	V363-T365 HydrophobicContact CG1-CG2 4.03Å; V363-E482 HydrophobicContact CG1-CG 3.65Å; V363-M484 HydrophobicContact CG2-CE 4.06Å; V363-M484 HydrophobicContact CG2-CG 4.22Å
364	C	96.9	Very high	85.9	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.2	170.5	176.7	0	0	0	0	109.5	N373 F375 E482 V483 C497	C364-N373 CarbonylContact C-O 3.56Å; C364-N373 WeakPolarHBondContact CA-O 3.35Å; C364-N373 PolarHBondContact SG-O 3.2Å; C364-F375 HydrophobicContact CB-CD1 3.69Å; C364-F375 HydrophobicContact CB-CD2 4.46Å; C364-F375 HydrophobicContact CB-CE1 3.52Å; C364-F375 HydrophobicContact CB-CE2 4.31Å; C364-F375 HydrophobicContact CB-CG 4.18Å; C364-F375 HydrophobicContact CB-CZ 3.85Å; C364-E482 CarbonylContact O-C 3.43Å; C364-E482 WeakPolarHBondContact O-CA 3.03Å; C364-V483 HydrophobicContact CB-CB 4.46Å; C364-V483 PolarHBondContact N-O 3.13Å; C364-V483 PolarHBondContact O-N 2.87Å; C364-C497 HydrophobicContact CB-CB 3.59Å; C364-C497 WeakPolarHBondContact CB-SG 3.44Å; C364-C497 WeakPolarHBondContact SG-CB 3.14Å; C364-C497 CovalentContact SG-SG 2.02Å; C364-C497 PolarHBondContact SG-SG 3.4Å
365	T	95.3	Very high	87.2	Confident	10 Å²	10	22.8 Å²	22.8	6%	0.061	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.8	179.9	62.3	0	0	0	0	112.2	V363 Y372 N373 F480 V481 E482	V363-T365 HydrophobicContact CG1-CG2 4.03Å; T365-Y372 CarbonylContact O-C 3.53Å; T365-Y372 WeakPolarHBondContact O-CA 3.33Å; T365-N373 PolarHBondContact N-O 3.4Å; T365-N373 PolarHBondContact O-N 3.44Å; T365-N373 WeakPolarHBondContact OG1-CB 3.3Å; T365-N373 PolarHBondContact OG1-ND2 3.28Å; T365-F480 HydrophobicContact CG2-CZ 4.3Å; T365-V481 CarbonylContact C-O 3.55Å; T365-V481 VanDerWaalsContact CA-O 3.27Å; T365-V481 WeakPolarHBondContact CA-O 3.28Å; T365-E482 HydrophobicContact CG2-CB 4.23Å; T365-E482 HydrophobicContact CG2-CG 4.07Å
366	V	94.4	Very high	88	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127	170.3	-167.9	0	0	0	0	108.6	P370 H371 Y372 L390 F480 V481	V366-P370 HydrophobicContact CG1-CB 4.01Å; V366-H371 VanDerWaalsContact CA-O 3.29Å; V366-H371 WeakPolarHBondContact CA-O 3.44Å; V366-Y372 HydrophobicContact CB-CD1 4.49Å; V366-Y372 HydrophobicContact CB-CE1 4.44Å; V366-Y372 HydrophobicContact CG1-CD1 4.21Å; V366-Y372 HydrophobicContact CG1-CE1 3.86Å; V366-Y372 HydrophobicContact CG2-CD1 3.64Å; V366-Y372 HydrophobicContact CG2-CE1 3.69Å; V366-L390 HydrophobicContact CG2-CD1 3.65Å; V366-L390 HydrophobicContact CG2-CD2 4.19Å; V366-F480 WeakPolarHBondContact O-CA 3.37Å; V366-V481 HydrophobicContact CB-CB 4.05Å; V366-V481 HydrophobicContact CB-CG2 4.22Å; V366-V481 HydrophobicContact CG2-CB 4.29Å; V366-V481 PolarHBondContact N-O 2.92Å; V366-V481 PolarHBondContact O-N 2.83Å
367	F	89.4	Confident	88.5	Confident	1 Å²	1	20.1 Å²	20.1	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	161.5	-177.5	65.3	-84.1	0	0	0	111.5	H371 N373 F480 F580 A604	F367-H371 HydrophobicContact CD1-CB 4.3Å; F367-H371 HydrophobicContact CD2-CB 4.32Å; F367-H371 AromaticContact CD2-CD2 4Å; F367-H371 HydrophobicContact CE1-CB 3.88Å; F367-H371 HydrophobicContact CE2-CB 3.92Å; F367-H371 AromaticContact CE2-CD2 3.7Å; F367-H371 HydrophobicContact CG-CB 4.5Å; F367-H371 HydrophobicContact CZ-CB 3.68Å; F367-H371 PolarHBondContact N-O 2.98Å; F367-H371 VanDerWaalsContact N-O 3.09Å; F367-H371 PolarHBondContact O-N 3.39Å; F367-N373 WeakPolarHBondContact CE1-ND2 3.21Å; F367-F480 HydrophobicContact CB-CD2 3.79Å; F367-F480 HydrophobicContact CB-CE2 4.37Å; F367-F580 HydrophobicContact CE1-CE1 4.26Å; F367-F580 HydrophobicContact CE2-CD1 4.27Å; F367-F580 AromaticContact CZ-CD1 3.91Å; F367-F580 HydrophobicContact CZ-CD1 3.91Å; F367-F580 HydrophobicContact CZ-CE1 4.06Å; F367-A604 HydrophobicContact CB-CB 4.09Å; F367-A604 HydrophobicContact CD1-CB 4Å; F367-A604 HydrophobicContact CD2-CB 3.67Å; F367-A604 HydrophobicContact CE1-CB 4.38Å; F367-A604 HydrophobicContact CE2-CB 4.06Å; F367-A604 HydrophobicContact CG-CB 3.64Å; F367-A604 HydrophobicContact CZ-CB 4.4Å
368	G	79.4	Confident	89.1	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	-135.5	177	0	0	0	0	0	113.3
369	D	71.1	Confident	89.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	51.1	-162.2	77.1	-6.5	0	0	0	120.3	H371 F415 S416 D587	D369-H371 IonicContact OD1-CD2 3.18Å; D369-H371 IonicContact OD1-CE1 3.53Å; D369-H371 PolarHBondContact OD1-CE1 3.25Å; D369-H371 IonicContact OD1-ND1 2.97Å; D369-H371 IonicContact OD1-NE2 3Å; D369-H371 PolarHBondContact OD1-NE2 2.04Å; D369-H371 VanDerWaalsContact OD1-NE2 3.12Å; D369-F415 HydrophobicContact CB-CD1 4.25Å; D369-S416 CarbonylContact C-O 3.54Å; D369-D587 VanDerWaalsContact CB-OD1 3.23Å; D369-D587 WeakPolarHBondContact CB-OD1 3.27Å; D369-D587 PolarHBondContact N-OD1 3.02Å; D369-D587 VanDerWaalsContact N-OD1 3.14Å
370	P	74.9	Confident	89.8	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.006	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	cis	-85.2	135.1	-45.4	20.8	-2.2	0	0	0	110.2	V366 Y372 F382 S416	V366-P370 HydrophobicContact CG1-CB 4.01Å; P370-Y372 HydrophobicContact CB-CE2 4.03Å; P370-Y372 HydrophobicContact CG-CE2 4.11Å; P370-F382 WeakPolarHBondContact CD-O 3.12Å; P370-F382 VanDerWaalsContact CG-O 3.22Å; P370-F382 WeakPolarHBondContact CG-O 3.46Å; P370-F382 PolarHBondContact O-N 3.25Å; P370-S416 WeakPolarHBondContact CD-O 3.46Å; P370-S416 WeakPolarHBondContact CD-OG 3.33Å; P370-S416 WeakPolarHBondContact CG-O 3.39Å; P370-S416 WeakPolarHBondContact CG-OG 3.07Å
371	H	90.3	Very high	90	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.6	172.1	-53.2	-60.5	0	0	0	109.9	V366 F367 D369 N381 S583 D587	V366-H371 VanDerWaalsContact CA-O 3.29Å; V366-H371 WeakPolarHBondContact CA-O 3.44Å; F367-H371 HydrophobicContact CD1-CB 4.3Å; F367-H371 HydrophobicContact CD2-CB 4.32Å; F367-H371 AromaticContact CD2-CD2 4Å; F367-H371 HydrophobicContact CE1-CB 3.88Å; F367-H371 HydrophobicContact CE2-CB 3.92Å; F367-H371 AromaticContact CE2-CD2 3.7Å; F367-H371 HydrophobicContact CG-CB 4.5Å; F367-H371 HydrophobicContact CZ-CB 3.68Å; F367-H371 PolarHBondContact N-O 2.98Å; F367-H371 VanDerWaalsContact N-O 3.09Å; F367-H371 PolarHBondContact O-N 3.39Å; D369-H371 IonicContact OD1-CD2 3.18Å; D369-H371 IonicContact OD1-CE1 3.53Å; D369-H371 PolarHBondContact OD1-CE1 3.25Å; D369-H371 IonicContact OD1-ND1 2.97Å; D369-H371 IonicContact OD1-NE2 3Å; D369-H371 PolarHBondContact OD1-NE2 2.04Å; D369-H371 VanDerWaalsContact OD1-NE2 3.12Å; H371-N381 VanDerWaalsContact ND1-CG 3.27Å; H371-N381 PolarHBondContact ND1-OD1 2.8Å; H371-S583 WeakPolarHBondContact CD2-CB 3.5Å; H371-S583 PolarHBondContact ND1-OG 2.83Å; H371-S583 WeakPolarHBondContact NE2-CB 3.38Å; H371-S583 PolarHBondContact NE2-O 3.2Å; H371-D587 IonicContact CD2-OD1 3.71Å; H371-D587 IonicContact CD2-OD2 3.41Å; H371-D587 IonicContact NE2-OD1 3.35Å; H371-D587 PolarHBondContact NE2-OD1 2.87Å; H371-D587 IonicContact NE2-OD2 2.7Å; H371-D587 PolarHBondContact NE2-OD2 3.21Å
372	Y	93.8	Very high	89.7	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.4	177.3	-63.2	-100.2	0	0	0	109	T365 V366 P370 T379 F380 F382 L390 N407 L496	T365-Y372 CarbonylContact O-C 3.53Å; T365-Y372 WeakPolarHBondContact O-CA 3.33Å; V366-Y372 HydrophobicContact CB-CD1 4.49Å; V366-Y372 HydrophobicContact CB-CE1 4.44Å; V366-Y372 HydrophobicContact CG1-CD1 4.21Å; V366-Y372 HydrophobicContact CG1-CE1 3.86Å; V366-Y372 HydrophobicContact CG2-CD1 3.64Å; V366-Y372 HydrophobicContact CG2-CE1 3.69Å; P370-Y372 HydrophobicContact CB-CE2 4.03Å; P370-Y372 HydrophobicContact CG-CE2 4.11Å; Y372-T379 CarbonylContact O-C 3.6Å; Y372-T379 VanDerWaalsContact O-CA 3.24Å; Y372-T379 WeakPolarHBondContact O-CA 3.11Å; Y372-F380 HydrophobicContact CD1-CE2 4.48Å; Y372-F380 HydrophobicContact CD1-CZ 4.21Å; Y372-F380 HydrophobicContact CD2-CD2 4.1Å; Y372-F380 AromaticContact CD2-CE2 3.54Å; Y372-F380 HydrophobicContact CD2-CE2 3.54Å; Y372-F380 HydrophobicContact CD2-CZ 4.03Å; Y372-F380 HydrophobicContact CE2-CE2 4.35Å; Y372-F380 HydrophobicContact CG-CD2 4.4Å; Y372-F380 HydrophobicContact CG-CE1 4.35Å; Y372-F380 AromaticContact CG-CE2 3.64Å; Y372-F380 HydrophobicContact CG-CE2 3.64Å; Y372-F380 AromaticContact CG-CZ 3.6Å; Y372-F380 HydrophobicContact CG-CZ 3.6Å; Y372-F380 PolarHBondContact N-O 2.6Å; Y372-F380 PolarHBondContact O-N 3.5Å; Y372-F382 HydrophobicContact CD2-CB 4.36Å; Y372-F382 HydrophobicContact CE2-CB 4Å; Y372-F382 HydrophobicContact CE2-CD1 4.43Å; Y372-L390 HydrophobicContact CD1-CD1 4.08Å; Y372-L390 HydrophobicContact CE1-CD1 4.01Å; Y372-N407 PolarHBondContact OH-ND2 2.83Å; Y372-L496 HydrophobicContact CD1-CB 4.28Å; Y372-L496 HydrophobicContact CD1-CD1 4.42Å; Y372-L496 HydrophobicContact CE1-CB 4.37Å; Y372-L496 HydrophobicContact CE1-CD1 3.74Å
373	N	94.1	Very high	89.2	Confident	18 Å²	18	19 Å²	19	10%	0.096	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.6	161.3	-65.8	-42	0	0	0	108.1	C364 T365 F367 R378 T379	C364-N373 CarbonylContact C-O 3.56Å; C364-N373 WeakPolarHBondContact CA-O 3.35Å; C364-N373 PolarHBondContact SG-O 3.2Å; T365-N373 PolarHBondContact N-O 3.4Å; T365-N373 PolarHBondContact O-N 3.44Å; T365-N373 WeakPolarHBondContact OG1-CB 3.3Å; T365-N373 PolarHBondContact OG1-ND2 3.28Å; F367-N373 WeakPolarHBondContact CE1-ND2 3.21Å; N373-R378 CarbonylContact C-O 3.53Å; N373-R378 WeakPolarHBondContact CA-O 3.44Å; N373-T379 WeakPolarHBondContact OD1-CB 3.33Å; N373-T379 VanDerWaalsContact OD1-CG2 3.29Å; N373-T379 WeakPolarHBondContact OD1-CG2 3.38Å; N373-T379 PolarHBondContact OD1-OG1 3.49Å
374	T	96.3	Very high	88.5	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.099	C	C	.	.			trans	-73.7	167.3	176.1	64.8	0	0	0	0	111.8	D376 G377 R378 F380 C497 D507	T374-D376 PolarHBondContact O-N 2.87Å; T374-G377 PolarHBondContact O-N 2.97Å; T374-G377 PolarHBondContact OG1-N 3.5Å; T374-R378 HydrophobicContact CG2-CB 4.08Å; T374-R378 PolarHBondContact N-O 2.89Å; T374-R378 WeakPolarHBondContact OG1-CB 3.31Å; T374-R378 PolarHBondContact OG1-N 3.25Å; T374-R378 PolarHBondContact OG1-O 2.98Å; T374-F380 HydrophobicContact CG2-CD1 4.4Å; T374-F380 HydrophobicContact CG2-CE1 3.86Å; T374-C497 WeakPolarHBondContact CA-O 3.33Å; T374-C497 VanDerWaalsContact CB-O 3.22Å; T374-C497 WeakPolarHBondContact CB-O 3.04Å; T374-D507 WeakPolarHBondContact CB-OD2 3.45Å; T374-D507 HydrophobicContact CG2-CB 4.04Å; T374-D507 PolarHBondContact OG1-OD2 2.79Å
375	F	95.9	Very high	88	Confident	16 Å²	16	19.1 Å²	19.1	7%	0.07	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.4	176.7	-65.1	-63.7	0	0	0	113.7	C364 T391 V483 A485 L493 C497 Y500	C364-F375 HydrophobicContact CB-CD1 3.69Å; C364-F375 HydrophobicContact CB-CD2 4.46Å; C364-F375 HydrophobicContact CB-CE1 3.52Å; C364-F375 HydrophobicContact CB-CE2 4.31Å; C364-F375 HydrophobicContact CB-CG 4.18Å; C364-F375 HydrophobicContact CB-CZ 3.85Å; F375-T391 HydrophobicContact CZ-CG2 4.28Å; F375-V483 HydrophobicContact CE1-CG1 4.38Å; F375-V483 WeakPolarHBondContact CE1-O 3.29Å; F375-V483 HydrophobicContact CZ-CG1 4.15Å; F375-A485 HydrophobicContact CD1-CB 4.21Å; F375-A485 HydrophobicContact CE1-CB 3.7Å; F375-A485 HydrophobicContact CZ-CB 4Å; F375-L493 HydrophobicContact CD2-CD1 4.06Å; F375-L493 HydrophobicContact CE2-CB 4.48Å; F375-L493 HydrophobicContact CE2-CD1 3.48Å; F375-L493 VanDerWaalsContact CE2-CD1 3.48Å; F375-L493 HydrophobicContact CZ-CD1 3.83Å; F375-C497 HydrophobicContact CD2-CB 3.66Å; F375-C497 WeakPolarHBondContact CD2-O 2.98Å; F375-C497 HydrophobicContact CE2-CB 3.36Å; F375-C497 HydrophobicContact CG-CB 4.47Å; F375-C497 HydrophobicContact CZ-CB 3.97Å; F375-C497 PolarHBondContact N-O 3.32Å; F375-Y500 HydrophobicContact CB-CD2 3.5Å; F375-Y500 HydrophobicContact CB-CE2 4.34Å; F375-Y500 HydrophobicContact CB-CG 3.84Å; F375-Y500 HydrophobicContact CD2-CG 4.29Å; F375-Y500 HydrophobicContact CG-CD2 4.17Å; F375-Y500 HydrophobicContact CG-CG 4.1Å
376	D	92.8	Very high	87.6	Confident	30 Å²	30	18.8 Å²	18.8	16%	0.16	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	3.1	-179	-61.4	-28.4	0	0	0	112.8	T374 Y500 N501 G502 H503 K504	T374-D376 PolarHBondContact O-N 2.87Å; D376-Y500 WeakPolarHBondContact OD2-CA 3.44Å; D376-N501 PolarHBondContact OD2-N 2.84Å; D376-N501 PolarHBondContact OD2-OD1 3.4Å; D376-G502 VanDerWaalsContact OD1-CA 3.27Å; D376-G502 WeakPolarHBondContact OD1-CA 3.09Å; D376-G502 PolarHBondContact OD1-N 2.97Å; D376-G502 PolarHBondContact OD2-N 3.47Å; D376-H503 PolarHBondContact OD2-N 2.93Å; D376-K504 HydrophobicContact CB-CB 4.44Å
377	G	89.4	Confident	87.5	Confident	46 Å²	46	20.2 Å²	20.2	47%	0.474	11%	0.111	S	C	.	.			trans	88.6	22.5	171.8	0	0	0	0	0	115.2	T374	T374-G377 PolarHBondContact O-N 2.97Å; T374-G377 PolarHBondContact OG1-N 3.5Å
378	R	90.5	Very high	87.7	Confident	93 Å²	93	20.1 Å²	20.1	35%	0.351	11%	0.111	S	C	.	.			trans	-80.6	127.4	166.4	-177.9	135.8	177.5	86.9	-1.3	110	N373 T374 K504 D507	N373-R378 CarbonylContact C-O 3.53Å; N373-R378 WeakPolarHBondContact CA-O 3.44Å; T374-R378 HydrophobicContact CG2-CB 4.08Å; T374-R378 PolarHBondContact N-O 2.89Å; T374-R378 WeakPolarHBondContact OG1-CB 3.31Å; T374-R378 PolarHBondContact OG1-N 3.25Å; T374-R378 PolarHBondContact OG1-O 2.98Å; R378-K504 HydrophobicContact CB-CB 4.11Å; R378-K504 WeakPolarHBondContact CD-O 3.39Å; R378-D507 HydrophobicContact CB-CB 4.11Å; R378-D507 WeakPolarHBondContact CB-OD2 3.38Å
379	T	90.9	Very high	88.5	Confident	35 Å²	35	20.7 Å²	20.7	22%	0.215	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	135.6	171.8	-49.3	0	0	0	0	111.1	Y372 N373 T579	Y372-T379 CarbonylContact O-C 3.6Å; Y372-T379 VanDerWaalsContact O-CA 3.24Å; Y372-T379 WeakPolarHBondContact O-CA 3.11Å; N373-T379 WeakPolarHBondContact OD1-CB 3.33Å; N373-T379 VanDerWaalsContact OD1-CG2 3.29Å; N373-T379 WeakPolarHBondContact OD1-CG2 3.38Å; N373-T379 PolarHBondContact OD1-OG1 3.49Å; T379-T579 WeakPolarHBondContact OG1-CB 3.03Å; T379-T579 WeakPolarHBondContact OG1-CG2 3.46Å
380	F	89.3	Confident	89.7	Confident	9 Å²	9	20.7 Å²	20.7	4%	0.039	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	162.1	171.2	66.5	-91	0	0	0	111.7	Y372 T374 F382 L496 V519 F522	Y372-F380 HydrophobicContact CD1-CE2 4.48Å; Y372-F380 HydrophobicContact CD1-CZ 4.21Å; Y372-F380 HydrophobicContact CD2-CD2 4.1Å; Y372-F380 AromaticContact CD2-CE2 3.54Å; Y372-F380 HydrophobicContact CD2-CE2 3.54Å; Y372-F380 HydrophobicContact CD2-CZ 4.03Å; Y372-F380 HydrophobicContact CE2-CE2 4.35Å; Y372-F380 HydrophobicContact CG-CD2 4.4Å; Y372-F380 HydrophobicContact CG-CE1 4.35Å; Y372-F380 AromaticContact CG-CE2 3.64Å; Y372-F380 HydrophobicContact CG-CE2 3.64Å; Y372-F380 AromaticContact CG-CZ 3.6Å; Y372-F380 HydrophobicContact CG-CZ 3.6Å; Y372-F380 PolarHBondContact N-O 2.6Å; Y372-F380 PolarHBondContact O-N 3.5Å; T374-F380 HydrophobicContact CG2-CD1 4.4Å; T374-F380 HydrophobicContact CG2-CE1 3.86Å; F380-F382 HydrophobicContact CD2-CB 4.25Å; F380-F382 HydrophobicContact CE2-CB 4.16Å; F380-L496 WeakPolarHBondContact CE1-O 3.11Å; F380-L496 HydrophobicContact CZ-CB 4.37Å; F380-L496 WeakPolarHBondContact CZ-O 3.41Å; F380-V519 HydrophobicContact CB-CG1 3.89Å; F380-V519 HydrophobicContact CB-CG2 4.15Å; F380-V519 HydrophobicContact CD2-CG1 3.47Å; F380-V519 VanDerWaalsContact CD2-CG1 3.47Å; F380-V519 HydrophobicContact CE2-CG1 4.34Å; F380-V519 HydrophobicContact CG-CG1 3.98Å; F380-F522 AromaticContact CE1-CE1 3.96Å; F380-F522 HydrophobicContact CE1-CE1 3.96Å; F380-F522 HydrophobicContact CE2-CD1 4.46Å; F380-F522 HydrophobicContact CE2-CE1 4.04Å; F380-F522 HydrophobicContact CZ-CD1 4.44Å; F380-F522 AromaticContact CZ-CE1 3.61Å; F380-F522 HydrophobicContact CZ-CE1 3.61Å
381	N	86	Confident	90.8	Very high	62 Å²	62	20.6 Å²	20.6	33%	0.332	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.9	-180	-58	-8.1	0	0	0	108.4	H371 V519	H371-N381 VanDerWaalsContact ND1-CG 3.27Å; H371-N381 PolarHBondContact ND1-OD1 2.8Å; N381-V519 WeakPolarHBondContact O-CG1 3.33Å
382	F	85.9	Confident	91	Very high	1 Å²	1	23.9 Å²	23.9	0%	0.004	13%	0.128	C	C	.	.			trans	-149.8	114.5	178.5	172.9	-112.2	0	0	0	112	P370 Y372 F380 G384 Y388 A523 P537	P370-F382 WeakPolarHBondContact CD-O 3.12Å; P370-F382 VanDerWaalsContact CG-O 3.22Å; P370-F382 WeakPolarHBondContact CG-O 3.46Å; P370-F382 PolarHBondContact O-N 3.25Å; Y372-F382 HydrophobicContact CD2-CB 4.36Å; Y372-F382 HydrophobicContact CE2-CB 4Å; Y372-F382 HydrophobicContact CE2-CD1 4.43Å; F380-F382 HydrophobicContact CD2-CB 4.25Å; F380-F382 HydrophobicContact CE2-CB 4.16Å; F382-G384 VanDerWaalsContact C-N 3.34Å; F382-G384 PolarHBondContact O-N 2.88Å; F382-Y388 HydrophobicContact CE1-CD1 4.04Å; F382-Y388 HydrophobicContact CE1-CD2 4.18Å; F382-Y388 AromaticContact CE1-CE1 3.58Å; F382-Y388 HydrophobicContact CE1-CE1 3.58Å; F382-Y388 AromaticContact CE1-CE2 3.72Å; F382-Y388 HydrophobicContact CE1-CE2 3.72Å; F382-Y388 HydrophobicContact CE1-CG 4.34Å; F382-Y388 AromaticContact CE1-CZ 3.41Å; F382-Y388 VanDerWaalsContact CE1-CZ 3.41Å; F382-Y388 HydrophobicContact CZ-CD1 4.49Å; F382-Y388 AromaticContact CZ-CE1 3.68Å; F382-Y388 HydrophobicContact CZ-CE1 3.68Å; F382-Y388 HydrophobicContact CZ-CE2 4.34Å; F382-Y388 AromaticContact CZ-CZ 3.59Å; F382-Y388 WeakPolarHBondContact CZ-OH 3.22Å; F382-A523 HydrophobicContact CB-CB 4.06Å; F382-A523 HydrophobicContact CD1-CB 3.44Å; F382-A523 VanDerWaalsContact CD1-CB 3.44Å; F382-A523 HydrophobicContact CD2-CB 3.4Å; F382-A523 VanDerWaalsContact CD2-CB 3.4Å; F382-A523 HydrophobicContact CE1-CB 3.56Å; F382-A523 HydrophobicContact CE2-CB 3.54Å; F382-A523 HydrophobicContact CG-CB 3.33Å; F382-A523 HydrophobicContact CZ-CB 3.6Å; F382-P537 HydrophobicContact CE2-CG 3.97Å
383	Q	80.8	Confident	91	Very high	47 Å²	47	24.5 Å²	24.5	22%	0.22	13%	0.131	C	C	.	.			trans	-95.1	30.9	-169	-59.4	179.9	-56.5	0	0	113.6	S414 S416	Q383-S414 PolarHBondContact NE2-O 2.82Å; Q383-S416 VanDerWaalsContact CA-OG 3.27Å; Q383-S416 WeakPolarHBondContact CA-OG 3.29Å; Q383-S416 PolarHBondContact O-OG 2.81Å
384	G	82.3	Confident	90.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.			trans	-69.2	136	178.9	0	0	0	0	0	112.9	F382 Y388 N407 S416	F382-G384 VanDerWaalsContact C-N 3.34Å; F382-G384 PolarHBondContact O-N 2.88Å; G384-Y388 WeakPolarHBondContact CA-OH 3.33Å; G384-N407 WeakPolarHBondContact O-CB 3.33Å; G384-N407 PolarHBondContact O-ND2 3.03Å; G384-S416 PolarHBondContact O-OG 3.03Å
385	T	84.8	Confident	90.2	Very high	28 Å²	28	29.8 Å²	29.8	17%	0.172	17%	0.169	C	C	.	.			trans	-102.5	16.1	-175.9	57.6	0	0	0	0	113.8	N407 A409 N535	T385-N407 CarbonylContact C-O 3.57Å; T385-N407 VanDerWaalsContact C-O 3.29Å; T385-A409 HydrophobicContact CG2-CB 3.88Å; T385-N535 PolarHBondContact OG1-N 3.33Å; T385-N535 VanDerWaalsContact OG1-N 3.11Å; T385-N535 PolarHBondContact OG1-O 3.32Å
386	C	87.4	Confident	89.1	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.027	18%	0.184	C	C	.	.	S	Bend	trans	-101.5	-171.2	-179.8	-44.9	0	0	0	0	111.7	Y388 N407 R527 C534	C386-Y388 HydrophobicContact CB-CD2 4.43Å; C386-Y388 HydrophobicContact CB-CE1 4.43Å; C386-Y388 HydrophobicContact CB-CE2 3.66Å; C386-Y388 WeakPolarHBondContact O-CD2 3.16Å; C386-Y388 WeakPolarHBondContact O-CE2 3.37Å; C386-Y388 PolarHBondContact SG-OH 3.37Å; C386-N407 PolarHBondContact O-N 3.02Å; C386-N407 VanDerWaalsContact O-N 3.08Å; C386-R527 HydrophobicContact CB-CG 4.06Å; C386-C534 HydrophobicContact CB-CB 3.85Å; C386-C534 WeakPolarHBondContact CB-SG 3.25Å; C386-C534 WeakPolarHBondContact SG-CB 3.02Å; C386-C534 CovalentContact SG-SG 2.03Å; C386-C534 PolarHBondContact SG-SG 3.19Å
387	Q	91.8	Very high	87.8	Confident	30 Å²	30	37 Å²	37	14%	0.14	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.7	165.1	-173	166.6	5.7	0	0	110.3	L404 V405 E422 V528	Q387-L404 HydrophobicContact CG-CB 4.18Å; Q387-V405 CarbonylContact C-O 3.54Å; Q387-V405 WeakPolarHBondContact CA-O 3.45Å; Q387-E422 PolarHBondContact NE2-OE2 3.45Å; Q387-E422 VanDerWaalsContact NE2-OE2 3.14Å; Q387-V528 HydrophobicContact CG-CB 4.41Å; Q387-V528 HydrophobicContact CG-CG2 4.39Å; Q387-V528 PolarHBondContact O-N 3.18Å
388	Y	94.3	Very high	86.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.8	-176.5	-59.9	-88.3	0	0	0	111.2	F382 G384 C386 L390 L404 V405 L496 A523 E524 W526 R527	F382-Y388 HydrophobicContact CE1-CD1 4.04Å; F382-Y388 HydrophobicContact CE1-CD2 4.18Å; F382-Y388 AromaticContact CE1-CE1 3.58Å; F382-Y388 HydrophobicContact CE1-CE1 3.58Å; F382-Y388 AromaticContact CE1-CE2 3.72Å; F382-Y388 HydrophobicContact CE1-CE2 3.72Å; F382-Y388 HydrophobicContact CE1-CG 4.34Å; F382-Y388 AromaticContact CE1-CZ 3.41Å; F382-Y388 VanDerWaalsContact CE1-CZ 3.41Å; F382-Y388 HydrophobicContact CZ-CD1 4.49Å; F382-Y388 AromaticContact CZ-CE1 3.68Å; F382-Y388 HydrophobicContact CZ-CE1 3.68Å; F382-Y388 HydrophobicContact CZ-CE2 4.34Å; F382-Y388 AromaticContact CZ-CZ 3.59Å; F382-Y388 WeakPolarHBondContact CZ-OH 3.22Å; G384-Y388 WeakPolarHBondContact CA-OH 3.33Å; C386-Y388 HydrophobicContact CB-CD2 4.43Å; C386-Y388 HydrophobicContact CB-CE1 4.43Å; C386-Y388 HydrophobicContact CB-CE2 3.66Å; C386-Y388 WeakPolarHBondContact O-CD2 3.16Å; C386-Y388 WeakPolarHBondContact O-CE2 3.37Å; C386-Y388 PolarHBondContact SG-OH 3.37Å; Y388-L390 PolarHBondContact O-N 2.88Å; Y388-L404 WeakPolarHBondContact O-CA 3.28Å; Y388-V405 PolarHBondContact N-O 3.05Å; Y388-V405 PolarHBondContact O-N 2.9Å; Y388-L496 HydrophobicContact CG-CD1 4.27Å; Y388-A523 WeakPolarHBondContact CD1-O 3.26Å; Y388-E524 PolarHBondContact OH-OE2 2.99Å; Y388-W526 WeakPolarHBondContact CA-O 2.97Å; Y388-R527 HydrophobicContact CD1-CB 3.91Å; Y388-R527 HydrophobicContact CD1-CG 4.34Å; Y388-R527 HydrophobicContact CE1-CB 3.73Å; Y388-R527 HydrophobicContact CE1-CG 3.97Å
389	V	96.1	Very high	85.4	Confident	12 Å²	12	36 Å²	36	7%	0.073	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	105.4	171.4	-178.8	0	0	0	0	108.8	K392 L404 L496 W526 V528	V389-K392 HydrophobicContact CG1-CB 4.12Å; V389-K392 HydrophobicContact CG1-CD 4.06Å; V389-K392 HydrophobicContact CG1-CG 4.03Å; V389-L404 HydrophobicContact CB-CD2 4.38Å; V389-L404 HydrophobicContact CG2-CD2 3.92Å; V389-L496 WeakPolarHBondContact O-CG 3.5Å; V389-L496 PolarHBondContact O-N 3.3Å; V389-L496 VanDerWaalsContact O-N 3.09Å; V389-W526 HydrophobicContact CB-CE3 4Å; V389-W526 HydrophobicContact CG1-CE3 4.26Å; V389-W526 PolarHBondContact N-O 2.76Å; V389-V528 HydrophobicContact CG2-CG2 3.81Å
390	L	97	Very high	84.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-50.8	176.9	-175.5	59.4	0	0	0	110.1	V366 Y372 Y388 V403 V405 V481 V483 L496 C497	V366-L390 HydrophobicContact CG2-CD1 3.65Å; V366-L390 HydrophobicContact CG2-CD2 4.19Å; Y372-L390 HydrophobicContact CD1-CD1 4.08Å; Y372-L390 HydrophobicContact CE1-CD1 4.01Å; Y388-L390 PolarHBondContact O-N 2.88Å; L390-V403 HydrophobicContact CB-CG1 4.35Å; L390-V403 WeakPolarHBondContact CB-O 3.36Å; L390-V403 HydrophobicContact CD2-CG1 4.2Å; L390-V403 PolarHBondContact N-O 3.3Å; L390-V405 HydrophobicContact CB-CB 4.19Å; L390-V405 HydrophobicContact CB-CG1 4.08Å; L390-V405 HydrophobicContact CD1-CG1 4.38Å; L390-V405 HydrophobicContact CD2-CB 4.41Å; L390-V481 HydrophobicContact CD2-CG1 4.09Å; L390-V483 HydrophobicContact CD2-CG2 3.81Å; L390-L496 HydrophobicContact CD1-CB 4.27Å; L390-L496 PolarHBondContact O-N 3.23Å; L390-L496 VanDerWaalsContact O-N 3.1Å; L390-C497 WeakPolarHBondContact CD1-SG 2.96Å; L390-C497 VanDerWaalsContact CG-SG 3.55Å; L390-C497 WeakPolarHBondContact O-CB 3.39Å; L390-C497 PolarHBondContact O-N 3.03Å; L390-C497 PolarHBondContact O-SG 3.07Å; L390-C497 VanDerWaalsContact O-SG 3.39Å
391	T	97.3	Very high	84.9	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	147.1	170.1	-173.6	0	0	0	0	110.6	F375 V403 V483 C494	F375-T391 HydrophobicContact CZ-CG2 4.28Å; T391-V403 HydrophobicContact CG2-CB 3.92Å; T391-V403 HydrophobicContact CG2-CG2 3.88Å; T391-V403 PolarHBondContact N-O 3.38Å; T391-V403 PolarHBondContact O-N 3.2Å; T391-V483 HydrophobicContact CG2-CG1 4.11Å; T391-C494 CarbonylContact C-O 3.5Å; T391-C494 WeakPolarHBondContact CA-O 3.49Å
392	K	94.5	Very high	85.3	Confident	68 Å²	68	37.2 Å²	37.2	30%	0.296	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.3	169.8	70.8	-179.4	-177.3	-179.9	0	110	V389 C394 F401 Q402 L493 C494	V389-K392 HydrophobicContact CG1-CB 4.12Å; V389-K392 HydrophobicContact CG1-CD 4.06Å; V389-K392 HydrophobicContact CG1-CG 4.03Å; K392-C394 VanDerWaalsContact CG-SG 3.51Å; K392-C394 PolarHBondContact O-SG 2.92Å; K392-F401 WeakPolarHBondContact CA-O 3.41Å; K392-Q402 HydrophobicContact CB-CB 3.67Å; K392-L493 WeakPolarHBondContact O-CA 3.01Å; K392-C494 PolarHBondContact N-O 3.24Å; K392-C494 PolarHBondContact O-N 2.84Å
393	D	92.7	Very high	85.8	Confident	14 Å²	14	37.2 Å²	37.2	8%	0.075	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.7	170.3	-175.5	-16.4	0	0	0	109.9	S395 S399 P400 F401	D393-S395 VanDerWaalsContact OD1-CB 3.29Å; D393-S395 WeakPolarHBondContact OD1-CB 3.23Å; D393-S395 PolarHBondContact OD1-N 3.45Å; D393-S395 PolarHBondContact OD1-OG 2.88Å; D393-S395 PolarHBondContact OD2-OG 3.15Å; D393-S399 PolarHBondContact N-OG 3.37Å; D393-S399 WeakPolarHBondContact O-CB 3.49Å; D393-S399 PolarHBondContact O-OG 3.16Å; D393-P400 HydrophobicContact CB-CG 3.73Å; D393-P400 WeakPolarHBondContact OD2-CD 3.25Å; D393-P400 WeakPolarHBondContact OD2-CG 3.33Å; D393-F401 HydrophobicContact CB-CD1 4.34Å; D393-F401 HydrophobicContact CB-CE1 3.94Å; D393-F401 HydrophobicContact CB-CE2 4.24Å; D393-F401 HydrophobicContact CB-CZ 3.89Å; D393-F401 PolarHBondContact N-O 2.92Å
394	C	90.4	Very high	86.5	Confident	54 Å²	54	35.1 Å²	35.1	37%	0.365	22%	0.222	S	C	.	.			trans	-116.1	9.3	-174.1	-48.7	0	0	0	0	112.1	K392 K492 C494	K392-C394 VanDerWaalsContact CG-SG 3.51Å; K392-C394 PolarHBondContact O-SG 2.92Å; C394-K492 PolarHBondContact N-O 2.96Å; C394-C494 HydrophobicContact CB-CB 3.95Å; C394-C494 WeakPolarHBondContact CB-SG 3.37Å; C394-C494 WeakPolarHBondContact SG-CB 3.3Å; C394-C494 PolarHBondContact SG-N 3.3Å; C394-C494 CovalentContact SG-SG 2Å; C394-C494 PolarHBondContact SG-SG 2.74Å
395	S	85.1	Confident	87.1	Confident	75 Å²	75	35.1 Å²	35.1	52%	0.524	22%	0.222	S	C	.	.	S	Bend	trans	-75.9	-21.4	176.9	66.2	0	0	0	0	113.8	D393	D393-S395 VanDerWaalsContact OD1-CB 3.29Å; D393-S395 WeakPolarHBondContact OD1-CB 3.23Å; D393-S395 PolarHBondContact OD1-N 3.45Å; D393-S395 PolarHBondContact OD1-OG 2.88Å; D393-S395 PolarHBondContact OD2-OG 3.15Å
396	S	72.9	Confident	87.4	Confident	55 Å²	55	35.8 Å²	35.8	39%	0.385	22%	0.222	S	C	.	.	S	Bend	trans	-141.3	145.4	178.2	175.7	0	0	0	0	110.6	A398 S399	S396-A398 PolarHBondContact O-N 2Å; S396-A398 PolarHBondContact OG-N 3.49Å; S396-S399 PolarHBondContact O-N 2.01Å
397	P	64.9	Low	87.5	Confident	142 Å²	142	35.6 Å²	35.6	92%	0.922	22%	0.221	S	C	*	.	S	Bend	trans	-62	-28.7	174.5	22.6	-31.4	0	0	0	112.9	S399	P397-S399 VanDerWaalsContact C-N 3.27Å; P397-S399 PolarHBondContact O-N 3.34Å; P397-S399 VanDerWaalsContact O-N 3.09Å
398	A	64.4	Low	87	Confident	77 Å²	77	37 Å²	37	64%	0.636	23%	0.229	S	C	*	.	S	Bend	trans	-82.2	76.5	166.4	0	0	0	0	0	108.6	S396 P400	S396-A398 PolarHBondContact O-N 2Å; S396-A398 PolarHBondContact OG-N 3.49Å; A398-P400 WeakPolarHBondContact O-CD 3.4Å; A398-P400 VanDerWaalsContact O-N 3.16Å
399	S	64.4	Low	85.7	Confident	43 Å²	43	37.8 Å²	37.8	30%	0.301	24%	0.237	S	C	.	.			trans	-59.7	115.1	-178.2	-170.4	0	0	0	0	110.2	D393 S396 P397 F401	D393-S399 PolarHBondContact N-OG 3.37Å; D393-S399 WeakPolarHBondContact O-CB 3.49Å; D393-S399 PolarHBondContact O-OG 3.16Å; S396-S399 PolarHBondContact O-N 2.01Å; P397-S399 VanDerWaalsContact C-N 3.27Å; P397-S399 PolarHBondContact O-N 3.34Å; P397-S399 VanDerWaalsContact O-N 3.09Å; S399-F401 PolarHBondContact O-N 3.17Å; S399-F401 PolarHBondContact OG-O 2.61Å; S399-F401 VanDerWaalsContact OG-O 3.05Å
400	P	77	Confident	84.2	Confident	61 Å²	61	41.5 Å²	41.5	40%	0.396	25%	0.249	S	C	.	.	S	Bend	trans	-64.3	-23.8	-177.4	23.2	-35.9	0	0	0	113.4	D393 A398	D393-P400 HydrophobicContact CB-CG 3.73Å; D393-P400 WeakPolarHBondContact OD2-CD 3.25Å; D393-P400 WeakPolarHBondContact OD2-CG 3.33Å; A398-P400 WeakPolarHBondContact O-CD 3.4Å; A398-P400 VanDerWaalsContact O-N 3.16Å
401	F	91.9	Very high	82.3	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.018	30%	0.295	C	S	.	.			trans	-154.2	152	175	62.3	-96.9	0	0	0	112.7	K392 D393 S399 V424 L425 A469 L471 L489 L493	K392-F401 WeakPolarHBondContact CA-O 3.41Å; D393-F401 HydrophobicContact CB-CD1 4.34Å; D393-F401 HydrophobicContact CB-CE1 3.94Å; D393-F401 HydrophobicContact CB-CE2 4.24Å; D393-F401 HydrophobicContact CB-CZ 3.89Å; D393-F401 PolarHBondContact N-O 2.92Å; S399-F401 PolarHBondContact O-N 3.17Å; S399-F401 PolarHBondContact OG-O 2.61Å; S399-F401 VanDerWaalsContact OG-O 3.05Å; F401-V424 CarbonylContact C-O 3.51Å; F401-V424 VanDerWaalsContact CA-O 3.24Å; F401-V424 WeakPolarHBondContact CA-O 3.47Å; F401-L425 HydrophobicContact CB-CD2 3.53Å; F401-L425 HydrophobicContact CB-CG 4.31Å; F401-A469 HydrophobicContact CD1-CB 3.68Å; F401-A469 HydrophobicContact CE1-CB 3.94Å; F401-L471 HydrophobicContact CD2-CD1 3.27Å; F401-L471 HydrophobicContact CD2-CG 4.18Å; F401-L471 HydrophobicContact CE1-CG 4.49Å; F401-L471 HydrophobicContact CE2-CD1 3.24Å; F401-L471 HydrophobicContact CE2-CD2 4.21Å; F401-L471 HydrophobicContact CE2-CG 3.8Å; F401-L471 HydrophobicContact CG-CD1 4.01Å; F401-L471 HydrophobicContact CZ-CD1 3.91Å; F401-L471 HydrophobicContact CZ-CD2 4.31Å; F401-L471 HydrophobicContact CZ-CG 3.94Å; F401-L489 HydrophobicContact CE1-CD1 4.45Å; F401-L489 HydrophobicContact CE1-CD2 4.08Å; F401-L489 HydrophobicContact CZ-CD1 4.04Å; F401-L489 HydrophobicContact CZ-CD2 4.09Å; F401-L493 HydrophobicContact CE2-CD2 3.89Å; F401-L493 HydrophobicContact CZ-CD2 3.62Å
402	Q	94.3	Very high	80.1	Confident	66 Å²	66	56.5 Å²	56.5	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.1	166.1	58	178	-7	0	0	110.3	K392 V424	K392-Q402 HydrophobicContact CB-CB 3.67Å; Q402-V424 HydrophobicContact CG-CB 3.55Å; Q402-V424 HydrophobicContact CG-CG1 4.34Å; Q402-V424 HydrophobicContact CG-CG2 3.9Å; Q402-V424 PolarHBondContact N-O 3.43Å; Q402-V424 PolarHBondContact O-N 3.46Å
403	V	97.1	Very high	78	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.8	174.8	-174	0	0	0	0	107.7	L390 T391 V421 E422 L423 L471 I473 V483	L390-V403 HydrophobicContact CB-CG1 4.35Å; L390-V403 WeakPolarHBondContact CB-O 3.36Å; L390-V403 HydrophobicContact CD2-CG1 4.2Å; L390-V403 PolarHBondContact N-O 3.3Å; T391-V403 HydrophobicContact CG2-CB 3.92Å; T391-V403 HydrophobicContact CG2-CG2 3.88Å; T391-V403 PolarHBondContact N-O 3.38Å; T391-V403 PolarHBondContact O-N 3.2Å; V403-V421 HydrophobicContact CG1-CG1 3.76Å; V403-E422 CarbonylContact C-O 3.29Å; V403-E422 WeakPolarHBondContact CA-O 3.41Å; V403-L423 HydrophobicContact CG2-CD1 4.01Å; V403-L471 HydrophobicContact CG2-CD1 3.78Å; V403-I473 HydrophobicContact CG1-CD1 4.04Å; V403-I473 HydrophobicContact CG2-CD1 3.75Å; V403-V483 HydrophobicContact CG1-CG2 4.49Å
404	L	96.2	Very high	75.8	Confident	4 Å²	4	68 Å²	68	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.2	-178.9	-50.4	178.7	0	0	0	109.2	Q387 Y388 V389 V421 E422 V424 V528	Q387-L404 HydrophobicContact CG-CB 4.18Å; Y388-L404 WeakPolarHBondContact O-CA 3.28Å; V389-L404 HydrophobicContact CB-CD2 4.38Å; V389-L404 HydrophobicContact CG2-CD2 3.92Å; L404-V421 CarbonylContact O-C 3.43Å; L404-V421 WeakPolarHBondContact O-CA 3.06Å; L404-E422 HydrophobicContact CB-CB 4.28Å; L404-E422 PolarHBondContact N-O 2.04Å; L404-E422 PolarHBondContact O-N 2.83Å; L404-V424 HydrophobicContact CD1-CG2 4.41Å; L404-V528 HydrophobicContact CD2-CG2 3.95Å
405	V	95	Very high	74.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.7	174.6	66.2	0	0	0	0	108.8	Q387 Y388 L390 T418 L496	Q387-V405 CarbonylContact C-O 3.54Å; Q387-V405 WeakPolarHBondContact CA-O 3.45Å; Y388-V405 PolarHBondContact N-O 3.05Å; Y388-V405 PolarHBondContact O-N 2.9Å; L390-V405 HydrophobicContact CB-CB 4.19Å; L390-V405 HydrophobicContact CB-CG1 4.08Å; L390-V405 HydrophobicContact CD1-CG1 4.38Å; L390-V405 HydrophobicContact CD2-CB 4.41Å; V405-T418 HydrophobicContact CG2-CG2 3.51Å; V405-L496 HydrophobicContact CG1-CD1 4.37Å
406	K	91.5	Very high	73.3	Confident	41 Å²	41	63.6 Å²	63.6	18%	0.178	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.7	173.4	-174.4	170.8	-173.5	164.1	0	108.9	K419 S420 E532	K406-K419 WeakPolarHBondContact O-CB 3.29Å; K406-K419 PolarHBondContact O-N 3.45Å; K406-S420 PolarHBondContact N-O 2.8Å; K406-S420 PolarHBondContact O-N 2.03Å; K406-E532 VanDerWaalsContact CE-OE2 3.27Å; K406-E532 WeakPolarHBondContact CE-OE2 2.99Å; K406-E532 IonicContact NZ-OE1 2.89Å; K406-E532 PolarHBondContact NZ-OE1 3.43Å; K406-E532 IonicContact NZ-OE2 2.66Å; K406-E532 PolarHBondContact NZ-OE2 2.93Å
407	N	88.4	Confident	73.3	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	149.6	176	-63.4	-28	0	0	0	110	Y372 G384 T385 C386 W417 T418	Y372-N407 PolarHBondContact OH-ND2 2.83Å; G384-N407 WeakPolarHBondContact O-CB 3.33Å; G384-N407 PolarHBondContact O-ND2 3.03Å; T385-N407 CarbonylContact C-O 3.57Å; T385-N407 VanDerWaalsContact C-O 3.29Å; C386-N407 PolarHBondContact O-N 3.02Å; C386-N407 VanDerWaalsContact O-N 3.08Å; N407-W417 CarbonylContact C-O 3.48Å; N407-W417 VanDerWaalsContact CA-O 3.23Å; N407-W417 WeakPolarHBondContact CA-O 3.36Å; N407-T418 WeakPolarHBondContact OD1-CA 3.27Å; N407-T418 PolarHBondContact OD1-OG1 2.83Å; N407-T418 VanDerWaalsContact OD1-OG1 3.12Å
408	D	81.3	Confident	74.1	Confident	58 Å²	58	56.2 Å²	56.2	31%	0.31	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	148.6	179.2	-172.8	-10.9	0	0	0	109.6	R410 S416 W417 K419	D408-R410 VanDerWaalsContact C-N 3.27Å; D408-R410 PolarHBondContact O-N 2.94Å; D408-S416 WeakPolarHBondContact O-CA 3.44Å; D408-W417 PolarHBondContact N-O 2.78Å; D408-W417 PolarHBondContact O-N 3.48Å; D408-K419 HydrophobicContact CB-CB 4.11Å; D408-K419 HydrophobicContact CB-CD 3.68Å; D408-K419 HydrophobicContact CB-CG 4.5Å; D408-K419 WeakPolarHBondContact OD2-CD 3.33Å; D408-K419 IonicContact OD2-NZ 2.75Å; D408-K419 PolarHBondContact OD2-NZ 3.08Å
409	A	67.3	Low	75.1	Confident	18 Å²	18	56.1 Å²	56.1	15%	0.149	26%	0.259	C	S	.	.			trans	-80.7	0.7	-173.2	0	0	0	0	0	115.5	T385 R411 T412 F415	T385-A409 HydrophobicContact CG2-CB 3.88Å; A409-R411 PolarHBondContact O-N 2.8Å; A409-T412 WeakPolarHBondContact CB-O 3.43Å; A409-T412 PolarHBondContact O-N 3.38Å; A409-T412 PolarHBondContact O-OG1 3.37Å; A409-F415 WeakPolarHBondContact CA-O 3.45Å; A409-F415 WeakPolarHBondContact CB-O 3.3Å
410	R	64.5	Low	76.4	Confident	90 Å²	90	55 Å²	55	34%	0.34	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.7	42.7	178.7	-64.8	-170.8	-176.7	-162.4	1.5	113.6	D408 T412 W417 D478	D408-R410 VanDerWaalsContact C-N 3.27Å; D408-R410 PolarHBondContact O-N 2.94Å; R410-T412 VanDerWaalsContact C-N 3.34Å; R410-T412 PolarHBondContact O-N 3.44Å; R410-W417 HydrophobicContact CG-CB 4.24Å; R410-W417 HydrophobicContact CG-CG 4.37Å; R410-D478 IonicContact CZ-OD1 2.67Å; R410-D478 VanDerWaalsContact CZ-OD1 3.24Å; R410-D478 IonicContact NH1-OD1 3.81Å; R410-D478 PolarHBondContact NH1-OD1 2.9Å; R410-D478 IonicContact NH1-OD2 3.89Å; R410-D478 PolarHBondContact NH2-O 3.39Å; R410-D478 IonicContact NH2-OD1 3.29Å; R410-D478 PolarHBondContact NH2-OD1 3Å
411	R	56.2	Low	77.3	Confident	258 Å²	258	52.1 Å²	52.1	97%	0.974	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.9	21.5	-179.2	-50.3	178.1	175.6	-178.8	-2.9	115.8	A409	A409-R411 PolarHBondContact O-N 2.8Å
412	T	52.6	Low	77.5	Confident	57 Å²	57	53.1 Å²	53.1	35%	0.35	24%	0.237	S	C	.	.			trans	-113	158.7	171.9	68.8	0	0	0	0	110.4	A409 R410 F415	A409-T412 WeakPolarHBondContact CB-O 3.43Å; A409-T412 PolarHBondContact O-N 3.38Å; A409-T412 PolarHBondContact O-OG1 3.37Å; R410-T412 VanDerWaalsContact C-N 3.34Å; R410-T412 PolarHBondContact O-N 3.44Å; T412-F415 HydrophobicContact CG2-CD2 3.82Å; T412-F415 HydrophobicContact CG2-CE2 4.38Å; T412-F415 WeakPolarHBondContact OG1-CB 3.05Å; T412-F415 VanDerWaalsContact OG1-CD2 3.28Å; T412-F415 WeakPolarHBondContact OG1-CD2 3.47Å; T412-F415 PolarHBondContact OG1-N 2.04Å
413	R	49.4	Very low	77.6	Confident	255 Å²	255	50.1 Å²	50.1	96%	0.962	22%	0.223	S	C	*	.	S	Bend	trans	-89.7	-8.4	176.8	-73.2	-173.4	177	179.6	-0.8	113.8
414	S	48	Very low	77.5	Confident	68 Å²	68	51 Å²	51	48%	0.476	23%	0.229	S	C	.	.	S	Bend	trans	-127.1	-15	-167.8	-50.2	0	0	0	0	115.2	Q383	Q383-S414 PolarHBondContact NE2-O 2.82Å
415	F	61.4	Low	77.2	Confident	38 Å²	38	52 Å²	52	17%	0.167	23%	0.234	C	C	.	.			trans	-108.7	144.7	-178.5	-54.5	-93.8	0	0	0	110.2	D369 A409 T412 E590	D369-F415 HydrophobicContact CB-CD1 4.25Å; A409-F415 WeakPolarHBondContact CA-O 3.45Å; A409-F415 WeakPolarHBondContact CB-O 3.3Å; T412-F415 HydrophobicContact CG2-CD2 3.82Å; T412-F415 HydrophobicContact CG2-CE2 4.38Å; T412-F415 WeakPolarHBondContact OG1-CB 3.05Å; T412-F415 VanDerWaalsContact OG1-CD2 3.28Å; T412-F415 WeakPolarHBondContact OG1-CD2 3.47Å; T412-F415 PolarHBondContact OG1-N 2.04Å; F415-E590 HydrophobicContact CE1-CB 3.49Å; F415-E590 VanDerWaalsContact CE1-CB 3.49Å; F415-E590 HydrophobicContact CE2-CB 4.43Å; F415-E590 HydrophobicContact CZ-CB 3.36Å; F415-E590 WeakPolarHBondContact CZ-O 3.13Å
416	S	60.1	Low	76.8	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.			trans	-126.7	132.4	163.7	71.1	0	0	0	0	109.5	D369 P370 Q383 G384 D408	D369-S416 CarbonylContact C-O 3.54Å; P370-S416 WeakPolarHBondContact CD-O 3.46Å; P370-S416 WeakPolarHBondContact CD-OG 3.33Å; P370-S416 WeakPolarHBondContact CG-O 3.39Å; P370-S416 WeakPolarHBondContact CG-OG 3.07Å; Q383-S416 VanDerWaalsContact CA-OG 3.27Å; Q383-S416 WeakPolarHBondContact CA-OG 3.29Å; Q383-S416 PolarHBondContact O-OG 2.81Å; G384-S416 PolarHBondContact O-OG 3.03Å; D408-S416 WeakPolarHBondContact O-CA 3.44Å
417	W	72.9	Confident	76.5	Confident	40 Å²	40	62.1 Å²	62.1	15%	0.152	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	144.6	-177.7	-70.1	63.3	0	0	0	109	N407 D408 R410 K419 E600	N407-W417 CarbonylContact C-O 3.48Å; N407-W417 VanDerWaalsContact CA-O 3.23Å; N407-W417 WeakPolarHBondContact CA-O 3.36Å; D408-W417 PolarHBondContact N-O 2.78Å; D408-W417 PolarHBondContact O-N 3.48Å; R410-W417 HydrophobicContact CG-CB 4.24Å; R410-W417 HydrophobicContact CG-CG 4.37Å; W417-K419 PolarHBondContact O-N 3.25Å; W417-E600 HydrophobicContact CH2-CG 4.11Å; W417-E600 HydrophobicContact CZ3-CG 4.14Å
418	T	81.4	Confident	76.6	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.012	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	128.2	170.5	-56.9	0	0	0	0	109.7	V405 N407 V421 W475 V481	V405-T418 HydrophobicContact CG2-CG2 3.51Å; N407-T418 WeakPolarHBondContact OD1-CA 3.27Å; N407-T418 PolarHBondContact OD1-OG1 2.83Å; N407-T418 VanDerWaalsContact OD1-OG1 3.12Å; T418-V421 HydrophobicContact CG2-CG2 4.27Å; T418-W475 HydrophobicContact CG2-CH2 3.82Å; T418-W475 HydrophobicContact CG2-CZ3 3.62Å; T418-V481 HydrophobicContact CG2-CG2 3.76Å
419	K	86.6	Confident	77.2	Confident	75 Å²	75	66.4 Å²	66.4	33%	0.326	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-37.7	-178.3	178.3	175.5	-175.5	169.9	0	111.3	K406 D408 W417 Q434	K406-K419 WeakPolarHBondContact O-CB 3.29Å; K406-K419 PolarHBondContact O-N 3.45Å; D408-K419 HydrophobicContact CB-CB 4.11Å; D408-K419 HydrophobicContact CB-CD 3.68Å; D408-K419 HydrophobicContact CB-CG 4.5Å; D408-K419 WeakPolarHBondContact OD2-CD 3.33Å; D408-K419 IonicContact OD2-NZ 2.75Å; D408-K419 PolarHBondContact OD2-NZ 3.08Å; W417-K419 PolarHBondContact O-N 3.25Å; K419-Q434 WeakPolarHBondContact O-CG 3.37Å
420	S	91.6	Very high	78.6	Confident	20 Å²	20	65.6 Å²	65.6	14%	0.14	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	152.2	177.8	57.1	0	0	0	0	111.2	K406 L432	K406-S420 PolarHBondContact N-O 2.8Å; K406-S420 PolarHBondContact O-N 2.03Å; S420-L432 CarbonylContact C-O 3.5Å; S420-L432 WeakPolarHBondContact CA-O 3.46Å; S420-L432 VanDerWaalsContact CB-O 3.26Å; S420-L432 WeakPolarHBondContact CB-O 3.36Å
421	V	96.4	Very high	80	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139	171.4	-176.2	0	0	0	0	108.3	V403 L404 T418 L432 I473 W475 V481	V403-V421 HydrophobicContact CG1-CG1 3.76Å; L404-V421 CarbonylContact O-C 3.43Å; L404-V421 WeakPolarHBondContact O-CA 3.06Å; T418-V421 HydrophobicContact CG2-CG2 4.27Å; V421-L432 HydrophobicContact CB-CB 4.28Å; V421-L432 HydrophobicContact CB-CD1 4.37Å; V421-L432 PolarHBondContact N-O 3.04Å; V421-L432 PolarHBondContact O-N 3.04Å; V421-I473 HydrophobicContact CG1-CG2 4.18Å; V421-W475 HydrophobicContact CG2-CD2 4.46Å; V421-W475 HydrophobicContact CG2-CE3 3.96Å; V421-W475 HydrophobicContact CG2-CZ3 4.27Å; V421-V481 HydrophobicContact CG1-CG1 4.48Å; V421-V481 HydrophobicContact CG2-CB 4.28Å; V421-V481 HydrophobicContact CG2-CG1 3.82Å; V421-V481 HydrophobicContact CG2-CG2 3.4Å; V421-V481 VanDerWaalsContact CG2-CG2 3.4Å
422	E	96.4	Very high	81.8	Confident	25 Å²	25	49.9 Å²	49.9	12%	0.117	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.2	-179.1	176.7	163.8	-119.3	0	0	110.7	Q387 V403 L404 V424 R429 V430	Q387-E422 PolarHBondContact NE2-OE2 3.45Å; Q387-E422 VanDerWaalsContact NE2-OE2 3.14Å; V403-E422 CarbonylContact C-O 3.29Å; V403-E422 WeakPolarHBondContact CA-O 3.41Å; L404-E422 HydrophobicContact CB-CB 4.28Å; L404-E422 PolarHBondContact N-O 2.04Å; L404-E422 PolarHBondContact O-N 2.83Å; E422-V424 HydrophobicContact CG-CG2 4.31Å; E422-R429 HydrophobicContact CG-CG 4.09Å; E422-R429 WeakPolarHBondContact OE1-CD 3.33Å; E422-R429 VanDerWaalsContact OE1-CG 3.26Å; E422-R429 WeakPolarHBondContact OE1-CG 3.43Å; E422-R429 IonicContact OE1-CZ 3.73Å; E422-R429 IonicContact OE1-NE 3.77Å; E422-R429 PolarHBondContact OE1-NE 3.22Å; E422-R429 IonicContact OE1-NH2 2.83Å; E422-R429 IonicContact OE2-CZ 3.96Å; E422-R429 IonicContact OE2-NE 2.88Å; E422-R429 PolarHBondContact OE2-NE 3.37Å; E422-R429 IonicContact OE2-NH2 2.69Å; E422-R429 PolarHBondContact OE2-NH2 2.63Å; E422-V430 CarbonylContact C-O 3.5Å; E422-V430 WeakPolarHBondContact CA-O 3.32Å
423	L	96.4	Very high	83.4	Confident	2 Å²	2	50 Å²	50	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.9	174.8	171.9	66	0	0	0	108.8	V403 L425 V430 V465 T467 I473	V403-L423 HydrophobicContact CG2-CD1 4.01Å; L423-L425 HydrophobicContact CD1-CD1 4.22Å; L423-L425 HydrophobicContact CD1-CG 3.93Å; L423-L425 HydrophobicContact CD2-CD1 3.56Å; L423-L425 HydrophobicContact CD2-CG 4.18Å; L423-L425 HydrophobicContact CG-CD1 3.88Å; L423-L425 HydrophobicContact CG-CG 3.93Å; L423-V430 HydrophobicContact CB-CB 4.34Å; L423-V430 PolarHBondContact N-O 3.46Å; L423-V430 PolarHBondContact O-N 3.48Å; L423-V465 HydrophobicContact CD2-CG1 3.67Å; L423-T467 HydrophobicContact CD2-CG2 3.67Å; L423-I473 HydrophobicContact CB-CD1 4.1Å; L423-I473 HydrophobicContact CD1-CD1 4.07Å; L423-I473 HydrophobicContact CD2-CD1 4.16Å; L423-I473 HydrophobicContact CG-CD1 4.35Å
424	V	94.3	Very high	84.7	Confident	20 Å²	20	40.4 Å²	40.4	12%	0.121	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.1	171.6	-171.9	0	0	0	0	107.9	F401 Q402 L404 E422 S428 R429	F401-V424 CarbonylContact C-O 3.51Å; F401-V424 VanDerWaalsContact CA-O 3.24Å; F401-V424 WeakPolarHBondContact CA-O 3.47Å; Q402-V424 HydrophobicContact CG-CB 3.55Å; Q402-V424 HydrophobicContact CG-CG1 4.34Å; Q402-V424 HydrophobicContact CG-CG2 3.9Å; Q402-V424 PolarHBondContact N-O 3.43Å; Q402-V424 PolarHBondContact O-N 3.46Å; L404-V424 HydrophobicContact CD1-CG2 4.41Å; E422-V424 HydrophobicContact CG-CG2 4.31Å; V424-S428 WeakPolarHBondContact CA-O 3.32Å; V424-R429 HydrophobicContact CG2-CG 4.39Å
425	L	90.6	Very high	85.8	Confident	24 Å²	24	41.7 Å²	41.7	13%	0.126	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	95.8	-179.6	-82.3	166.9	0	0	0	108.4	F401 L423 E427 S428 F454 T467	F401-L425 HydrophobicContact CB-CD2 3.53Å; F401-L425 HydrophobicContact CB-CG 4.31Å; L423-L425 HydrophobicContact CD1-CD1 4.22Å; L423-L425 HydrophobicContact CD1-CG 3.93Å; L423-L425 HydrophobicContact CD2-CD1 3.56Å; L423-L425 HydrophobicContact CD2-CG 4.18Å; L423-L425 HydrophobicContact CG-CD1 3.88Å; L423-L425 HydrophobicContact CG-CG 3.93Å; L425-E427 PolarHBondContact O-N 3.05Å; L425-S428 PolarHBondContact N-O 2.79Å; L425-S428 WeakPolarHBondContact O-CB 3.23Å; L425-S428 PolarHBondContact O-N 3.11Å; L425-F454 HydrophobicContact CD1-CB 4.15Å; L425-F454 HydrophobicContact CD1-CD1 4.05Å; L425-F454 HydrophobicContact CD1-CG 4.44Å; L425-T467 HydrophobicContact CD1-CG2 3.89Å
426	G	86	Confident	86.4	Confident	62 Å²	62	42.9 Å²	42.9	64%	0.639	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	-119.7	-169.3	0	0	0	0	0	110.9
427	E	84.6	Confident	87.2	Confident	192 Å²	192	44 Å²	44	90%	0.897	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.6	176.9	-60.1	-175.9	165	0	0	113.8	L425	L425-E427 PolarHBondContact O-N 3.05Å
428	S	90.3	Very high	87.9	Confident	30 Å²	30	42.2 Å²	42.2	21%	0.21	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.7	-179.1	-71.5	0	0	0	0	111.4	V424 L425	V424-S428 WeakPolarHBondContact CA-O 3.32Å; L425-S428 PolarHBondContact N-O 2.79Å; L425-S428 WeakPolarHBondContact O-CB 3.23Å; L425-S428 PolarHBondContact O-N 3.11Å
429	R	94.3	Very high	88.3	Confident	119 Å²	119	47.1 Å²	47.1	45%	0.449	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	110.7	179.4	-165.2	166.5	-170.6	146.8	8	110.4	E422 V424 W440 N441	E422-R429 HydrophobicContact CG-CG 4.09Å; E422-R429 WeakPolarHBondContact OE1-CD 3.33Å; E422-R429 VanDerWaalsContact OE1-CG 3.26Å; E422-R429 WeakPolarHBondContact OE1-CG 3.43Å; E422-R429 IonicContact OE1-CZ 3.73Å; E422-R429 IonicContact OE1-NE 3.77Å; E422-R429 PolarHBondContact OE1-NE 3.22Å; E422-R429 IonicContact OE1-NH2 2.83Å; E422-R429 IonicContact OE2-CZ 3.96Å; E422-R429 IonicContact OE2-NE 2.88Å; E422-R429 PolarHBondContact OE2-NE 3.37Å; E422-R429 IonicContact OE2-NH2 2.69Å; E422-R429 PolarHBondContact OE2-NH2 2.63Å; V424-R429 HydrophobicContact CG2-CG 4.39Å; R429-W440 WeakPolarHBondContact O-CA 3.36Å; R429-N441 PolarHBondContact N-OD1 2.01Å; R429-N441 PolarHBondContact O-N 2.94Å
430	V	95.8	Very high	88.6	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.8	179.9	179.5	0	0	0	0	108.7	E422 L423 L432 V438 R439 F454 I456	E422-V430 CarbonylContact C-O 3.5Å; E422-V430 WeakPolarHBondContact CA-O 3.32Å; L423-V430 HydrophobicContact CB-CB 4.34Å; L423-V430 PolarHBondContact N-O 3.46Å; L423-V430 PolarHBondContact O-N 3.48Å; V430-L432 HydrophobicContact CG1-CD2 3.99Å; V430-V438 HydrophobicContact CG1-CG1 4.1Å; V430-R439 CarbonylContact C-O 3.58Å; V430-R439 WeakPolarHBondContact CA-O 3.45Å; V430-F454 HydrophobicContact CG2-CD2 4.34Å; V430-F454 HydrophobicContact CG2-CE1 4.03Å; V430-F454 HydrophobicContact CG2-CE2 3.83Å; V430-F454 HydrophobicContact CG2-CZ 3.65Å; V430-I456 HydrophobicContact CG1-CD1 3.58Å; V430-I456 HydrophobicContact CG2-CD1 4.48Å
431	S	95.3	Very high	88.6	Confident	16 Å²	16	50.9 Å²	50.9	11%	0.112	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.3	179.2	179.5	0	0	0	0	110.3	V438 R439	S431-V438 WeakPolarHBondContact O-CA 3.48Å; S431-R439 PolarHBondContact N-O 3.28Å; S431-R439 PolarHBondContact O-N 3.12Å
432	L	93.4	Very high	88.2	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108	174.3	-48.5	-175.6	0	0	0	108.1	S420 V421 V430 V438 L463 V465 I473 W475	S420-L432 CarbonylContact C-O 3.5Å; S420-L432 WeakPolarHBondContact CA-O 3.46Å; S420-L432 VanDerWaalsContact CB-O 3.26Å; S420-L432 WeakPolarHBondContact CB-O 3.36Å; V421-L432 HydrophobicContact CB-CB 4.28Å; V421-L432 HydrophobicContact CB-CD1 4.37Å; V421-L432 PolarHBondContact N-O 3.04Å; V421-L432 PolarHBondContact O-N 3.04Å; V430-L432 HydrophobicContact CG1-CD2 3.99Å; L432-V438 HydrophobicContact CD2-CG1 4.07Å; L432-V438 HydrophobicContact CD2-CG2 4.16Å; L432-L463 HydrophobicContact CD1-CD2 3.92Å; L432-L463 HydrophobicContact CD2-CD2 3.39Å; L432-L463 HydrophobicContact CG-CD2 4.19Å; L432-V465 HydrophobicContact CD1-CG2 3.87Å; L432-V465 HydrophobicContact CD2-CG2 3.88Å; L432-V465 HydrophobicContact CG-CG2 4.4Å; L432-I473 HydrophobicContact CD1-CG2 4.11Å; L432-W475 HydrophobicContact CB-CG 4.22Å; L432-W475 HydrophobicContact CD1-CB 3.97Å
433	Q	85.6	Confident	87.6	Confident	59 Å²	59	56.1 Å²	56.1	28%	0.276	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	169.6	-176.9	-56.4	-172.9	-11.6	0	0	110.4	T437 W475	Q433-T437 WeakPolarHBondContact CB-O 3.43Å; Q433-T437 PolarHBondContact N-O 3.49Å; Q433-W475 PolarHBondContact O-NE1 3.23Å
434	Q	78.1	Confident	87	Confident	53 Å²	53	62.7 Å²	62.7	25%	0.248	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	157.4	173	-53	-170.5	-71.2	0	0	111.5	K419 L436 T437 W475 G477 D478	K419-Q434 WeakPolarHBondContact O-CG 3.37Å; Q434-L436 PolarHBondContact O-N 3.11Å; Q434-T437 PolarHBondContact O-N 3.43Å; Q434-W475 HydrophobicContact CG-CZ2 4.48Å; Q434-G477 CarbonylContact C-O 3.57Å; Q434-G477 VanDerWaalsContact CA-O 3.22Å; Q434-G477 WeakPolarHBondContact CA-O 3.08Å; Q434-D478 PolarHBondContact NE2-O 2.94Å
435	H	70.8	Confident	86.5	Confident	96 Å²	96	63.5 Å²	63.5	44%	0.444	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	36.9	-179.3	-45.4	-24.1	0	0	0	112	T437 G477	H435-T437 PolarHBondContact O-N 3.35Å; H435-G477 PolarHBondContact N-O 3.16Å
436	L	73.1	Confident	85.8	Confident	62 Å²	62	66.2 Å²	66.2	33%	0.325	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	29.9	176.5	-53.2	174.8	0	0	0	113.2	Q434 L458 L463	Q434-L436 PolarHBondContact O-N 3.11Å; L436-L458 HydrophobicContact CD1-CD2 4.44Å; L436-L463 HydrophobicContact CD2-CB 4.13Å
437	T	78.1	Confident	85.4	Confident	23 Å²	23	65.7 Å²	65.7	14%	0.141	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.2	179.4	-67.6	0	0	0	0	109.9	Q433 Q434 H435 R444	Q433-T437 WeakPolarHBondContact CB-O 3.43Å; Q433-T437 PolarHBondContact N-O 3.49Å; Q434-T437 PolarHBondContact O-N 3.43Å; H435-T437 PolarHBondContact O-N 3.35Å; T437-R444 HydrophobicContact CG2-CG 4.31Å
438	V	87.1	Confident	85.4	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.3	176.9	-169.9	0	0	0	0	110.6	V430 S431 L432 R444 I445 L447 I456 L463	V430-V438 HydrophobicContact CG1-CG1 4.1Å; S431-V438 WeakPolarHBondContact O-CA 3.48Å; L432-V438 HydrophobicContact CD2-CG1 4.07Å; L432-V438 HydrophobicContact CD2-CG2 4.16Å; V438-R444 WeakPolarHBondContact O-CA 3.22Å; V438-I445 HydrophobicContact CB-CD1 4.34Å; V438-I445 HydrophobicContact CB-CG1 3.89Å; V438-I445 HydrophobicContact CG1-CD1 3.73Å; V438-I445 HydrophobicContact CG1-CG1 3.76Å; V438-I445 PolarHBondContact O-N 3.4Å; V438-I445 VanDerWaalsContact O-N 3.11Å; V438-L447 HydrophobicContact CG2-CD1 4.32Å; V438-L447 HydrophobicContact CG2-CD2 4.16Å; V438-I456 HydrophobicContact CG1-CD1 3.95Å; V438-L463 HydrophobicContact CG2-CD1 3.15Å; V438-L463 HydrophobicContact CG2-CD2 4.17Å; V438-L463 HydrophobicContact CG2-CG 4.2Å
439	R	89.3	Confident	85	Confident	105 Å²	105	60.2 Å²	60.2	40%	0.396	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.6	167.6	-58.7	-177.6	-179.8	-136.4	3.9	110.4	V430 S431 G442 S443	V430-R439 CarbonylContact C-O 3.58Å; V430-R439 WeakPolarHBondContact CA-O 3.45Å; S431-R439 PolarHBondContact N-O 3.28Å; S431-R439 PolarHBondContact O-N 3.12Å; R439-G442 PolarHBondContact NH1-O 3.46Å; R439-S443 CarbonylContact C-O 3.46Å; R439-S443 WeakPolarHBondContact CA-O 3.27Å
440	W	93.4	Very high	84.7	Confident	82 Å²	82	64.9 Å²	64.9	31%	0.311	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.1	169.9	179.1	25.2	0	0	0	108.3	R429 G442 S443 I445 A451 F454	R429-W440 WeakPolarHBondContact O-CA 3.36Å; W440-G442 PolarHBondContact O-N 3.28Å; W440-S443 PolarHBondContact N-O 3.49Å; W440-S443 PolarHBondContact O-N 3Å; W440-I445 HydrophobicContact CB-CD1 4.1Å; W440-I445 HydrophobicContact CB-CG2 3.94Å; W440-I445 HydrophobicContact CE3-CG2 4.47Å; W440-A451 HydrophobicContact CH2-CB 4.34Å; W440-F454 HydrophobicContact CD2-CZ 4.04Å; W440-F454 AromaticContact CE2-CZ 3.76Å; W440-F454 HydrophobicContact CG-CZ 4.28Å; W440-F454 HydrophobicContact CZ2-CE1 4.5Å; W440-F454 HydrophobicContact CZ2-CZ 4.15Å; W440-F454 AromaticContact NE1-CZ 3.82Å
441	N	91.6	Very high	84.4	Confident	93 Å²	93	65.8 Å²	65.8	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	43.1	-174.9	-64.5	-6	0	0	0	112.4	R429 S443	R429-N441 PolarHBondContact N-OD1 2.01Å; R429-N441 PolarHBondContact O-N 2.94Å; N441-S443 PolarHBondContact O-N 3.49Å
442	G	87.5	Confident	84	Confident	53 Å²	53	69.3 Å²	69.3	55%	0.546	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-20.2	-179.8	0	0	0	0	0	115.5	R439 W440	R439-G442 PolarHBondContact NH1-O 3.46Å; W440-G442 PolarHBondContact O-N 3.28Å
443	S	84.8	Confident	83.7	Confident	81 Å²	81	75.1 Å²	75.1	57%	0.566	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	134.3	-178.2	-65.5	0	0	0	0	111.9	R439 W440 N441	R439-S443 CarbonylContact C-O 3.46Å; R439-S443 WeakPolarHBondContact CA-O 3.27Å; W440-S443 PolarHBondContact N-O 3.49Å; W440-S443 PolarHBondContact O-N 3Å; N441-S443 PolarHBondContact O-N 3.49Å
444	R	83.9	Confident	84	Confident	140 Å²	140	72.6 Å²	72.6	53%	0.528	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	132.7	177.2	-170.6	177.7	-176	-173.6	1.2	110	T437 V438 K673	T437-R444 HydrophobicContact CG2-CG 4.31Å; V438-R444 WeakPolarHBondContact O-CA 3.22Å; R444-K673 PolarHBondContact NH2-O 2.87Å
445	I	83.8	Confident	84.7	Confident	38 Å²	38	72.7 Å²	72.7	20%	0.195	38%	0.382	C	S	.	.			trans	-116.3	156.3	-179.4	59.9	167.4	0	0	0	111.9	V438 W440 C449 I456	V438-I445 HydrophobicContact CB-CD1 4.34Å; V438-I445 HydrophobicContact CB-CG1 3.89Å; V438-I445 HydrophobicContact CG1-CD1 3.73Å; V438-I445 HydrophobicContact CG1-CG1 3.76Å; V438-I445 PolarHBondContact O-N 3.4Å; V438-I445 VanDerWaalsContact O-N 3.11Å; W440-I445 HydrophobicContact CB-CD1 4.1Å; W440-I445 HydrophobicContact CB-CG2 3.94Å; W440-I445 HydrophobicContact CE3-CG2 4.47Å; I445-C449 HydrophobicContact CD1-CB 3.89Å; I445-I456 HydrophobicContact CD1-CD1 4.04Å
446	A	75.6	Confident	85.7	Confident	81 Å²	81	68.1 Å²	68.1	67%	0.669	36%	0.361	S	S	*	.			trans	-88.9	156.8	170.2	0	0	0	0	0	111
447	L	76.8	Confident	86.3	Confident	50 Å²	50	67.7 Å²	67.7	26%	0.262	36%	0.359	S	S	.	.	S	Bend	trans	-112	147.8	178.6	-58.2	177.8	0	0	0	110.1	V438 I456 L458 L463	V438-L447 HydrophobicContact CG2-CD1 4.32Å; V438-L447 HydrophobicContact CG2-CD2 4.16Å; L447-I456 HydrophobicContact CD2-CB 3.95Å; L447-I456 HydrophobicContact CD2-CG2 3.5Å; L447-I456 VanDerWaalsContact CD2-CG2 3.5Å; L447-L458 HydrophobicContact CD1-CD1 4.36Å; L447-L458 HydrophobicContact CD1-CD2 4.13Å; L447-L458 HydrophobicContact CD1-CG 3.96Å; L447-L463 HydrophobicContact CD1-CD1 3.8Å; L447-L463 HydrophobicContact CD1-CG 4.33Å
448	P	84	Confident	86.1	Confident	90 Å²	90	68.3 Å²	68.3	58%	0.584	36%	0.362	S	S	*	.	S	Bend	cis	-71.2	150.1	-4.6	28.7	-34	0	0	0	112.5	I456 D457	P448-I456 CarbonylContact C-O 3.46Å; P448-I456 WeakPolarHBondContact CA-O 3.44Å; P448-D457 HydrophobicContact CB-CB 4.43Å
449	C	83.1	Confident	85.3	Confident	18 Å²	18	72.3 Å²	72.3	12%	0.122	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.1	175.7	-178.5	0	0	0	0	109.8	I445 H455 I456	I445-C449 HydrophobicContact CD1-CB 3.89Å; C449-H455 WeakPolarHBondContact O-CA 3.11Å; C449-H455 PolarHBondContact O-ND1 3.03Å; C449-I456 HydrophobicContact CB-CB 4.33Å; C449-I456 PolarHBondContact N-O 2.94Å; C449-I456 PolarHBondContact O-N 3.2Å
450	R	88.6	Confident	84.2	Confident	216 Å²	216	68.2 Å²	68.2	82%	0.815	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.9	173.6	-74.1	-177.3	-171.1	169.1	6.5	109.5	H455	R450-H455 VanDerWaalsContact CG-ND1 3.34Å; R450-H455 WeakPolarHBondContact CG-ND1 3.17Å
451	A	88.8	Confident	83.1	Confident	20 Å²	20	66.8 Å²	66.8	17%	0.165	37%	0.368	C	S	.	.			trans	-117	167	172.9	0	0	0	0	0	110.1	W440 H453 F454	W440-A451 HydrophobicContact CH2-CB 4.34Å; A451-H453 VanDerWaalsContact C-N 3.26Å; A451-H453 PolarHBondContact O-N 3.01Å; A451-F454 CarbonylContact C-O 3.53Å; A451-F454 WeakPolarHBondContact CA-O 3.12Å; A451-F454 HydrophobicContact CB-CD1 3.99Å; A451-F454 HydrophobicContact CB-CD2 4Å; A451-F454 HydrophobicContact CB-CE1 3.66Å; A451-F454 HydrophobicContact CB-CE2 3.67Å; A451-F454 HydrophobicContact CB-CG 4.14Å; A451-F454 HydrophobicContact CB-CZ 3.49Å; A451-F454 VanDerWaalsContact CB-CZ 3.49Å; A451-F454 WeakPolarHBondContact CB-O 3.47Å; A451-F454 PolarHBondContact N-O 2.92Å
452	P	85.9	Confident	82.3	Confident	90 Å²	90	63.7 Å²	63.7	58%	0.584	35%	0.351	S	S	*	.	S	Bend	trans	-59.2	-32.9	-178.6	-27.2	35.8	0	0	0	114.5	K468	P452-K468 VanDerWaalsContact O-CD 3.29Å; P452-K468 WeakPolarHBondContact O-CD 3.28Å; P452-K468 WeakPolarHBondContact O-CE 3.37Å; P452-K468 PolarHBondContact O-NZ 3.05Å
453	H	87.3	Confident	82.2	Confident	124 Å²	124	61.1 Å²	61.1	57%	0.574	33%	0.325	S	S	*	.	S	Bend	trans	-112.7	-11.7	-174	-60.4	-69.5	0	0	0	114.6	A451 K468	A451-H453 VanDerWaalsContact C-N 3.26Å; A451-H453 PolarHBondContact O-N 3.01Å; H453-K468 PolarHBondContact O-N 3.18Å
454	F	92.9	Very high	82.5	Confident	7 Å²	7	59.2 Å²	59.2	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	157.6	-179.6	64.5	-94.2	0	0	0	111.6	L425 V430 W440 A451 I456 T466 T467	L425-F454 HydrophobicContact CD1-CB 4.15Å; L425-F454 HydrophobicContact CD1-CD1 4.05Å; L425-F454 HydrophobicContact CD1-CG 4.44Å; V430-F454 HydrophobicContact CG2-CD2 4.34Å; V430-F454 HydrophobicContact CG2-CE1 4.03Å; V430-F454 HydrophobicContact CG2-CE2 3.83Å; V430-F454 HydrophobicContact CG2-CZ 3.65Å; W440-F454 HydrophobicContact CD2-CZ 4.04Å; W440-F454 AromaticContact CE2-CZ 3.76Å; W440-F454 HydrophobicContact CG-CZ 4.28Å; W440-F454 HydrophobicContact CZ2-CE1 4.5Å; W440-F454 HydrophobicContact CZ2-CZ 4.15Å; W440-F454 AromaticContact NE1-CZ 3.82Å; A451-F454 CarbonylContact C-O 3.53Å; A451-F454 WeakPolarHBondContact CA-O 3.12Å; A451-F454 HydrophobicContact CB-CD1 3.99Å; A451-F454 HydrophobicContact CB-CD2 4Å; A451-F454 HydrophobicContact CB-CE1 3.66Å; A451-F454 HydrophobicContact CB-CE2 3.67Å; A451-F454 HydrophobicContact CB-CG 4.14Å; A451-F454 HydrophobicContact CB-CZ 3.49Å; A451-F454 VanDerWaalsContact CB-CZ 3.49Å; A451-F454 WeakPolarHBondContact CB-O 3.47Å; A451-F454 PolarHBondContact N-O 2.92Å; F454-I456 HydrophobicContact CD2-CD1 4.02Å; F454-I456 HydrophobicContact CD2-CG1 3.78Å; F454-I456 HydrophobicContact CE2-CD1 3.79Å; F454-I456 HydrophobicContact CE2-CG1 4.01Å; F454-T466 CarbonylContact C-O 3.41Å; F454-T466 VanDerWaalsContact CA-O 3.27Å; F454-T466 WeakPolarHBondContact CA-O 3.23Å; F454-T467 HydrophobicContact CB-CG2 4.34Å
455	H	93.1	Very high	83.1	Confident	55 Å²	55	52.5 Å²	52.5	26%	0.255	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.7	173.9	174.5	41.3	0	0	0	108.6	C449 R450 V465 T466	C449-H455 WeakPolarHBondContact O-CA 3.11Å; C449-H455 PolarHBondContact O-ND1 3.03Å; R450-H455 VanDerWaalsContact CG-ND1 3.34Å; R450-H455 WeakPolarHBondContact CG-ND1 3.17Å; H455-V465 CarbonylContact O-C 3.38Å; H455-V465 WeakPolarHBondContact O-CA 3.05Å; H455-T466 PolarHBondContact N-O 2.99Å; H455-T466 PolarHBondContact O-N 3.03Å
456	I	91.4	Very high	83.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.4	177.6	-44.5	-179	0	0	0	108.1	V430 V438 I445 L447 P448 C449 F454 L463 K464 V465	V430-I456 HydrophobicContact CG1-CD1 3.58Å; V430-I456 HydrophobicContact CG2-CD1 4.48Å; V438-I456 HydrophobicContact CG1-CD1 3.95Å; I445-I456 HydrophobicContact CD1-CD1 4.04Å; L447-I456 HydrophobicContact CD2-CB 3.95Å; L447-I456 HydrophobicContact CD2-CG2 3.5Å; L447-I456 VanDerWaalsContact CD2-CG2 3.5Å; P448-I456 CarbonylContact C-O 3.46Å; P448-I456 WeakPolarHBondContact CA-O 3.44Å; C449-I456 HydrophobicContact CB-CB 4.33Å; C449-I456 PolarHBondContact N-O 2.94Å; C449-I456 PolarHBondContact O-N 3.2Å; F454-I456 HydrophobicContact CD2-CD1 4.02Å; F454-I456 HydrophobicContact CD2-CG1 3.78Å; F454-I456 HydrophobicContact CE2-CD1 3.79Å; F454-I456 HydrophobicContact CE2-CG1 4.01Å; I456-L463 HydrophobicContact CG2-CD2 3.73Å; I456-L463 HydrophobicContact CG2-CG 4.26Å; I456-K464 VanDerWaalsContact CA-O 3.32Å; I456-K464 WeakPolarHBondContact CA-O 3.33Å; I456-V465 HydrophobicContact CD1-CG2 4.4Å; I456-V465 HydrophobicContact CG1-CG1 4.26Å; I456-V465 HydrophobicContact CG1-CG2 4.13Å; I456-V465 HydrophobicContact CG2-CG2 4.06Å
457	D	85	Confident	84.4	Confident	53 Å²	53	50 Å²	50	28%	0.283	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	174.3	176.4	-159.8	6	0	0	0	110.3	P448 K464	P448-D457 HydrophobicContact CB-CB 4.43Å; D457-K464 PolarHBondContact N-O 3.24Å; D457-K464 PolarHBondContact O-N 2.82Å
458	L	74.5	Confident	85	Confident	36 Å²	36	55.5 Å²	55.5	19%	0.188	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.4	168.5	-69.9	168.2	0	0	0	109.2	L436 L447 L463	L436-L458 HydrophobicContact CD1-CD2 4.44Å; L447-L458 HydrophobicContact CD1-CD1 4.36Å; L447-L458 HydrophobicContact CD1-CD2 4.13Å; L447-L458 HydrophobicContact CD1-CG 3.96Å; L458-L463 HydrophobicContact CD2-CB 4.41Å
459	D	69.6	Low	85.2	Confident	87 Å²	87	52.8 Å²	52.8	47%	0.465	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	95.5	171.2	-169.1	8.6	0	0	0	107.7	Y461 L462 K464	D459-Y461 PolarHBondContact O-N 3.25Å; D459-L462 PolarHBondContact N-O 2.96Å; D459-L462 WeakPolarHBondContact O-CB 3.1Å; D459-L462 PolarHBondContact O-N 3Å; D459-L462 VanDerWaalsContact O-N 3.15Å; D459-K464 HydrophobicContact CB-CB 4.12Å; D459-K464 HydrophobicContact CB-CD 3.62Å; D459-K464 WeakPolarHBondContact OD2-CD 3.42Å; D459-K464 IonicContact OD2-NZ 2.63Å; D459-K464 PolarHBondContact OD2-NZ 3.48Å
460	G	66.9	Low	85.6	Confident	19 Å²	19	52.8 Å²	52.8	20%	0.196	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-125.6	-165.8	0	0	0	0	0	111.8
461	Y	69.7	Low	85.9	Confident	52 Å²	52	42.6 Å²	42.6	20%	0.204	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-3	168.9	65.1	-73.7	0	0	0	112.1	D459 D476 R607 A661	D459-Y461 PolarHBondContact O-N 3.25Å; Y461-D476 HydrophobicContact CE2-CB 4.17Å; Y461-R607 PolarHBondContact OH-NE 2.85Å; Y461-R607 PolarHBondContact OH-NH2 2.94Å; Y461-A661 WeakPolarHBondContact CD1-O 3.33Å; Y461-A661 WeakPolarHBondContact CE1-O 3.35Å
462	L	75.7	Confident	86.2	Confident	27 Å²	27	43.8 Å²	43.8	14%	0.141	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.3	178.7	-60.7	179.7	0	0	0	108.6	D459 K464 D476	D459-L462 PolarHBondContact N-O 2.96Å; D459-L462 WeakPolarHBondContact O-CB 3.1Å; D459-L462 PolarHBondContact O-N 3Å; D459-L462 VanDerWaalsContact O-N 3.15Å; L462-K464 PolarHBondContact O-N 2.96Å; L462-D476 HydrophobicContact CD2-CB 3.5Å; L462-D476 VanDerWaalsContact CD2-CB 3.5Å
463	L	84.7	Confident	86.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122.8	168.8	-166.3	145.4	0	0	0	109.1	L432 L436 V438 L447 I456 L458 V465 S474 W475	L432-L463 HydrophobicContact CD1-CD2 3.92Å; L432-L463 HydrophobicContact CD2-CD2 3.39Å; L432-L463 HydrophobicContact CG-CD2 4.19Å; L436-L463 HydrophobicContact CD2-CB 4.13Å; V438-L463 HydrophobicContact CG2-CD1 3.15Å; V438-L463 HydrophobicContact CG2-CD2 4.17Å; V438-L463 HydrophobicContact CG2-CG 4.2Å; L447-L463 HydrophobicContact CD1-CD1 3.8Å; L447-L463 HydrophobicContact CD1-CG 4.33Å; I456-L463 HydrophobicContact CG2-CD2 3.73Å; I456-L463 HydrophobicContact CG2-CG 4.26Å; L458-L463 HydrophobicContact CD2-CB 4.41Å; L463-V465 HydrophobicContact CD2-CG2 3.9Å; L463-S474 CarbonylContact O-C 3.59Å; L463-S474 VanDerWaalsContact O-CA 3.29Å; L463-S474 WeakPolarHBondContact O-CA 3.04Å; L463-W475 HydrophobicContact CB-CB 4.39Å; L463-W475 PolarHBondContact N-O 3.29Å; L463-W475 PolarHBondContact O-N 3.34Å
464	K	91.6	Very high	87	Confident	40 Å²	40	33.9 Å²	33.9	17%	0.174	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121	-171.9	-170.2	171.4	-171.1	160.4	0	110.7	I456 D457 D459 L462 E472 I473	I456-K464 VanDerWaalsContact CA-O 3.32Å; I456-K464 WeakPolarHBondContact CA-O 3.33Å; D457-K464 PolarHBondContact N-O 3.24Å; D457-K464 PolarHBondContact O-N 2.82Å; D459-K464 HydrophobicContact CB-CB 4.12Å; D459-K464 HydrophobicContact CB-CD 3.62Å; D459-K464 WeakPolarHBondContact OD2-CD 3.42Å; D459-K464 IonicContact OD2-NZ 2.63Å; D459-K464 PolarHBondContact OD2-NZ 3.48Å; L462-K464 PolarHBondContact O-N 2.96Å; K464-E472 WeakPolarHBondContact CE-OE1 3.26Å; K464-E472 WeakPolarHBondContact CE-OE2 3.12Å; K464-E472 HydrophobicContact CG-CG 4.17Å; K464-E472 IonicContact NZ-OE1 2.83Å; K464-E472 PolarHBondContact NZ-OE1 3.38Å; K464-E472 IonicContact NZ-OE2 2.94Å; K464-I473 CarbonylContact C-O 3.57Å; K464-I473 WeakPolarHBondContact CA-O 3.02Å
465	V	95.7	Very high	86.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	112.1	173.4	-175.7	0	0	0	0	108.7	L423 L432 H455 I456 L463 T467 E472 I473	L423-V465 HydrophobicContact CD2-CG1 3.67Å; L432-V465 HydrophobicContact CD1-CG2 3.87Å; L432-V465 HydrophobicContact CD2-CG2 3.88Å; L432-V465 HydrophobicContact CG-CG2 4.4Å; H455-V465 CarbonylContact O-C 3.38Å; H455-V465 WeakPolarHBondContact O-CA 3.05Å; I456-V465 HydrophobicContact CD1-CG2 4.4Å; I456-V465 HydrophobicContact CG1-CG1 4.26Å; I456-V465 HydrophobicContact CG1-CG2 4.13Å; I456-V465 HydrophobicContact CG2-CG2 4.06Å; L463-V465 HydrophobicContact CD2-CG2 3.9Å; V465-T467 HydrophobicContact CG1-CG2 4.31Å; V465-E472 CarbonylContact O-C 3.58Å; V465-E472 VanDerWaalsContact O-CA 3.3Å; V465-E472 WeakPolarHBondContact O-CA 3.46Å; V465-I473 HydrophobicContact CB-CB 4.3Å; V465-I473 PolarHBondContact N-O 3.09Å; V465-I473 PolarHBondContact O-N 3.32Å
466	T	94.7	Very high	86.3	Confident	55 Å²	55	32 Å²	32	34%	0.337	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.9	175	-54.1	0	0	0	0	109.5	F454 H455	F454-T466 CarbonylContact C-O 3.41Å; F454-T466 VanDerWaalsContact CA-O 3.27Å; F454-T466 WeakPolarHBondContact CA-O 3.23Å; H455-T466 PolarHBondContact N-O 2.99Å; H455-T466 PolarHBondContact O-N 3.03Å
467	T	93.6	Very high	85.7	Confident	12 Å²	12	32.2 Å²	32.2	7%	0.074	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.2	-177.7	70.2	0	0	0	0	111.4	L423 L425 F454 V465 A469 G470 L471	L423-T467 HydrophobicContact CD2-CG2 3.67Å; L425-T467 HydrophobicContact CD1-CG2 3.89Å; F454-T467 HydrophobicContact CB-CG2 4.34Å; V465-T467 HydrophobicContact CG1-CG2 4.31Å; T467-A469 PolarHBondContact O-N 3.35Å; T467-G470 PolarHBondContact O-N 3.13Å; T467-L471 HydrophobicContact CG2-CB 4.42Å; T467-L471 PolarHBondContact N-O 3.03Å; T467-L471 WeakPolarHBondContact OG1-CA 3.19Å; T467-L471 WeakPolarHBondContact OG1-CB 3.22Å; T467-L471 PolarHBondContact OG1-N 3.34Å; T467-L471 PolarHBondContact OG1-O 2.77Å
468	K	89.3	Confident	85.4	Confident	165 Å²	165	31.6 Å²	31.6	72%	0.717	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.2	171.5	-72.5	-172.6	176.6	170.4	0	113.2	P452 H453 G470	P452-K468 VanDerWaalsContact O-CD 3.29Å; P452-K468 WeakPolarHBondContact O-CD 3.28Å; P452-K468 WeakPolarHBondContact O-CE 3.37Å; P452-K468 PolarHBondContact O-NZ 3.05Å; H453-K468 PolarHBondContact O-N 3.18Å; K468-G470 PolarHBondContact O-N 3.05Å
469	A	87.2	Confident	85.7	Confident	32 Å²	32	29.9 Å²	29.9	26%	0.264	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.8	175.5	0	0	0	0	0	113.1	F401 T467 H488	F401-A469 HydrophobicContact CD1-CB 3.68Å; F401-A469 HydrophobicContact CE1-CB 3.94Å; T467-A469 PolarHBondContact O-N 3.35Å; A469-H488 PolarHBondContact O-NE2 2.63Å
470	G	90.8	Very high	86.6	Confident	18 Å²	18	25.9 Å²	25.9	19%	0.186	14%	0.141	C	C	.	.	S	Bend	trans	97.8	15.9	179.6	0	0	0	0	0	114.6	T467 K468 A486	T467-G470 PolarHBondContact O-N 3.13Å; K468-G470 PolarHBondContact O-N 3.05Å; G470-A486 VanDerWaalsContact O-CB 3.23Å; G470-A486 WeakPolarHBondContact O-CB 3.25Å; G470-A486 PolarHBondContact O-N 3.41Å
471	L	94.9	Very high	87.9	Confident	2 Å²	2	25 Å²	25	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	141.6	166.2	-68.5	-174	0	0	0	111.6	F401 V403 T467 V483 M484 A485 L489	F401-L471 HydrophobicContact CD2-CD1 3.27Å; F401-L471 HydrophobicContact CD2-CG 4.18Å; F401-L471 HydrophobicContact CE1-CG 4.49Å; F401-L471 HydrophobicContact CE2-CD1 3.24Å; F401-L471 HydrophobicContact CE2-CD2 4.21Å; F401-L471 HydrophobicContact CE2-CG 3.8Å; F401-L471 HydrophobicContact CG-CD1 4.01Å; F401-L471 HydrophobicContact CZ-CD1 3.91Å; F401-L471 HydrophobicContact CZ-CD2 4.31Å; F401-L471 HydrophobicContact CZ-CG 3.94Å; V403-L471 HydrophobicContact CG2-CD1 3.78Å; T467-L471 HydrophobicContact CG2-CB 4.42Å; T467-L471 PolarHBondContact N-O 3.03Å; T467-L471 WeakPolarHBondContact OG1-CA 3.19Å; T467-L471 WeakPolarHBondContact OG1-CB 3.22Å; T467-L471 PolarHBondContact OG1-N 3.34Å; T467-L471 PolarHBondContact OG1-O 2.77Å; L471-V483 HydrophobicContact CD2-CG1 4.17Å; L471-M484 WeakPolarHBondContact CA-O 3.34Å; L471-A485 HydrophobicContact CD2-CB 3.97Å; L471-L489 HydrophobicContact CD2-CD1 3.79Å; L471-L489 HydrophobicContact CG-CD1 4.23Å
472	E	95.8	Very high	89.1	Confident	46 Å²	46	23.5 Å²	23.5	22%	0.215	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.2	168.4	178.1	171	121.8	0	0	109.1	K464 V465 V483 M484	K464-E472 WeakPolarHBondContact CE-OE1 3.26Å; K464-E472 WeakPolarHBondContact CE-OE2 3.12Å; K464-E472 HydrophobicContact CG-CG 4.17Å; K464-E472 IonicContact NZ-OE1 2.83Å; K464-E472 PolarHBondContact NZ-OE1 3.38Å; K464-E472 IonicContact NZ-OE2 2.94Å; V465-E472 CarbonylContact O-C 3.58Å; V465-E472 VanDerWaalsContact O-CA 3.3Å; V465-E472 WeakPolarHBondContact O-CA 3.46Å; E472-V483 CarbonylContact O-C 3.56Å; E472-V483 WeakPolarHBondContact O-CA 3.25Å; E472-M484 HydrophobicContact CB-CB 4.24Å; E472-M484 PolarHBondContact N-O 2.91Å; E472-M484 PolarHBondContact O-N 3.42Å
473	I	96.9	Very high	90.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.2	-177	-54.2	170.6	0	0	0	108.5	V403 V421 L423 L432 K464 V465 V481 E482 V483	V403-I473 HydrophobicContact CG1-CD1 4.04Å; V403-I473 HydrophobicContact CG2-CD1 3.75Å; V421-I473 HydrophobicContact CG1-CG2 4.18Å; L423-I473 HydrophobicContact CB-CD1 4.1Å; L423-I473 HydrophobicContact CD1-CD1 4.07Å; L423-I473 HydrophobicContact CD2-CD1 4.16Å; L423-I473 HydrophobicContact CG-CD1 4.35Å; L432-I473 HydrophobicContact CD1-CG2 4.11Å; K464-I473 CarbonylContact C-O 3.57Å; K464-I473 WeakPolarHBondContact CA-O 3.02Å; V465-I473 HydrophobicContact CB-CB 4.3Å; V465-I473 PolarHBondContact N-O 3.09Å; V465-I473 PolarHBondContact O-N 3.32Å; I473-V481 HydrophobicContact CG2-CG1 4.47Å; I473-E482 CarbonylContact C-O 3.55Å; I473-E482 WeakPolarHBondContact CA-O 3.27Å; I473-V483 HydrophobicContact CG1-CG1 4.42Å; I473-V483 HydrophobicContact CG1-CG2 4.4Å; I473-V483 HydrophobicContact CG2-CG2 4.44Å
474	S	93.6	Very high	90.6	Very high	6 Å²	6	24 Å²	24	4%	0.042	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.5	176.2	-60.7	0	0	0	0	110	L463 V481 E482	L463-S474 CarbonylContact O-C 3.59Å; L463-S474 VanDerWaalsContact O-CA 3.29Å; L463-S474 WeakPolarHBondContact O-CA 3.04Å; S474-V481 WeakPolarHBondContact O-CA 3.36Å; S474-E482 PolarHBondContact N-O 2.83Å; S474-E482 PolarHBondContact O-N 3.27Å
475	W	90.4	Very high	90.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.5	-177.8	171.5	-116.7	0	0	0	110.3	T418 V421 L432 Q433 Q434 L463 G477 D478 V481	T418-W475 HydrophobicContact CG2-CH2 3.82Å; T418-W475 HydrophobicContact CG2-CZ3 3.62Å; V421-W475 HydrophobicContact CG2-CD2 4.46Å; V421-W475 HydrophobicContact CG2-CE3 3.96Å; V421-W475 HydrophobicContact CG2-CZ3 4.27Å; L432-W475 HydrophobicContact CB-CG 4.22Å; L432-W475 HydrophobicContact CD1-CB 3.97Å; Q433-W475 PolarHBondContact O-NE1 3.23Å; Q434-W475 HydrophobicContact CG-CZ2 4.48Å; L463-W475 HydrophobicContact CB-CB 4.39Å; L463-W475 PolarHBondContact N-O 3.29Å; L463-W475 PolarHBondContact O-N 3.34Å; W475-G477 VanDerWaalsContact C-N 3.32Å; W475-G477 VanDerWaalsContact NE1-CA 3.27Å; W475-G477 PolarHBondContact O-N 3.42Å; W475-D478 VanDerWaalsContact CH2-O 3.27Å; W475-D478 WeakPolarHBondContact CH2-O 3.34Å; W475-V481 HydrophobicContact CE3-CG2 3.67Å; W475-V481 HydrophobicContact CZ3-CG2 3.62Å
476	D	80.6	Confident	90.7	Very high	21 Å²	21	23.1 Å²	23.1	11%	0.112	13%	0.129	C	C	.	.			trans	-84.8	-3.6	-177.2	73.4	-10	0	0	0	114.9	Y461 L462 D478 S479 F480 R607	Y461-D476 HydrophobicContact CE2-CB 4.17Å; L462-D476 HydrophobicContact CD2-CB 3.5Å; L462-D476 VanDerWaalsContact CD2-CB 3.5Å; D476-D478 VanDerWaalsContact C-N 3.34Å; D476-D478 PolarHBondContact OD1-N 2.87Å; D476-S479 PolarHBondContact OD1-N 2.76Å; D476-F480 HydrophobicContact CB-CB 4.14Å; D476-F480 VanDerWaalsContact CG-CB 3.48Å; D476-F480 PolarHBondContact N-O 3.05Å; D476-F480 PolarHBondContact OD1-N 3.44Å; D476-F480 WeakPolarHBondContact OD2-CB 3.47Å; D476-F480 PolarHBondContact OD2-N 2.56Å; D476-R607 IonicContact OD2-NH2 3.24Å
477	G	78.3	Confident	90.5	Very high	6 Å²	6	22.7 Å²	22.7	6%	0.062	13%	0.127	C	C	.	.	S	Bend	trans	85.5	1.8	-176.9	0	0	0	0	0	114.4	Q434 H435 W475	Q434-G477 CarbonylContact C-O 3.57Å; Q434-G477 VanDerWaalsContact CA-O 3.22Å; Q434-G477 WeakPolarHBondContact CA-O 3.08Å; H435-G477 PolarHBondContact N-O 3.16Å; W475-G477 VanDerWaalsContact C-N 3.32Å; W475-G477 VanDerWaalsContact NE1-CA 3.27Å; W475-G477 PolarHBondContact O-N 3.42Å
478	D	78.4	Confident	90.3	Very high	39 Å²	39	27 Å²	27	21%	0.209	15%	0.146	C	C	.	.	S	Bend	trans	-128	-66.7	178.4	-168.5	11.1	0	0	0	112.8	R410 Q434 W475 D476	R410-D478 IonicContact CZ-OD1 2.67Å; R410-D478 VanDerWaalsContact CZ-OD1 3.24Å; R410-D478 IonicContact NH1-OD1 3.81Å; R410-D478 PolarHBondContact NH1-OD1 2.9Å; R410-D478 IonicContact NH1-OD2 3.89Å; R410-D478 PolarHBondContact NH2-O 3.39Å; R410-D478 IonicContact NH2-OD1 3.29Å; R410-D478 PolarHBondContact NH2-OD1 3Å; Q434-D478 PolarHBondContact NE2-O 2.94Å; W475-D478 VanDerWaalsContact CH2-O 3.27Å; W475-D478 WeakPolarHBondContact CH2-O 3.34Å; D476-D478 VanDerWaalsContact C-N 3.34Å; D476-D478 PolarHBondContact OD1-N 2.87Å
479	S	80.8	Confident	90.5	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.007	11%	0.114	C	C	.	.	S	Bend	trans	-153.3	-19.1	-172.4	64.8	0	0	0	0	115	D476	D476-S479 PolarHBondContact OD1-N 2.76Å
480	F	88.3	Confident	90.7	Very high	2 Å²	2	22 Å²	22	1%	0.009	12%	0.119	C	C	.	.			trans	-83.6	124.7	-178.9	179.7	-94.9	0	0	0	111.5	T365 V366 F367 D476 E482 A604 R607	T365-F480 HydrophobicContact CG2-CZ 4.3Å; V366-F480 WeakPolarHBondContact O-CA 3.37Å; F367-F480 HydrophobicContact CB-CD2 3.79Å; F367-F480 HydrophobicContact CB-CE2 4.37Å; D476-F480 HydrophobicContact CB-CB 4.14Å; D476-F480 VanDerWaalsContact CG-CB 3.48Å; D476-F480 PolarHBondContact N-O 3.05Å; D476-F480 PolarHBondContact OD1-N 3.44Å; D476-F480 WeakPolarHBondContact OD2-CB 3.47Å; D476-F480 PolarHBondContact OD2-N 2.56Å; F480-E482 HydrophobicContact CE1-CB 3.65Å; F480-E482 HydrophobicContact CZ-CB 3.91Å; F480-A604 HydrophobicContact CD2-CB 4.48Å; F480-A604 HydrophobicContact CE2-CB 4.13Å; F480-R607 VanDerWaalsContact CB-NH1 3.27Å; F480-R607 VanDerWaalsContact CD1-NH1 3.35Å
481	V	94.1	Very high	90.8	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.6	171.3	-167.8	0	0	0	0	108.9	T365 V366 L390 T418 V421 I473 S474 W475 V483	T365-V481 CarbonylContact C-O 3.55Å; T365-V481 VanDerWaalsContact CA-O 3.27Å; T365-V481 WeakPolarHBondContact CA-O 3.28Å; V366-V481 HydrophobicContact CB-CB 4.05Å; V366-V481 HydrophobicContact CB-CG2 4.22Å; V366-V481 HydrophobicContact CG2-CB 4.29Å; V366-V481 PolarHBondContact N-O 2.92Å; V366-V481 PolarHBondContact O-N 2.83Å; L390-V481 HydrophobicContact CD2-CG1 4.09Å; T418-V481 HydrophobicContact CG2-CG2 3.76Å; V421-V481 HydrophobicContact CG1-CG1 4.48Å; V421-V481 HydrophobicContact CG2-CB 4.28Å; V421-V481 HydrophobicContact CG2-CG1 3.82Å; V421-V481 HydrophobicContact CG2-CG2 3.4Å; V421-V481 VanDerWaalsContact CG2-CG2 3.4Å; I473-V481 HydrophobicContact CG2-CG1 4.47Å; S474-V481 WeakPolarHBondContact O-CA 3.36Å; W475-V481 HydrophobicContact CE3-CG2 3.67Å; W475-V481 HydrophobicContact CZ3-CG2 3.62Å; V481-V483 HydrophobicContact CG1-CG2 4.11Å
482	E	94.9	Very high	90.8	Very high	21 Å²	21	27.8 Å²	27.8	10%	0.098	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.2	165	177	178.3	94.6	0	0	108.9	V363 C364 T365 I473 S474 F480 R611	V363-E482 HydrophobicContact CG1-CG 3.65Å; C364-E482 CarbonylContact O-C 3.43Å; C364-E482 WeakPolarHBondContact O-CA 3.03Å; T365-E482 HydrophobicContact CG2-CB 4.23Å; T365-E482 HydrophobicContact CG2-CG 4.07Å; I473-E482 CarbonylContact C-O 3.55Å; I473-E482 WeakPolarHBondContact CA-O 3.27Å; S474-E482 PolarHBondContact N-O 2.83Å; S474-E482 PolarHBondContact O-N 3.27Å; F480-E482 HydrophobicContact CE1-CB 3.65Å; F480-E482 HydrophobicContact CZ-CB 3.91Å; E482-R611 IonicContact OE2-CZ 3.97Å; E482-R611 IonicContact OE2-NH1 2.69Å; E482-R611 PolarHBondContact OE2-NH1 2.04Å
483	V	97.4	Very high	90.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.6	174	-176.4	0	0	0	0	107.4	C364 F375 L390 T391 V403 L471 E472 I473 V481	C364-V483 HydrophobicContact CB-CB 4.46Å; C364-V483 PolarHBondContact N-O 3.13Å; C364-V483 PolarHBondContact O-N 2.87Å; F375-V483 HydrophobicContact CE1-CG1 4.38Å; F375-V483 WeakPolarHBondContact CE1-O 3.29Å; F375-V483 HydrophobicContact CZ-CG1 4.15Å; L390-V483 HydrophobicContact CD2-CG2 3.81Å; T391-V483 HydrophobicContact CG2-CG1 4.11Å; V403-V483 HydrophobicContact CG1-CG2 4.49Å; L471-V483 HydrophobicContact CD2-CG1 4.17Å; E472-V483 CarbonylContact O-C 3.56Å; E472-V483 WeakPolarHBondContact O-CA 3.25Å; I473-V483 HydrophobicContact CG1-CG1 4.42Å; I473-V483 HydrophobicContact CG1-CG2 4.4Å; I473-V483 HydrophobicContact CG2-CG2 4.44Å; V481-V483 HydrophobicContact CG1-CG2 4.11Å
484	M	95.6	Very high	90.7	Very high	37 Å²	37	27.1 Å²	27.1	18%	0.182	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.1	174.1	-175.8	-179.4	-63.1	0	0	109.5	P361 G362 V363 L471 E472	P361-M484 HydrophobicContact CB-CG 3.61Å; P361-M484 HydrophobicContact CB-SD 3.9Å; P361-M484 HydrophobicContact CG-CE 4.48Å; P361-M484 HydrophobicContact CG-CG 3.92Å; P361-M484 HydrophobicContact CG-SD 3.55Å; P361-M484 VanDerWaalsContact CG-SD 3.55Å; G362-M484 CarbonylContact O-C 3.59Å; G362-M484 WeakPolarHBondContact O-CA 3.28Å; V363-M484 HydrophobicContact CG2-CE 4.06Å; V363-M484 HydrophobicContact CG2-CG 4.22Å; L471-M484 WeakPolarHBondContact CA-O 3.34Å; E472-M484 HydrophobicContact CB-CB 4.24Å; E472-M484 PolarHBondContact N-O 2.91Å; E472-M484 PolarHBondContact O-N 3.42Å
485	A	95.9	Very high	90.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	128.2	179.2	0	0	0	0	0	110.6	P361 G362 F375 L471 L489 L493 Y500	P361-A485 CarbonylContact C-O 3.6Å; P361-A485 VanDerWaalsContact CA-O 3.26Å; P361-A485 WeakPolarHBondContact CA-O 3.23Å; P361-A485 WeakPolarHBondContact CB-O 3.39Å; G362-A485 PolarHBondContact N-O 3.41Å; G362-A485 PolarHBondContact O-N 2.88Å; F375-A485 HydrophobicContact CD1-CB 4.21Å; F375-A485 HydrophobicContact CE1-CB 3.7Å; F375-A485 HydrophobicContact CZ-CB 4Å; L471-A485 HydrophobicContact CD2-CB 3.97Å; A485-L489 HydrophobicContact CB-CD1 4.27Å; A485-L493 HydrophobicContact CB-CD1 3.75Å; A485-Y500 HydrophobicContact CB-CD1 4.13Å; A485-Y500 HydrophobicContact CB-CE1 3.93Å; A485-Y500 PolarHBondContact O-OH 2.7Å
486	A	93	Very high	91.1	Very high	22 Å²	22	26.9 Å²	26.9	18%	0.182	15%	0.152	C	C	.	.			trans	-65.1	150	176.1	0	0	0	0	0	111.7	G470 H488 L489	G470-A486 VanDerWaalsContact O-CB 3.23Å; G470-A486 WeakPolarHBondContact O-CB 3.25Å; G470-A486 PolarHBondContact O-N 3.41Å; A486-H488 WeakPolarHBondContact CB-CE1 3.38Å; A486-H488 WeakPolarHBondContact CB-ND1 2.98Å; A486-H488 PolarHBondContact O-N 3.22Å; A486-L489 WeakPolarHBondContact O-CB 3.47Å; A486-L489 PolarHBondContact O-N 2.92Å
487	P	90.9	Very high	91.9	Very high	45 Å²	45	25.9 Å²	25.9	29%	0.292	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-54.9	-27.8	-175.6	-31.1	37.1	0	0	0	116.6	E359 L489 K490	E359-P487 HydrophobicContact CB-CB 4.03Å; E359-P487 HydrophobicContact CB-CG 4.09Å; E359-P487 VanDerWaalsContact O-CG 3.23Å; E359-P487 WeakPolarHBondContact O-CG 3.41Å; P487-L489 PolarHBondContact O-N 3.28Å; P487-K490 VanDerWaalsContact O-CB 3.25Å; P487-K490 WeakPolarHBondContact O-CB 3.38Å; P487-K490 PolarHBondContact O-N 3.22Å
488	H	89.2	Confident	92.8	Very high	104 Å²	104	25.7 Å²	25.7	48%	0.481	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-71.9	-9	179.4	65.6	-90.2	0	0	0	114.2	A469 A486 K492	A469-H488 PolarHBondContact O-NE2 2.63Å; A486-H488 WeakPolarHBondContact CB-CE1 3.38Å; A486-H488 WeakPolarHBondContact CB-ND1 2.98Å; A486-H488 PolarHBondContact O-N 3.22Å; H488-K492 PolarHBondContact O-NZ 3.32Å
489	L	92.8	Very high	93.6	Very high	6 Å²	6	25.2 Å²	25.2	3%	0.031	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-90.1	-3	174.4	-62.4	175.1	0	0	0	112.9	F401 L471 A485 A486 P487 G491 K492 L493 Y500	F401-L489 HydrophobicContact CE1-CD1 4.45Å; F401-L489 HydrophobicContact CE1-CD2 4.08Å; F401-L489 HydrophobicContact CZ-CD1 4.04Å; F401-L489 HydrophobicContact CZ-CD2 4.09Å; L471-L489 HydrophobicContact CD2-CD1 3.79Å; L471-L489 HydrophobicContact CG-CD1 4.23Å; A485-L489 HydrophobicContact CB-CD1 4.27Å; A486-L489 WeakPolarHBondContact O-CB 3.47Å; A486-L489 PolarHBondContact O-N 2.92Å; P487-L489 PolarHBondContact O-N 3.28Å; L489-G491 PolarHBondContact O-N 2.63Å; L489-K492 WeakPolarHBondContact O-CB 3.37Å; L489-K492 PolarHBondContact O-N 2.77Å; L489-L493 HydrophobicContact CB-CD1 4.25Å; L489-L493 HydrophobicContact CB-CD2 4.18Å; L489-L493 HydrophobicContact CB-CG 4.19Å; L489-Y500 HydrophobicContact CB-CD1 4.42Å; L489-Y500 HydrophobicContact CB-CE1 4.38Å
490	K	92.8	Very high	94.3	Very high	85 Å²	85	25.6 Å²	25.6	37%	0.37	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	128.5	-179.9	-161	-180	-168.6	173.1	0	111.4	E359 P487 K492 Y500	E359-K490 IonicContact OE1-NZ 3.88Å; E359-K490 WeakPolarHBondContact OE2-CD 3.08Å; E359-K490 IonicContact OE2-NZ 3.43Å; E359-K490 PolarHBondContact OE2-NZ 3.16Å; P487-K490 VanDerWaalsContact O-CB 3.25Å; P487-K490 WeakPolarHBondContact O-CB 3.38Å; P487-K490 PolarHBondContact O-N 3.22Å; K490-K492 PolarHBondContact O-N 2.86Å; K490-Y500 CarbonylContact C-O 3.47Å; K490-Y500 VanDerWaalsContact CA-CD1 3.48Å; K490-Y500 VanDerWaalsContact CA-O 3.3Å; K490-Y500 WeakPolarHBondContact CA-O 3.31Å; K490-Y500 HydrophobicContact CB-CD1 4.24Å; K490-Y500 HydrophobicContact CB-CE1 4.01Å; K490-Y500 HydrophobicContact CG-CE1 4.47Å; K490-Y500 HydrophobicContact CG-CE2 4.48Å; K490-Y500 WeakPolarHBondContact CG-O 3.45Å
491	G	92.7	Very high	94.5	Very high	52 Å²	52	27.8 Å²	27.8	54%	0.536	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	6.5	-177.5	0	0	0	0	0	115.3	L489 Y500	L489-G491 PolarHBondContact O-N 2.63Å; G491-Y500 PolarHBondContact N-O 2.05Å
492	K	93.8	Very high	94.3	Very high	90 Å²	90	30 Å²	30	39%	0.391	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-11.3	179.2	-60.7	179.3	-176.4	162.9	0	113.3	C394 H488 L489 K490	C394-K492 PolarHBondContact N-O 2.96Å; H488-K492 PolarHBondContact O-NZ 3.32Å; L489-K492 WeakPolarHBondContact O-CB 3.37Å; L489-K492 PolarHBondContact O-N 2.77Å; K490-K492 PolarHBondContact O-N 2.86Å
493	L	95.4	Very high	94.1	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	156.3	-176.6	-56.5	-175.7	0	0	0	110.8	F375 K392 F401 A485 L489 N499 Y500	F375-L493 HydrophobicContact CD2-CD1 4.06Å; F375-L493 HydrophobicContact CE2-CB 4.48Å; F375-L493 HydrophobicContact CE2-CD1 3.48Å; F375-L493 VanDerWaalsContact CE2-CD1 3.48Å; F375-L493 HydrophobicContact CZ-CD1 3.83Å; K392-L493 WeakPolarHBondContact O-CA 3.01Å; F401-L493 HydrophobicContact CE2-CD2 3.89Å; F401-L493 HydrophobicContact CZ-CD2 3.62Å; A485-L493 HydrophobicContact CB-CD1 3.75Å; L489-L493 HydrophobicContact CB-CD1 4.25Å; L489-L493 HydrophobicContact CB-CD2 4.18Å; L489-L493 HydrophobicContact CB-CG 4.19Å; L493-N499 VanDerWaalsContact O-CA 3.23Å; L493-N499 WeakPolarHBondContact O-CA 3.44Å; L493-Y500 HydrophobicContact CD1-CD1 3.89Å; L493-Y500 HydrophobicContact CD1-CG 4.43Å; L493-Y500 HydrophobicContact CG-CD1 4.42Å
494	C	95.2	Very high	93.9	Very high	27 Å²	27	40.8 Å²	40.8	18%	0.182	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	162.8	163.8	72.8	0	0	0	0	110.5	T391 K392 C394 G498 W526	T391-C494 CarbonylContact C-O 3.5Å; T391-C494 WeakPolarHBondContact CA-O 3.49Å; K392-C494 PolarHBondContact N-O 3.24Å; K392-C494 PolarHBondContact O-N 2.84Å; C394-C494 HydrophobicContact CB-CB 3.95Å; C394-C494 WeakPolarHBondContact CB-SG 3.37Å; C394-C494 WeakPolarHBondContact SG-CB 3.3Å; C394-C494 PolarHBondContact SG-N 3.3Å; C394-C494 CovalentContact SG-SG 2Å; C394-C494 PolarHBondContact SG-SG 2.74Å; C494-G498 WeakPolarHBondContact CA-O 3.03Å; C494-W526 HydrophobicContact CB-CH2 3.81Å; C494-W526 HydrophobicContact CB-CZ2 4.19Å; C494-W526 WeakPolarHBondContact SG-CH2 3.41Å
495	G	96.2	Very high	93.6	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	26%	0.257	C	S	.	.	S	Bend	trans	136.4	-166.7	-175.6	0	0	0	0	0	112.2	C497 G498	G495-C497 PolarHBondContact O-N 2.9Å; G495-G498 PolarHBondContact O-N 2.92Å
496	L	97.2	Very high	93.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.5	174.8	-65.5	179.8	0	0	0	113.5	Y372 F380 Y388 V389 L390 V405 G498 F522 A523 W526	Y372-L496 HydrophobicContact CD1-CB 4.28Å; Y372-L496 HydrophobicContact CD1-CD1 4.42Å; Y372-L496 HydrophobicContact CE1-CB 4.37Å; Y372-L496 HydrophobicContact CE1-CD1 3.74Å; F380-L496 WeakPolarHBondContact CE1-O 3.11Å; F380-L496 HydrophobicContact CZ-CB 4.37Å; F380-L496 WeakPolarHBondContact CZ-O 3.41Å; Y388-L496 HydrophobicContact CG-CD1 4.27Å; V389-L496 WeakPolarHBondContact O-CG 3.5Å; V389-L496 PolarHBondContact O-N 3.3Å; V389-L496 VanDerWaalsContact O-N 3.09Å; L390-L496 HydrophobicContact CD1-CB 4.27Å; L390-L496 PolarHBondContact O-N 3.23Å; L390-L496 VanDerWaalsContact O-N 3.1Å; V405-L496 HydrophobicContact CG1-CD1 4.37Å; L496-G498 PolarHBondContact O-N 3.42Å; L496-F522 HydrophobicContact CD2-CE1 3.91Å; L496-F522 HydrophobicContact CD2-CZ 4.27Å; L496-A523 HydrophobicContact CD2-CB 3.58Å; L496-W526 HydrophobicContact CD2-CB 4.01Å; L496-W526 HydrophobicContact CD2-CG 4.26Å; L496-W526 HydrophobicContact CG-CB 4.22Å
497	C	97.7	Very high	93.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	6.1	174.7	-68	0	0	0	0	114.7	C364 T374 F375 L390 G495	C364-C497 HydrophobicContact CB-CB 3.59Å; C364-C497 WeakPolarHBondContact CB-SG 3.44Å; C364-C497 WeakPolarHBondContact SG-CB 3.14Å; C364-C497 CovalentContact SG-SG 2.02Å; C364-C497 PolarHBondContact SG-SG 3.4Å; T374-C497 WeakPolarHBondContact CA-O 3.33Å; T374-C497 VanDerWaalsContact CB-O 3.22Å; T374-C497 WeakPolarHBondContact CB-O 3.04Å; F375-C497 HydrophobicContact CD2-CB 3.66Å; F375-C497 WeakPolarHBondContact CD2-O 2.98Å; F375-C497 HydrophobicContact CE2-CB 3.36Å; F375-C497 HydrophobicContact CG-CB 4.47Å; F375-C497 HydrophobicContact CZ-CB 3.97Å; F375-C497 PolarHBondContact N-O 3.32Å; L390-C497 WeakPolarHBondContact CD1-SG 2.96Å; L390-C497 VanDerWaalsContact CG-SG 3.55Å; L390-C497 WeakPolarHBondContact O-CB 3.39Å; L390-C497 PolarHBondContact O-N 3.03Å; L390-C497 PolarHBondContact O-SG 3.07Å; L390-C497 VanDerWaalsContact O-SG 3.39Å; G495-C497 PolarHBondContact O-N 2.9Å
498	G	96.6	Very high	93.8	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	25%	0.247	C	C	.	.			trans	80.6	-168	-179.1	0	0	0	0	0	113.5	C494 G495 L496 D507	C494-G498 WeakPolarHBondContact CA-O 3.03Å; G495-G498 PolarHBondContact O-N 2.92Å; L496-G498 PolarHBondContact O-N 3.42Å; G498-D507 WeakPolarHBondContact CA-OD1 3.02Å
499	N	94.9	Very high	94	Very high	28 Å²	28	46.5 Å²	46.5	15%	0.15	24%	0.238	C	C	.	.			trans	-99.9	-3.7	-174.4	67.8	10	0	0	0	114.6	L493 N501 D506	L493-N499 VanDerWaalsContact O-CA 3.23Å; L493-N499 WeakPolarHBondContact O-CA 3.44Å; N499-N501 PolarHBondContact ND2-ND2 2.95Å; N499-N501 VanDerWaalsContact ND2-ND2 3.17Å; N499-N501 PolarHBondContact O-N 3.36Å; N499-N501 PolarHBondContact OD1-N 3.36Å; N499-N501 PolarHBondContact OD1-ND2 2.79Å; N499-N501 PolarHBondContact OD1-OD1 2.97Å; N499-D506 PolarHBondContact ND2-OD2 2.78Å
500	Y	95.9	Very high	94	Very high	9 Å²	9	46.3 Å²	46.3	4%	0.035	24%	0.237	C	C	.	.			trans	54	48.9	177.5	-174.1	-145.3	0	0	0	112.8	G362 F375 D376 A485 L489 K490 G491 L493	G362-Y500 VanDerWaalsContact CA-CE2 3.44Å; G362-Y500 PolarHBondContact N-OH 2.9Å; F375-Y500 HydrophobicContact CB-CD2 3.5Å; F375-Y500 HydrophobicContact CB-CE2 4.34Å; F375-Y500 HydrophobicContact CB-CG 3.84Å; F375-Y500 HydrophobicContact CD2-CG 4.29Å; F375-Y500 HydrophobicContact CG-CD2 4.17Å; F375-Y500 HydrophobicContact CG-CG 4.1Å; D376-Y500 WeakPolarHBondContact OD2-CA 3.44Å; A485-Y500 HydrophobicContact CB-CD1 4.13Å; A485-Y500 HydrophobicContact CB-CE1 3.93Å; A485-Y500 PolarHBondContact O-OH 2.7Å; L489-Y500 HydrophobicContact CB-CD1 4.42Å; L489-Y500 HydrophobicContact CB-CE1 4.38Å; K490-Y500 CarbonylContact C-O 3.47Å; K490-Y500 VanDerWaalsContact CA-CD1 3.48Å; K490-Y500 VanDerWaalsContact CA-O 3.3Å; K490-Y500 WeakPolarHBondContact CA-O 3.31Å; K490-Y500 HydrophobicContact CB-CD1 4.24Å; K490-Y500 HydrophobicContact CB-CE1 4.01Å; K490-Y500 HydrophobicContact CG-CE1 4.47Å; K490-Y500 HydrophobicContact CG-CE2 4.48Å; K490-Y500 WeakPolarHBondContact CG-O 3.45Å; G491-Y500 PolarHBondContact N-O 2.05Å; L493-Y500 HydrophobicContact CD1-CD1 3.89Å; L493-Y500 HydrophobicContact CD1-CG 4.43Å; L493-Y500 HydrophobicContact CG-CD1 4.42Å
501	N	92.3	Very high	93.8	Very high	49 Å²	49	44.2 Å²	44.2	26%	0.262	24%	0.24	S	C	.	.	S	Bend	trans	-106.8	-3.7	179.3	72.2	6.8	0	0	0	113.1	D376 N499 H503 D506	D376-N501 PolarHBondContact OD2-N 2.84Å; D376-N501 PolarHBondContact OD2-OD1 3.4Å; N499-N501 PolarHBondContact ND2-ND2 2.95Å; N499-N501 VanDerWaalsContact ND2-ND2 3.17Å; N499-N501 PolarHBondContact O-N 3.36Å; N499-N501 PolarHBondContact OD1-N 3.36Å; N499-N501 PolarHBondContact OD1-ND2 2.79Å; N499-N501 PolarHBondContact OD1-OD1 2.97Å; N501-H503 WeakPolarHBondContact OD1-CA 3.43Å; N501-H503 VanDerWaalsContact OD1-CB 3.28Å; N501-H503 WeakPolarHBondContact OD1-CB 3.22Å; N501-H503 PolarHBondContact OD1-N 2.92Å; N501-D506 PolarHBondContact ND2-OD2 2.04Å
502	G	90.6	Very high	93.7	Very high	46 Å²	46	45.6 Å²	45.6	47%	0.474	24%	0.235	S	C	.	.	S	Bend	trans	94.2	4.6	-176.4	0	0	0	0	0	114.2	D376	D376-G502 VanDerWaalsContact OD1-CA 3.27Å; D376-G502 WeakPolarHBondContact OD1-CA 3.09Å; D376-G502 PolarHBondContact OD1-N 2.97Å; D376-G502 PolarHBondContact OD2-N 3.47Å
503	H	90.7	Very high	93.6	Very high	122 Å²	122	44 Å²	44	57%	0.565	24%	0.244	S	C	*	.			trans	-119.2	104.6	-177.8	-61.8	-65	0	0	0	111.5	D376 N501 R505 D506	D376-H503 PolarHBondContact OD2-N 2.93Å; N501-H503 WeakPolarHBondContact OD1-CA 3.43Å; N501-H503 VanDerWaalsContact OD1-CB 3.28Å; N501-H503 WeakPolarHBondContact OD1-CB 3.22Å; N501-H503 PolarHBondContact OD1-N 2.92Å; H503-R505 PolarHBondContact O-N 3.02Å; H503-D506 WeakPolarHBondContact CB-OD1 3.07Å
504	K	92	Very high	93.4	Very high	126 Å²	126	48.2 Å²	48.2	55%	0.548	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-4.5	179.4	72.9	-179.4	179.1	-175.9	0	116	D376 R378 D507	D376-K504 HydrophobicContact CB-CB 4.44Å; R378-K504 HydrophobicContact CB-CB 4.11Å; R378-K504 WeakPolarHBondContact CD-O 3.39Å; K504-D507 WeakPolarHBondContact CA-OD2 2.94Å
505	R	89.4	Confident	93.4	Very high	222 Å²	222	51.2 Å²	51.2	84%	0.838	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-24.6	-171.8	-73	-172.9	179.6	-177.5	1.2	112.7	H503 F515	H503-R505 PolarHBondContact O-N 3.02Å; R505-F515 VanDerWaalsContact O-CE2 3.25Å; R505-F515 WeakPolarHBondContact O-CE2 3.4Å
506	D	93	Very high	93.1	Very high	42 Å²	42	53.5 Å²	53.5	23%	0.225	29%	0.286	C	S	.	.	S	Bend	trans	-104.5	6.3	-180	55	-51.4	0	0	0	113	N499 N501 H503 L508 I509	N499-D506 PolarHBondContact ND2-OD2 2.78Å; N501-D506 PolarHBondContact ND2-OD2 2.04Å; H503-D506 WeakPolarHBondContact CB-OD1 3.07Å; D506-L508 PolarHBondContact O-N 3.25Å; D506-I509 HydrophobicContact CB-CD1 4.18Å; D506-I509 WeakPolarHBondContact O-CD1 3.06Å; D506-I509 VanDerWaalsContact O-CG1 3.23Å; D506-I509 WeakPolarHBondContact O-CG1 3.32Å; D506-I509 PolarHBondContact O-N 3.1Å
507	D	95.7	Very high	92.6	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.011	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.4	176.6	-86.4	-25.5	0	0	0	115	T374 R378 G498 K504 I509 F522	T374-D507 WeakPolarHBondContact CB-OD2 3.45Å; T374-D507 HydrophobicContact CG2-CB 4.04Å; T374-D507 PolarHBondContact OG1-OD2 2.79Å; R378-D507 HydrophobicContact CB-CB 4.11Å; R378-D507 WeakPolarHBondContact CB-OD2 3.38Å; G498-D507 WeakPolarHBondContact CA-OD1 3.02Å; K504-D507 WeakPolarHBondContact CA-OD2 2.94Å; D507-I509 VanDerWaalsContact C-N 3.34Å; D507-F522 WeakPolarHBondContact O-CE2 3.03Å; D507-F522 WeakPolarHBondContact O-CZ 3.02Å
508	L	95.1	Very high	92.2	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	29.1	177.8	-57.4	-176.9	0	0	0	113.2	D506 G510 F515 K516 V519 F522	D506-L508 PolarHBondContact O-N 3.25Å; L508-G510 PolarHBondContact O-N 2.77Å; L508-F515 HydrophobicContact CB-CD2 4.48Å; L508-F515 HydrophobicContact CB-CE2 3.98Å; L508-F515 HydrophobicContact CB-CZ 4.36Å; L508-K516 WeakPolarHBondContact CB-O 3.42Å; L508-K516 PolarHBondContact O-N 3.35Å; L508-V519 HydrophobicContact CD1-CG2 4.47Å; L508-F522 VanDerWaalsContact C-CD2 3.48Å; L508-F522 HydrophobicContact CB-CD2 4.18Å; L508-F522 HydrophobicContact CB-CG 4.27Å; L508-F522 HydrophobicContact CD2-CB 4.39Å; L508-F522 HydrophobicContact CD2-CD1 3.58Å; L508-F522 HydrophobicContact CD2-CD2 4.29Å; L508-F522 HydrophobicContact CD2-CE1 3.82Å; L508-F522 HydrophobicContact CD2-CE2 4.48Å; L508-F522 HydrophobicContact CD2-CG 3.83Å; L508-F522 HydrophobicContact CD2-CZ 4.26Å
509	I	94.6	Very high	91.9	Very high	58 Å²	58	67.1 Å²	67.1	30%	0.297	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-73.9	117.5	169.1	-68.5	161	0	0	0	108.9	D506 D507 F515 F522 W526	D506-I509 HydrophobicContact CB-CD1 4.18Å; D506-I509 WeakPolarHBondContact O-CD1 3.06Å; D506-I509 VanDerWaalsContact O-CG1 3.23Å; D506-I509 WeakPolarHBondContact O-CG1 3.32Å; D506-I509 PolarHBondContact O-N 3.1Å; D507-I509 VanDerWaalsContact C-N 3.34Å; I509-F515 HydrophobicContact CG1-CD2 4.47Å; I509-F522 WeakPolarHBondContact O-CE2 3.28Å; I509-W526 WeakPolarHBondContact O-CZ2 3.4Å; I509-W526 PolarHBondContact O-NE1 2.77Å; I509-W526 VanDerWaalsContact O-NE1 3.16Å
510	G	92.6	Very high	91.5	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.01	35%	0.354	C	S	.	.			trans	-72.7	171.7	-179	0	0	0	0	0	113.9	L508 D512 G513 N514 S525	L508-G510 PolarHBondContact O-N 2.77Å; G510-D512 PolarHBondContact O-N 2.94Å; G510-D512 VanDerWaalsContact O-N 3.13Å; G510-G513 PolarHBondContact O-N 3.24Å; G510-N514 PolarHBondContact N-O 2.9Å; G510-S525 WeakPolarHBondContact CA-OG 3.38Å
511	G	89.3	Confident	91.3	Very high	42 Å²	42	70.4 Å²	70.4	43%	0.433	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17	175.7	0	0	0	0	0	114.2	G513 S525	G511-G513 VanDerWaalsContact C-N 3.3Å; G511-S525 PolarHBondContact N-OG 3.21Å
512	D	90.4	Very high	91.4	Very high	80 Å²	80	68.1 Å²	68.1	43%	0.428	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1	173	67.3	-26.5	0	0	0	113.6	G510 N514 K516	G510-D512 PolarHBondContact O-N 2.94Å; G510-D512 VanDerWaalsContact O-N 3.13Å; D512-N514 VanDerWaalsContact C-N 3.26Å; D512-N514 PolarHBondContact O-N 2.82Å; D512-N514 PolarHBondContact OD1-N 3.39Å; D512-N514 PolarHBondContact OD2-ND2 3.01Å; D512-K516 VanDerWaalsContact OD1-CE 3.22Å; D512-K516 WeakPolarHBondContact OD1-CE 3.22Å; D512-K516 IonicContact OD1-NZ 2.8Å; D512-K516 PolarHBondContact OD1-NZ 3.04Å; D512-K516 WeakPolarHBondContact OD2-CE 3.46Å; D512-K516 IonicContact OD2-NZ 3.61Å; D512-K516 PolarHBondContact OD2-NZ 3.33Å
513	G	90.4	Very high	91.4	Very high	56 Å²	56	65.9 Å²	65.9	58%	0.577	33%	0.334	S	S	*	.	S	Bend	trans	79.5	1.1	-178.4	0	0	0	0	0	114.6	G510 G511	G510-G513 PolarHBondContact O-N 3.24Å; G511-G513 VanDerWaalsContact C-N 3.3Å
514	N	92.6	Very high	91.4	Very high	94 Å²	94	61.7 Å²	61.7	50%	0.503	32%	0.315	S	S	.	.			trans	-98.5	144.1	-178.8	-64.3	-53.8	0	0	0	111.7	G510 D512	G510-N514 PolarHBondContact N-O 2.9Å; D512-N514 VanDerWaalsContact C-N 3.26Å; D512-N514 PolarHBondContact O-N 2.82Å; D512-N514 PolarHBondContact OD1-N 3.39Å; D512-N514 PolarHBondContact OD2-ND2 3.01Å
515	F	93.4	Very high	91.5	Very high	89 Å²	89	57.6 Å²	57.6	39%	0.39	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-67.3	135.5	171.6	-175.1	-95.2	0	0	0	111.3	R505 L508 I509 F517	R505-F515 VanDerWaalsContact O-CE2 3.25Å; R505-F515 WeakPolarHBondContact O-CE2 3.4Å; L508-F515 HydrophobicContact CB-CD2 4.48Å; L508-F515 HydrophobicContact CB-CE2 3.98Å; L508-F515 HydrophobicContact CB-CZ 4.36Å; I509-F515 HydrophobicContact CG1-CD2 4.47Å; F515-F517 HydrophobicContact CD1-CE1 4.38Å; F515-F517 HydrophobicContact CD1-CZ 4.38Å; F515-F517 AromaticContact CE1-CD1 3.98Å; F515-F517 HydrophobicContact CE1-CD1 3.98Å; F515-F517 HydrophobicContact CE1-CE1 4.02Å; F515-F517 HydrophobicContact CE1-CG 4.41Å; F515-F517 HydrophobicContact CE1-CZ 4.47Å
516	K	90.7	Very high	91.7	Very high	49 Å²	49	47.8 Å²	47.8	21%	0.213	27%	0.265	C	S	.	.			trans	-114.9	135.5	178.3	-54.6	-62.6	-179.2	-178.4	0	110.7	L508 D512 F522	L508-K516 WeakPolarHBondContact CB-O 3.42Å; L508-K516 PolarHBondContact O-N 3.35Å; D512-K516 VanDerWaalsContact OD1-CE 3.22Å; D512-K516 WeakPolarHBondContact OD1-CE 3.22Å; D512-K516 IonicContact OD1-NZ 2.8Å; D512-K516 PolarHBondContact OD1-NZ 3.04Å; D512-K516 WeakPolarHBondContact OD2-CE 3.46Å; D512-K516 IonicContact OD2-NZ 3.61Å; D512-K516 PolarHBondContact OD2-NZ 3.33Å; K516-F522 HydrophobicContact CB-CB 3.86Å; K516-F522 HydrophobicContact CG-CB 4.19Å
517	F	87.6	Confident	91.7	Very high	193 Å²	193	50.1 Å²	50.1	85%	0.846	27%	0.271	S	S	*	.	S	Bend	trans	-83.6	-29.7	176.4	-65	-82.4	0	0	0	112.7	F515	F515-F517 HydrophobicContact CD1-CE1 4.38Å; F515-F517 HydrophobicContact CD1-CZ 4.38Å; F515-F517 AromaticContact CE1-CD1 3.98Å; F515-F517 HydrophobicContact CE1-CD1 3.98Å; F515-F517 HydrophobicContact CE1-CE1 4.02Å; F515-F517 HydrophobicContact CE1-CG 4.41Å; F515-F517 HydrophobicContact CE1-CZ 4.47Å
518	D	88.4	Confident	91.4	Very high	63 Å²	63	52.1 Å²	52.1	34%	0.337	28%	0.283	S	S	.	.	S	Bend	trans	-98.7	135.4	179.8	-175.2	-92.5	0	0	0	110.4	D520 D521 F522	D518-D520 WeakPolarHBondContact OD1-CA 3.27Å; D518-D520 WeakPolarHBondContact OD1-CB 3.37Å; D518-D520 PolarHBondContact OD1-N 2.84Å; D518-D521 HydrophobicContact CB-CB 4.17Å; D518-D521 PolarHBondContact OD1-N 2.84Å; D518-F522 WeakPolarHBondContact O-CB 3.49Å; D518-F522 PolarHBondContact O-N 2.94Å
519	V	89.6	Confident	90.6	Very high	33 Å²	33	60.7 Å²	60.7	20%	0.2	32%	0.323	C	S	.	.	H	α-helix	trans	-71.9	-34.9	-175.8	172.3	0	0	0	0	111.5	F380 N381 L508 F522 A523	F380-V519 HydrophobicContact CB-CG1 3.89Å; F380-V519 HydrophobicContact CB-CG2 4.15Å; F380-V519 HydrophobicContact CD2-CG1 3.47Å; F380-V519 VanDerWaalsContact CD2-CG1 3.47Å; F380-V519 HydrophobicContact CE2-CG1 4.34Å; F380-V519 HydrophobicContact CG-CG1 3.98Å; N381-V519 WeakPolarHBondContact O-CG1 3.33Å; L508-V519 HydrophobicContact CD1-CG2 4.47Å; V519-F522 WeakPolarHBondContact O-CB 3.24Å; V519-F522 PolarHBondContact O-N 2.91Å; V519-A523 WeakPolarHBondContact O-CB 3.47Å; V519-A523 PolarHBondContact O-N 3.17Å
520	D	88.1	Confident	89.5	Confident	40 Å²	40	60.6 Å²	60.6	21%	0.214	33%	0.327	C	S	.	.	H	α-helix	trans	-70.2	-43.7	179.5	-63.3	-39	0	0	0	109.8	D518 F522 A523 E524	D518-D520 WeakPolarHBondContact OD1-CA 3.27Å; D518-D520 WeakPolarHBondContact OD1-CB 3.37Å; D518-D520 PolarHBondContact OD1-N 2.84Å; D520-F522 VanDerWaalsContact C-N 3.33Å; D520-F522 PolarHBondContact O-N 2.87Å; D520-A523 PolarHBondContact O-N 2.77Å; D520-E524 WeakPolarHBondContact O-CB 3.06Å; D520-E524 PolarHBondContact O-N 3.37Å
521	D	90.1	Very high	87.8	Confident	67 Å²	67	68.8 Å²	68.8	36%	0.358	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-38.6	174.7	-71.4	-19.1	0	0	0	111.8	D518 S525 R539	D518-D521 HydrophobicContact CB-CB 4.17Å; D518-D521 PolarHBondContact OD1-N 2.84Å; D521-S525 PolarHBondContact O-N 2.82Å; D521-R539 IonicContact OD1-CZ 2.87Å; D521-R539 IonicContact OD1-NE 2.73Å; D521-R539 IonicContact OD1-NH2 2.66Å; D521-R539 PolarHBondContact OD1-NH2 2.01Å; D521-R539 IonicContact OD2-NH2 2.75Å
522	F	94.4	Very high	86.6	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-57.8	171.9	160.9	-109.2	0	0	0	111.8	F380 L496 D507 L508 I509 K516 D518 V519 D520 E524 S525 W526	F380-F522 AromaticContact CE1-CE1 3.96Å; F380-F522 HydrophobicContact CE1-CE1 3.96Å; F380-F522 HydrophobicContact CE2-CD1 4.46Å; F380-F522 HydrophobicContact CE2-CE1 4.04Å; F380-F522 HydrophobicContact CZ-CD1 4.44Å; F380-F522 AromaticContact CZ-CE1 3.61Å; F380-F522 HydrophobicContact CZ-CE1 3.61Å; L496-F522 HydrophobicContact CD2-CE1 3.91Å; L496-F522 HydrophobicContact CD2-CZ 4.27Å; D507-F522 WeakPolarHBondContact O-CE2 3.03Å; D507-F522 WeakPolarHBondContact O-CZ 3.02Å; L508-F522 VanDerWaalsContact C-CD2 3.48Å; L508-F522 HydrophobicContact CB-CD2 4.18Å; L508-F522 HydrophobicContact CB-CG 4.27Å; L508-F522 HydrophobicContact CD2-CB 4.39Å; L508-F522 HydrophobicContact CD2-CD1 3.58Å; L508-F522 HydrophobicContact CD2-CD2 4.29Å; L508-F522 HydrophobicContact CD2-CE1 3.82Å; L508-F522 HydrophobicContact CD2-CE2 4.48Å; L508-F522 HydrophobicContact CD2-CG 3.83Å; L508-F522 HydrophobicContact CD2-CZ 4.26Å; I509-F522 WeakPolarHBondContact O-CE2 3.28Å; K516-F522 HydrophobicContact CB-CB 3.86Å; K516-F522 HydrophobicContact CG-CB 4.19Å; D518-F522 WeakPolarHBondContact O-CB 3.49Å; D518-F522 PolarHBondContact O-N 2.94Å; V519-F522 WeakPolarHBondContact O-CB 3.24Å; V519-F522 PolarHBondContact O-N 2.91Å; D520-F522 VanDerWaalsContact C-N 3.33Å; D520-F522 PolarHBondContact O-N 2.87Å; F522-E524 VanDerWaalsContact C-N 3.34Å; F522-E524 PolarHBondContact O-N 2.9Å; F522-S525 WeakPolarHBondContact O-CB 3.27Å; F522-S525 PolarHBondContact O-N 3.36Å; F522-S525 PolarHBondContact O-OG 3.28Å; F522-W526 AromaticContact CD2-NE1 3.89Å; F522-W526 AromaticContact CE2-CD1 3.68Å; F522-W526 AromaticContact CE2-NE1 3.32Å; F522-W526 VanDerWaalsContact CE2-NE1 3.32Å; F522-W526 AromaticContact CZ-NE1 3.97Å
523	A	92.4	Very high	85.4	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-71.5	-32.5	-171	0	0	0	0	0	112.1	F382 Y388 L496 V519 D520 S525 W526	F382-A523 HydrophobicContact CB-CB 4.06Å; F382-A523 HydrophobicContact CD1-CB 3.44Å; F382-A523 VanDerWaalsContact CD1-CB 3.44Å; F382-A523 HydrophobicContact CD2-CB 3.4Å; F382-A523 VanDerWaalsContact CD2-CB 3.4Å; F382-A523 HydrophobicContact CE1-CB 3.56Å; F382-A523 HydrophobicContact CE2-CB 3.54Å; F382-A523 HydrophobicContact CG-CB 3.33Å; F382-A523 HydrophobicContact CZ-CB 3.6Å; Y388-A523 WeakPolarHBondContact CD1-O 3.26Å; L496-A523 HydrophobicContact CD2-CB 3.58Å; V519-A523 WeakPolarHBondContact O-CB 3.47Å; V519-A523 PolarHBondContact O-N 3.17Å; D520-A523 PolarHBondContact O-N 2.77Å; A523-S525 VanDerWaalsContact C-N 3.28Å; A523-S525 PolarHBondContact O-N 3.34Å; A523-W526 PolarHBondContact O-N 3.04Å; A523-W526 VanDerWaalsContact O-N 3.12Å
524	E	90.6	Very high	84.5	Confident	33 Å²	33	77.9 Å²	77.9	15%	0.154	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-29.9	174.5	-171.7	66.1	-177.1	0	0	112.4	Y388 D520 F522 W526 R527 R536	Y388-E524 PolarHBondContact OH-OE2 2.99Å; D520-E524 WeakPolarHBondContact O-CB 3.06Å; D520-E524 PolarHBondContact O-N 3.37Å; F522-E524 VanDerWaalsContact C-N 3.34Å; F522-E524 PolarHBondContact O-N 2.9Å; E524-W526 PolarHBondContact O-N 2.7Å; E524-R527 VanDerWaalsContact O-CB 3.23Å; E524-R527 WeakPolarHBondContact O-CB 3.42Å; E524-R527 PolarHBondContact O-N 2.84Å; E524-R527 IonicContact OE1-CZ 3.53Å; E524-R527 IonicContact OE1-NE 3.47Å; E524-R527 IonicContact OE1-NH1 2.66Å; E524-R527 PolarHBondContact OE1-NH1 3.29Å; E524-R527 IonicContact OE1-NH2 3.55Å; E524-R536 IonicContact OE1-NE 3.73Å; E524-R536 PolarHBondContact OE1-NE 2.99Å
525	S	93.5	Very high	83.1	Confident	41 Å²	41	79.4 Å²	79.4	29%	0.287	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.3	174.1	78.6	0	0	0	0	113.8	G510 G511 D521 F522 A523	G510-S525 WeakPolarHBondContact CA-OG 3.38Å; G511-S525 PolarHBondContact N-OG 3.21Å; D521-S525 PolarHBondContact O-N 2.82Å; F522-S525 WeakPolarHBondContact O-CB 3.27Å; F522-S525 PolarHBondContact O-N 3.36Å; F522-S525 PolarHBondContact O-OG 3.28Å; A523-S525 VanDerWaalsContact C-N 3.28Å; A523-S525 PolarHBondContact O-N 3.34Å
526	W	94.1	Very high	81.8	Confident	15 Å²	15	83.4 Å²	83.4	6%	0.057	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	9.6	177.2	-71.6	110.2	0	0	0	113.6	Y388 V389 C494 L496 I509 F522 A523 E524	Y388-W526 WeakPolarHBondContact CA-O 2.97Å; V389-W526 HydrophobicContact CB-CE3 4Å; V389-W526 HydrophobicContact CG1-CE3 4.26Å; V389-W526 PolarHBondContact N-O 2.76Å; C494-W526 HydrophobicContact CB-CH2 3.81Å; C494-W526 HydrophobicContact CB-CZ2 4.19Å; C494-W526 WeakPolarHBondContact SG-CH2 3.41Å; L496-W526 HydrophobicContact CD2-CB 4.01Å; L496-W526 HydrophobicContact CD2-CG 4.26Å; L496-W526 HydrophobicContact CG-CB 4.22Å; I509-W526 WeakPolarHBondContact O-CZ2 3.4Å; I509-W526 PolarHBondContact O-NE1 2.77Å; I509-W526 VanDerWaalsContact O-NE1 3.16Å; F522-W526 AromaticContact CD2-NE1 3.89Å; F522-W526 AromaticContact CE2-CD1 3.68Å; F522-W526 AromaticContact CE2-NE1 3.32Å; F522-W526 VanDerWaalsContact CE2-NE1 3.32Å; F522-W526 AromaticContact CZ-NE1 3.97Å; A523-W526 PolarHBondContact O-N 3.04Å; A523-W526 VanDerWaalsContact O-N 3.12Å; E524-W526 PolarHBondContact O-N 2.7Å
527	R	92.1	Very high	80.4	Confident	92 Å²	92	82.9 Å²	82.9	35%	0.347	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-66.8	137	177.9	-170.8	177.7	68.7	-177.5	-0	111.2	C386 Y388 E524	C386-R527 HydrophobicContact CB-CG 4.06Å; Y388-R527 HydrophobicContact CD1-CB 3.91Å; Y388-R527 HydrophobicContact CD1-CG 4.34Å; Y388-R527 HydrophobicContact CE1-CB 3.73Å; Y388-R527 HydrophobicContact CE1-CG 3.97Å; E524-R527 VanDerWaalsContact O-CB 3.23Å; E524-R527 WeakPolarHBondContact O-CB 3.42Å; E524-R527 PolarHBondContact O-N 2.84Å; E524-R527 IonicContact OE1-CZ 3.53Å; E524-R527 IonicContact OE1-NE 3.47Å; E524-R527 IonicContact OE1-NH1 2.66Å; E524-R527 PolarHBondContact OE1-NH1 3.29Å; E524-R527 IonicContact OE1-NH2 3.55Å
528	V	90.1	Very high	79.2	Confident	43 Å²	43	82.3 Å²	82.3	26%	0.261	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-86.2	129.3	170.9	-176.8	0	0	0	0	108.8	Q387 V389 L404 S530	Q387-V528 HydrophobicContact CG-CB 4.41Å; Q387-V528 HydrophobicContact CG-CG2 4.39Å; Q387-V528 PolarHBondContact O-N 3.18Å; V389-V528 HydrophobicContact CG2-CG2 3.81Å; L404-V528 HydrophobicContact CD2-CG2 3.95Å; V528-S530 PolarHBondContact O-N 3.44Å
529	E	78.6	Confident	77.8	Confident	186 Å²	186	88.1 Å²	88.1	87%	0.869	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.1	130	175.1	-68.5	-171.8	163.3	0	0	110.6
530	S	70.4	Confident	76.3	Confident	56 Å²	56	91.2 Å²	91.2	39%	0.392	44%	0.435	S	S	.	.			trans	-150	157.7	176	74.9	0	0	0	0	110.1	V528 E532	V528-S530 PolarHBondContact O-N 3.44Å; S530-E532 PolarHBondContact O-N 3.29Å
531	N	57.7	Low	74.4	Confident	173 Å²	173	95.5 Å²	95.5	93%	0.925	47%	0.465	S	S	*	.	S	Bend	trans	-75.4	1.1	176.6	-68.1	-10.7	0	0	0	113.2
532	E	63.7	Low	72.6	Confident	115 Å²	115	96.6 Å²	96.6	54%	0.537	48%	0.475	S	S	.	.	S	Bend	trans	-82.1	127.6	178	-74.5	-176.3	170.3	0	0	110.9	K406 S530 C534	K406-E532 VanDerWaalsContact CE-OE2 3.27Å; K406-E532 WeakPolarHBondContact CE-OE2 2.99Å; K406-E532 IonicContact NZ-OE1 2.89Å; K406-E532 PolarHBondContact NZ-OE1 3.43Å; K406-E532 IonicContact NZ-OE2 2.66Å; K406-E532 PolarHBondContact NZ-OE2 2.93Å; S530-E532 PolarHBondContact O-N 3.29Å; E532-C534 PolarHBondContact O-N 2.92Å
533	F	65.4	Low	70.8	Confident	217 Å²	217	103 Å²	103	95%	0.952	52%	0.516	S	S	*	.			trans	-67.7	112.1	168.9	-74.9	-86.8	0	0	0	109.7
534	C	70.5	Confident	69.5	Low	36 Å²	36	107.9 Å²	107.9	24%	0.243	54%	0.539	C	S	.	.			trans	-120.3	147.2	172.3	58.1	0	0	0	0	110.3	C386 E532	C386-C534 HydrophobicContact CB-CB 3.85Å; C386-C534 WeakPolarHBondContact CB-SG 3.25Å; C386-C534 WeakPolarHBondContact SG-CB 3.02Å; C386-C534 CovalentContact SG-SG 2.03Å; C386-C534 PolarHBondContact SG-SG 3.19Å; E532-C534 PolarHBondContact O-N 2.92Å
535	N	64.6	Low	68.4	Low	127 Å²	127	108.7 Å²	108.7	68%	0.679	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-80.8	130.5	-176.5	-71.7	-40.4	0	0	0	110.2	T385	T385-N535 PolarHBondContact OG1-N 3.33Å; T385-N535 VanDerWaalsContact OG1-N 3.11Å; T385-N535 PolarHBondContact OG1-O 3.32Å
536	R	64.6	Low	67.6	Low	172 Å²	172	107.1 Å²	107.1	65%	0.649	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-70	134.5	165.9	-83.2	-176	171.9	165.6	1.4	109.8	E524 Q538	E524-R536 IonicContact OE1-NE 3.73Å; E524-R536 PolarHBondContact OE1-NE 2.99Å; R536-Q538 PolarHBondContact O-N 3.4Å
537	P	62.8	Low	66.7	Low	39 Å²	39	111.7 Å²	111.7	25%	0.253	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-57.2	137.8	170.6	-20.1	31.1	0	0	0	110.5	F382	F382-P537 HydrophobicContact CE2-CG 3.97Å
538	Q	61.6	Low	65.9	Low	180 Å²	180	108.4 Å²	108.4	84%	0.841	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-73.6	129.3	171.4	-73	-168.6	-13.9	0	0	109.5	R536 K540	R536-Q538 PolarHBondContact O-N 3.4Å; Q538-K540 PolarHBondContact O-N 2.99Å; Q538-K540 VanDerWaalsContact O-N 3.16Å
539	R	58.4	Low	65.7	Low	185 Å²	185	110.9 Å²	110.9	70%	0.698	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-57.4	117.1	176.8	-77.1	-177.9	171.9	168.5	-4.4	110.6	D521	D521-R539 IonicContact OD1-CZ 2.87Å; D521-R539 IonicContact OD1-NE 2.73Å; D521-R539 IonicContact OD1-NH2 2.66Å; D521-R539 PolarHBondContact OD1-NH2 2.01Å; D521-R539 IonicContact OD2-NH2 2.75Å
540	K	58.2	Low	66	Low	98 Å²	98	107.2 Å²	107.2	43%	0.426	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-89.6	124.1	174	-69.7	-178.8	-178.2	171.9	0	109.6	Q538 V542 E590	Q538-K540 PolarHBondContact O-N 2.99Å; Q538-K540 VanDerWaalsContact O-N 3.16Å; K540-V542 PolarHBondContact O-N 2.04Å; K540-E590 IonicContact NZ-OE1 2.77Å
541	P	48.4	Very low	66.8	Low	130 Å²	130	112.9 Å²	112.9	84%	0.844	57%	0.573	S	S	*	*	S	Bend	trans	-66.8	-18.7	-175.5	-21.3	31.5	0	0	0	115.4
542	V	52.5	Low	68.2	Low	91 Å²	91	106.8 Å²	106.8	55%	0.552	54%	0.542	S	S	*	.	S	Bend	trans	-141.8	133.1	-178.5	-173.4	0	0	0	0	109.6	K540 E544	K540-V542 PolarHBondContact O-N 2.04Å; V542-E544 PolarHBondContact O-N 3.34Å
543	P	56.3	Low	69.3	Low	134 Å²	134	104.6 Å²	104.6	87%	0.87	53%	0.531	S	S	*	.			trans	-75.4	75.6	171.7	4.3	11.1	0	0	0	109.7
544	E	64.5	Low	70.4	Confident	102 Å²	102	99.9 Å²	99.9	48%	0.477	52%	0.515	S	S	.	.			trans	-85.9	124.8	169.1	-155.7	-179.9	171.7	0	0	108.8	V542 C546 Q547 K553	V542-E544 PolarHBondContact O-N 3.34Å; E544-C546 PolarHBondContact O-N 3.02Å; E544-Q547 HydrophobicContact CB-CG 4.13Å; E544-K553 IonicContact OE1-NZ 3.54Å; E544-K553 PolarHBondContact OE1-NZ 2.87Å
545	L	68.3	Low	71.4	Confident	50 Å²	50	100 Å²	100	26%	0.262	51%	0.51	S	S	.	.	S	Bend	trans	-60.4	-29.2	-174.4	-127.3	84.8	0	0	0	113.3	R582 V585 T586	L545-R582 VanDerWaalsContact CD1-CZ 3.43Å; L545-R582 HydrophobicContact CD2-CB 3.98Å; L545-R582 HydrophobicContact CD2-CG 4.06Å; L545-V585 HydrophobicContact CD2-CB 4.05Å; L545-V585 HydrophobicContact CD2-CG1 3.96Å; L545-T586 PolarHBondContact O-OG1 3.21Å
546	C	75.9	Confident	72.6	Confident	9 Å²	9	94 Å²	94	6%	0.061	48%	0.478	C	S	.	.			trans	-152.4	116.4	-179.1	176	0	0	0	0	109.6	E544 G548 K553 C589	E544-C546 PolarHBondContact O-N 3.02Å; C546-G548 VanDerWaalsContact C-N 3.32Å; C546-K553 HydrophobicContact CB-CG 4.26Å; C546-K553 WeakPolarHBondContact O-CE 3.28Å; C546-K553 PolarHBondContact O-NZ 2.86Å; C546-K553 VanDerWaalsContact SG-CG 3.53Å; C546-C589 WeakPolarHBondContact CA-SG 3.48Å; C546-C589 HydrophobicContact CB-CB 3.48Å; C546-C589 VanDerWaalsContact CB-CB 3.48Å; C546-C589 WeakPolarHBondContact CB-SG 3.34Å; C546-C589 WeakPolarHBondContact SG-CB 3.4Å; C546-C589 CovalentContact SG-SG 2.01Å; C546-C589 PolarHBondContact SG-SG 2.95Å
547	Q	75.8	Confident	73.9	Confident	110 Å²	110	89.6 Å²	89.6	51%	0.514	47%	0.465	S	S	.	.			trans	-91.9	8.6	176.4	-68	-178.2	-15.5	0	0	112.9	E544	E544-Q547 HydrophobicContact CB-CG 4.13Å
548	G	76	Confident	75.3	Confident	24 Å²	24	94.6 Å²	94.6	25%	0.247	48%	0.478	C	S	.	.	S	Bend	trans	-73.6	169.1	-178.6	0	0	0	0	0	114.5	C546 K553 C589	C546-G548 VanDerWaalsContact C-N 3.32Å; G548-K553 VanDerWaalsContact O-CE 3.31Å; G548-K553 WeakPolarHBondContact O-CE 3.37Å; G548-C589 PolarHBondContact N-SG 2.87Å
549	T	84.8	Confident	76.7	Confident	94 Å²	94	87 Å²	87	58%	0.577	44%	0.443	S	S	*	.			trans	-59.3	162.3	173.5	66.2	0	0	0	0	111.8	K551 V552 K553	T549-K551 PolarHBondContact O-N 3.09Å; T549-K551 VanDerWaalsContact O-N 3.15Å; T549-V552 WeakPolarHBondContact O-CA 3.37Å; T549-V552 WeakPolarHBondContact O-CB 3.17Å; T549-V552 PolarHBondContact O-N 2.82Å; T549-V552 WeakPolarHBondContact OG1-CG2 3.47Å; T549-K553 PolarHBondContact O-N 2.92Å
550	V	85.6	Confident	78.3	Confident	109 Å²	109	78.2 Å²	78.2	66%	0.661	41%	0.41	S	S	*	.	H	α-helix	trans	-52.8	-39.1	177.3	178.1	0	0	0	0	112	V552 K553 L554	V550-V552 VanDerWaalsContact C-N 3.35Å; V550-V552 PolarHBondContact O-N 2.84Å; V550-K553 PolarHBondContact O-N 2.04Å; V550-L554 HydrophobicContact CG1-CD1 3.93Å; V550-L554 HydrophobicContact CG1-CG 4.31Å; V550-L554 WeakPolarHBondContact O-CB 3.23Å; V550-L554 VanDerWaalsContact O-CG 3.32Å; V550-L554 WeakPolarHBondContact O-CG 2.99Å; V550-L554 PolarHBondContact O-N 3.32Å
551	K	87.1	Confident	80	Confident	176 Å²	176	78.5 Å²	78.5	77%	0.765	41%	0.412	S	S	*	.	H	α-helix	trans	-62.3	-41	176.3	-69.8	-175.8	178.7	179.2	0	112.4	T549 R555	T549-K551 PolarHBondContact O-N 3.09Å; T549-K551 VanDerWaalsContact O-N 3.15Å; K551-R555 WeakPolarHBondContact O-CB 3.24Å; K551-R555 PolarHBondContact O-N 3.1Å
552	V	86.9	Confident	82.1	Confident	45 Å²	45	75.7 Å²	75.7	27%	0.273	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-46.5	177.1	170.7	0	0	0	0	110.5	T549 V550 L554 R555 A556 C589	T549-V552 WeakPolarHBondContact O-CA 3.37Å; T549-V552 WeakPolarHBondContact O-CB 3.17Å; T549-V552 PolarHBondContact O-N 2.82Å; T549-V552 WeakPolarHBondContact OG1-CG2 3.47Å; V550-V552 VanDerWaalsContact C-N 3.35Å; V550-V552 PolarHBondContact O-N 2.84Å; V552-L554 PolarHBondContact O-N 2.88Å; V552-R555 PolarHBondContact O-N 2.86Å; V552-A556 WeakPolarHBondContact O-CB 2.98Å; V552-A556 PolarHBondContact O-N 2.87Å; V552-C589 WeakPolarHBondContact CG1-O 3.13Å
553	K	87.3	Confident	84	Confident	69 Å²	69	71.3 Å²	71.3	30%	0.3	36%	0.361	S	S	.	.	H	α-helix	trans	-56.8	-48.7	175.4	-71.7	179	173.1	-171.8	0	111.4	E544 C546 G548 T549 V550 R555 A556 H557	E544-K553 IonicContact OE1-NZ 3.54Å; E544-K553 PolarHBondContact OE1-NZ 2.87Å; C546-K553 HydrophobicContact CB-CG 4.26Å; C546-K553 WeakPolarHBondContact O-CE 3.28Å; C546-K553 PolarHBondContact O-NZ 2.86Å; C546-K553 VanDerWaalsContact SG-CG 3.53Å; G548-K553 VanDerWaalsContact O-CE 3.31Å; G548-K553 WeakPolarHBondContact O-CE 3.37Å; T549-K553 PolarHBondContact O-N 2.92Å; V550-K553 PolarHBondContact O-N 2.04Å; K553-R555 PolarHBondContact O-N 3.07Å; K553-A556 PolarHBondContact O-N 2.66Å; K553-H557 PolarHBondContact O-CD2 2.87Å; K553-H557 VanDerWaalsContact O-CD2 3.24Å; K553-H557 PolarHBondContact O-N 3.03Å
554	L	88.7	Confident	85.7	Confident	118 Å²	118	69.9 Å²	69.9	62%	0.618	34%	0.341	S	S	*	.	H	α-helix	trans	-61.2	-44.7	177.4	-75.5	170.6	0	0	0	112	V550 V552 R558	V550-L554 HydrophobicContact CG1-CD1 3.93Å; V550-L554 HydrophobicContact CG1-CG 4.31Å; V550-L554 WeakPolarHBondContact O-CB 3.23Å; V550-L554 VanDerWaalsContact O-CG 3.32Å; V550-L554 WeakPolarHBondContact O-CG 2.99Å; V550-L554 PolarHBondContact O-N 3.32Å; V552-L554 PolarHBondContact O-N 2.88Å; L554-R558 WeakPolarHBondContact O-CB 3.36Å; L554-R558 PolarHBondContact O-N 2.87Å
555	R	90.6	Very high	87	Confident	38 Å²	38	66.5 Å²	66.5	14%	0.143	33%	0.328	C	S	.	.	H	α-helix	trans	-59.5	-48.6	175.5	180	-176	178.2	-132.7	-0.4	111.1	K551 V552 K553 R558 E559 M588 C591 P592 V593 K595	K551-R555 WeakPolarHBondContact O-CB 3.24Å; K551-R555 PolarHBondContact O-N 3.1Å; V552-R555 PolarHBondContact O-N 2.86Å; K553-R555 PolarHBondContact O-N 3.07Å; R555-R558 PolarHBondContact O-N 2.96Å; R555-E559 WeakPolarHBondContact O-CG 3.38Å; R555-E559 PolarHBondContact O-N 2.9Å; R555-M588 HydrophobicContact CG-CE 4.33Å; R555-C591 PolarHBondContact NH1-O 3.2Å; R555-P592 PolarHBondContact NH1-O 2.05Å; R555-P592 PolarHBondContact NH2-O 3.43Å; R555-P592 VanDerWaalsContact NH2-O 3.16Å; R555-V593 PolarHBondContact NH2-O 2.69Å; R555-K595 PolarHBondContact NH2-O 2.87Å
556	A	90.4	Very high	88.1	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.9	-51.4	-179.9	0	0	0	0	0	111.6	V552 K553 R558 E559 C560 V585 M588	V552-A556 WeakPolarHBondContact O-CB 2.98Å; V552-A556 PolarHBondContact O-N 2.87Å; K553-A556 PolarHBondContact O-N 2.66Å; A556-R558 VanDerWaalsContact C-N 3.34Å; A556-R558 PolarHBondContact O-N 2.87Å; A556-E559 PolarHBondContact O-N 3.39Å; A556-C560 VanDerWaalsContact O-CB 3.28Å; A556-C560 WeakPolarHBondContact O-CB 3.47Å; A556-C560 PolarHBondContact O-N 3.25Å; A556-C560 PolarHBondContact O-SG 2.91Å; A556-V585 HydrophobicContact CB-CG1 4.32Å; A556-M588 HydrophobicContact CB-CB 3.61Å
557	H	91.3	Very high	88.8	Confident	81 Å²	81	74 Å²	74	38%	0.375	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-38.8	177.1	-78.3	-72.4	0	0	0	112.8	K553 Q561 Y581	K553-H557 PolarHBondContact O-CD2 2.87Å; K553-H557 VanDerWaalsContact O-CD2 3.24Å; K553-H557 PolarHBondContact O-N 3.03Å; H557-Q561 VanDerWaalsContact O-CB 3.28Å; H557-Q561 WeakPolarHBondContact O-CB 3.49Å; H557-Q561 WeakPolarHBondContact O-CG 3.48Å; H557-Q561 PolarHBondContact O-N 2.77Å; H557-Y581 AromaticContact ND1-CZ 3.75Å; H557-Y581 PolarHBondContact ND1-OH 3Å
558	R	92	Very high	89.7	Confident	144 Å²	144	68.8 Å²	68.8	54%	0.543	33%	0.33	S	S	.	.	H	α-helix	trans	-66.1	-38.8	179.4	-174	-170.5	70.9	-174.3	1.7	113.2	L554 R555 A556 Q561	L554-R558 WeakPolarHBondContact O-CB 3.36Å; L554-R558 PolarHBondContact O-N 2.87Å; R555-R558 PolarHBondContact O-N 2.96Å; A556-R558 VanDerWaalsContact C-N 3.34Å; A556-R558 PolarHBondContact O-N 2.87Å; R558-Q561 VanDerWaalsContact O-CG 3.25Å; R558-Q561 WeakPolarHBondContact O-CG 3.33Å; R558-Q561 PolarHBondContact O-NE2 2.88Å
559	E	91.5	Very high	90.3	Very high	21 Å²	21	73.8 Å²	73.8	10%	0.098	35%	0.347	C	S	.	.	H	α-helix	trans	-76	-43.1	176	-59.2	-47.6	138.8	0	0	110.8	R555 A556 Q561 K562 M588 Y598	R555-E559 WeakPolarHBondContact O-CG 3.38Å; R555-E559 PolarHBondContact O-N 2.9Å; A556-E559 PolarHBondContact O-N 3.39Å; E559-Q561 PolarHBondContact O-N 2.82Å; E559-K562 WeakPolarHBondContact O-CB 3.35Å; E559-K562 WeakPolarHBondContact O-CG 3.46Å; E559-K562 PolarHBondContact O-N 2.02Å; E559-K562 WeakPolarHBondContact OE2-CE 3.24Å; E559-K562 IonicContact OE2-NZ 2.74Å; E559-K562 PolarHBondContact OE2-NZ 3.22Å; E559-M588 HydrophobicContact CB-CE 4.05Å; E559-M588 HydrophobicContact CG-CE 3.76Å; E559-Y598 HydrophobicContact CB-CD1 3.73Å; E559-Y598 HydrophobicContact CB-CE1 4.18Å; E559-Y598 HydrophobicContact CB-CG 4.33Å; E559-Y598 HydrophobicContact CG-CD1 4.21Å; E559-Y598 HydrophobicContact CG-CE1 4.35Å
560	C	92.9	Very high	90.6	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-73.2	-24.8	-176.7	-63.6	0	0	0	0	114.4	A556 K562 L563 Y581 C584 V585	A556-C560 VanDerWaalsContact O-CB 3.28Å; A556-C560 WeakPolarHBondContact O-CB 3.47Å; A556-C560 PolarHBondContact O-N 3.25Å; A556-C560 PolarHBondContact O-SG 2.91Å; C560-K562 PolarHBondContact O-N 2.73Å; C560-K562 VanDerWaalsContact O-N 3.14Å; C560-L563 VanDerWaalsContact O-CB 3.32Å; C560-L563 WeakPolarHBondContact O-CB 3.04Å; C560-L563 PolarHBondContact O-N 3.2Å; C560-Y581 HydrophobicContact CB-CD2 4.03Å; C560-Y581 HydrophobicContact CB-CE2 3.81Å; C560-Y581 WeakPolarHBondContact O-CD2 2.97Å; C560-Y581 WeakPolarHBondContact O-CE2 3.38Å; C560-C584 WeakPolarHBondContact CA-SG 3.49Å; C560-C584 HydrophobicContact CB-CB 3.83Å; C560-C584 WeakPolarHBondContact CB-SG 3.35Å; C560-C584 WeakPolarHBondContact SG-CB 3Å; C560-C584 PolarHBondContact SG-O 3.02Å; C560-C584 CovalentContact SG-SG 2.04Å; C560-C584 PolarHBondContact SG-SG 2.92Å; C560-V585 HydrophobicContact CB-CG2 3.88Å; C560-V585 PolarHBondContact SG-N 2.03Å; C560-V585 VanDerWaalsContact SG-N 3.39Å
561	Q	93.6	Very high	91	Very high	103 Å²	103	67.4 Å²	67.4	48%	0.481	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-63.3	-17.9	176.4	67.3	-176.7	-4	0	0	112.9	H557 R558 E559 L563 K564 Y581	H557-Q561 VanDerWaalsContact O-CB 3.28Å; H557-Q561 WeakPolarHBondContact O-CB 3.49Å; H557-Q561 WeakPolarHBondContact O-CG 3.48Å; H557-Q561 PolarHBondContact O-N 2.77Å; R558-Q561 VanDerWaalsContact O-CG 3.25Å; R558-Q561 WeakPolarHBondContact O-CG 3.33Å; R558-Q561 PolarHBondContact O-NE2 2.88Å; E559-Q561 PolarHBondContact O-N 2.82Å; Q561-L563 PolarHBondContact O-N 2.84Å; Q561-L563 VanDerWaalsContact O-N 3.14Å; Q561-K564 WeakPolarHBondContact O-CB 3.3Å; Q561-K564 PolarHBondContact O-N 3.41Å; Q561-Y581 HydrophobicContact CB-CE2 4.49Å
562	K	92.3	Very high	91.3	Very high	71 Å²	71	61.3 Å²	61.3	31%	0.309	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60.9	-18.4	171.8	-60.3	175.4	-168.1	165.8	0	112.4	E559 C560 K564 S565 F602	E559-K562 WeakPolarHBondContact O-CB 3.35Å; E559-K562 WeakPolarHBondContact O-CG 3.46Å; E559-K562 PolarHBondContact O-N 2.02Å; E559-K562 WeakPolarHBondContact OE2-CE 3.24Å; E559-K562 IonicContact OE2-NZ 2.74Å; E559-K562 PolarHBondContact OE2-NZ 3.22Å; C560-K562 PolarHBondContact O-N 2.73Å; C560-K562 VanDerWaalsContact O-N 3.14Å; K562-K564 PolarHBondContact O-N 2.79Å; K562-S565 WeakPolarHBondContact O-CB 3.43Å; K562-S565 PolarHBondContact O-N 3.01Å; K562-S565 PolarHBondContact O-OG 2.9Å; K562-F602 HydrophobicContact CB-CE2 3.73Å; K562-F602 HydrophobicContact CB-CZ 3.79Å
563	L	93.1	Very high	91.4	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-65.8	-21.6	171.9	-153.9	85.6	0	0	0	112.3	C560 Q561 S565 F568 H572 Y577 F580 F602 Y605	C560-L563 VanDerWaalsContact O-CB 3.32Å; C560-L563 WeakPolarHBondContact O-CB 3.04Å; C560-L563 PolarHBondContact O-N 3.2Å; Q561-L563 PolarHBondContact O-N 2.84Å; Q561-L563 VanDerWaalsContact O-N 3.14Å; L563-S565 VanDerWaalsContact C-N 3.34Å; L563-F568 HydrophobicContact CD1-CE2 4.5Å; L563-F568 HydrophobicContact CD1-CZ 4.43Å; L563-F568 WeakPolarHBondContact O-CB 3.05Å; L563-H572 PolarHBondContact O-NE2 2.71Å; L563-Y577 HydrophobicContact CD2-CD2 4.21Å; L563-F580 HydrophobicContact CD2-CB 3.9Å; L563-F602 HydrophobicContact CB-CE1 4.02Å; L563-F602 HydrophobicContact CB-CZ 3.91Å; L563-F602 HydrophobicContact CD1-CB 4.47Å; L563-F602 HydrophobicContact CD1-CD1 3.54Å; L563-F602 HydrophobicContact CD1-CD2 4.13Å; L563-F602 HydrophobicContact CD1-CE1 3.67Å; L563-F602 HydrophobicContact CD1-CE2 4.26Å; L563-F602 HydrophobicContact CD1-CG 3.79Å; L563-F602 HydrophobicContact CD1-CZ 4.04Å; L563-F602 HydrophobicContact CG-CE1 4.46Å; L563-F602 VanDerWaalsContact N-CZ 3.32Å; L563-Y605 HydrophobicContact CD1-CD1 3.97Å; L563-Y605 HydrophobicContact CD1-CG 4.21Å; L563-Y605 HydrophobicContact CG-CD1 4.19Å
564	K	91.8	Very high	91.4	Very high	104 Å²	104	64.4 Å²	64.4	45%	0.452	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-90.6	2.9	177.5	-57	-179.3	177	179.9	0	113.4	Q561 K562 Y577	Q561-K564 WeakPolarHBondContact O-CB 3.3Å; Q561-K564 PolarHBondContact O-N 3.41Å; K562-K564 PolarHBondContact O-N 2.79Å; K564-Y577 HydrophobicContact CD-CE2 4.27Å; K564-Y577 HydrophobicContact CG-CD2 4.37Å; K564-Y577 HydrophobicContact CG-CE2 3.74Å
565	S	91.9	Very high	91.5	Very high	30 Å²	30	59.7 Å²	59.7	21%	0.21	29%	0.288	C	S	.	.	S	Bend	trans	-73.6	171	-177	66.7	0	0	0	0	112.4	K562 L563 E567 F568 Q569	K562-S565 WeakPolarHBondContact O-CB 3.43Å; K562-S565 PolarHBondContact O-N 3.01Å; K562-S565 PolarHBondContact O-OG 2.9Å; L563-S565 VanDerWaalsContact C-N 3.34Å; S565-E567 WeakPolarHBondContact CB-OE2 3.49Å; S565-E567 PolarHBondContact O-N 3.13Å; S565-E567 PolarHBondContact OG-OE2 2.04Å; S565-F568 PolarHBondContact O-N 3.5Å; S565-Q569 PolarHBondContact O-N 3.16Å
566	W	90.5	Very high	91.4	Very high	165 Å²	165	62.5 Å²	62.5	63%	0.625	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-64.3	-27.1	-178.1	70.6	-88.1	0	0	0	111.7	F568 Q569 H617	W566-F568 PolarHBondContact O-N 3.39Å; W566-F568 VanDerWaalsContact O-N 3.12Å; W566-Q569 WeakPolarHBondContact O-CB 3.4Å; W566-Q569 PolarHBondContact O-N 3.25Å; W566-Q569 VanDerWaalsContact O-N 3.11Å; W566-H617 HydrophobicContact CH2-CB 4.49Å; W566-H617 HydrophobicContact CZ3-CB 4.23Å
567	E	91.8	Very high	91.4	Very high	52 Å²	52	65.9 Å²	65.9	24%	0.243	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-59.9	-24.8	179.8	-65.2	89.1	147.7	0	0	112.9	S565 V616 H617 W618	S565-E567 WeakPolarHBondContact CB-OE2 3.49Å; S565-E567 PolarHBondContact O-N 3.13Å; S565-E567 PolarHBondContact OG-OE2 2.04Å; E567-V616 WeakPolarHBondContact O-CG1 3.3Å; E567-H617 HydrophobicContact CB-CB 4.47Å; E567-H617 PolarHBondContact O-N 2.95Å; E567-W618 HydrophobicContact CB-CB 3.98Å
568	F	93.1	Very high	91.4	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-111.2	-4.6	179.3	-69.6	-74.1	0	0	0	114	L563 S565 W566 T570 C571 H572 F602 Y605 V616 W618	L563-F568 HydrophobicContact CD1-CE2 4.5Å; L563-F568 HydrophobicContact CD1-CZ 4.43Å; L563-F568 WeakPolarHBondContact O-CB 3.05Å; S565-F568 PolarHBondContact O-N 3.5Å; W566-F568 PolarHBondContact O-N 3.39Å; W566-F568 VanDerWaalsContact O-N 3.12Å; F568-T570 PolarHBondContact O-N 3.12Å; F568-T570 VanDerWaalsContact O-N 3.16Å; F568-C571 WeakPolarHBondContact O-CB 3.17Å; F568-C571 PolarHBondContact O-N 3.29Å; F568-H572 PolarHBondContact O-CD2 3Å; F568-H572 PolarHBondContact O-N 2.06Å; F568-F602 AromaticContact CE2-CD2 3.79Å; F568-F602 HydrophobicContact CE2-CD2 3.79Å; F568-F602 AromaticContact CE2-CE2 3.92Å; F568-F602 HydrophobicContact CE2-CE2 3.92Å; F568-F602 AromaticContact CZ-CD2 3.74Å; F568-F602 HydrophobicContact CZ-CD2 3.74Å; F568-F602 HydrophobicContact CZ-CE2 4.34Å; F568-F602 HydrophobicContact CZ-CG 4.4Å; F568-Y605 HydrophobicContact CB-CE1 4.11Å; F568-Y605 AromaticContact CD1-CD1 3.58Å; F568-Y605 HydrophobicContact CD1-CD1 3.58Å; F568-Y605 AromaticContact CD1-CE1 3.76Å; F568-Y605 HydrophobicContact CD1-CE1 3.76Å; F568-Y605 AromaticContact CE1-CD1 3.93Å; F568-Y605 HydrophobicContact CE1-CD1 3.93Å; F568-Y605 HydrophobicContact CG-CD1 4.29Å; F568-Y605 HydrophobicContact CG-CE1 4.21Å; F568-V616 HydrophobicContact CD1-CG1 3.48Å; F568-V616 VanDerWaalsContact CD1-CG1 3.48Å; F568-V616 HydrophobicContact CE1-CG1 3.55Å; F568-V616 HydrophobicContact CG-CG1 4.38Å; F568-V616 HydrophobicContact CZ-CG1 4.48Å; F568-W618 HydrophobicContact CD1-CB 4.49Å; F568-W618 HydrophobicContact CD2-CB 4.33Å; F568-W618 HydrophobicContact CE1-CB 3.82Å; F568-W618 HydrophobicContact CE1-CD2 4.39Å; F568-W618 HydrophobicContact CE1-CE3 4.41Å; F568-W618 HydrophobicContact CE1-CG 4.16Å; F568-W618 HydrophobicContact CE2-CB 3.63Å; F568-W618 AromaticContact CE2-CD1 3.67Å; F568-W618 HydrophobicContact CE2-CD2 4.13Å; F568-W618 AromaticContact CE2-CG 3.51Å; F568-W618 HydrophobicContact CE2-CG 3.51Å; F568-W618 HydrophobicContact CZ-CB 3.35Å; F568-W618 AromaticContact CZ-CD1 3.85Å; F568-W618 AromaticContact CZ-CD2 3.49Å; F568-W618 HydrophobicContact CZ-CD2 3.49Å; F568-W618 VanDerWaalsContact CZ-CD2 3.49Å; F568-W618 AromaticContact CZ-CE3 3.86Å; F568-W618 HydrophobicContact CZ-CE3 3.86Å; F568-W618 AromaticContact CZ-CG 3.25Å; F568-W618 HydrophobicContact CZ-CG 3.25Å
569	Q	90.3	Very high	91.3	Very high	130 Å²	130	58.7 Å²	58.7	61%	0.607	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-33.2	-168.1	-175	173.5	11.9	0	0	113.5	S565 W566 C571 H572	S565-Q569 PolarHBondContact O-N 3.16Å; W566-Q569 WeakPolarHBondContact O-CB 3.4Å; W566-Q569 PolarHBondContact O-N 3.25Å; W566-Q569 VanDerWaalsContact O-N 3.11Å; Q569-C571 PolarHBondContact O-N 2.95Å; Q569-H572 PolarHBondContact O-N 3.49Å
570	T	91.1	Very high	91.3	Very high	69 Å²	69	58.2 Å²	58.2	42%	0.423	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.4	177.1	54.3	0	0	0	0	113.1	F568	F568-T570 PolarHBondContact O-N 3.12Å; F568-T570 VanDerWaalsContact O-N 3.16Å
571	C	93.3	Very high	91.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-21.3	-177.6	-173.3	0	0	0	0	113.9	F568 Q569 S573 T574 V575 Y605 C609 I614	F568-C571 WeakPolarHBondContact O-CB 3.17Å; F568-C571 PolarHBondContact O-N 3.29Å; Q569-C571 PolarHBondContact O-N 2.95Å; C571-S573 PolarHBondContact O-N 2.94Å; C571-S573 VanDerWaalsContact O-N 3.1Å; C571-T574 PolarHBondContact O-N 2.96Å; C571-V575 PolarHBondContact O-N 3.3Å; C571-Y605 HydrophobicContact CB-CE1 4.29Å; C571-Y605 PolarHBondContact O-OH 3.32Å; C571-Y605 PolarHBondContact SG-OH 2.04Å; C571-C609 HydrophobicContact CB-CB 3.79Å; C571-C609 WeakPolarHBondContact CB-SG 3.43Å; C571-C609 WeakPolarHBondContact SG-CA 3.47Å; C571-C609 WeakPolarHBondContact SG-CB 3.08Å; C571-C609 CovalentContact SG-SG 2.01Å; C571-C609 PolarHBondContact SG-SG 2.84Å; C571-I614 HydrophobicContact CB-CG2 4.22Å
572	H	93.2	Very high	91.1	Very high	48 Å²	48	61.9 Å²	61.9	22%	0.222	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29	-174.7	-65.9	166.6	0	0	0	113.8	L563 F568 Q569 T574 Y577 Y605	L563-H572 PolarHBondContact O-NE2 2.71Å; F568-H572 PolarHBondContact O-CD2 3Å; F568-H572 PolarHBondContact O-N 2.06Å; Q569-H572 PolarHBondContact O-N 3.49Å; H572-T574 VanDerWaalsContact C-N 3.29Å; H572-Y577 HydrophobicContact CB-CD1 4.26Å; H572-Y577 AromaticContact CD2-CD1 3.79Å; H572-Y577 AromaticContact CG-CD1 3.97Å; H572-Y605 PolarHBondContact CD2-OH 2.89Å; H572-Y605 PolarHBondContact N-OH 3.32Å
573	S	88.6	Confident	90.9	Very high	108 Å²	108	58.6 Å²	58.6	76%	0.755	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-18.8	177.5	60.9	0	0	0	0	113.8	C571	C571-S573 PolarHBondContact O-N 2.94Å; C571-S573 VanDerWaalsContact O-N 3.1Å
574	T	87.9	Confident	90.8	Very high	71 Å²	71	58.6 Å²	58.6	44%	0.436	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-40	-170.8	-54	0	0	0	0	112.1	C571 H572 E612 I614	C571-T574 PolarHBondContact O-N 2.96Å; H572-T574 VanDerWaalsContact C-N 3.29Å; T574-E612 HydrophobicContact CG2-CB 3.89Å; T574-E612 HydrophobicContact CG2-CG 3.83Å; T574-I614 HydrophobicContact CG2-CD1 3.92Å; T574-I614 WeakPolarHBondContact OG1-CD1 3.1Å
575	V	89.8	Confident	90.7	Very high	19 Å²	19	53.7 Å²	53.7	12%	0.115	27%	0.273	C	S	.	.	S	Bend	trans	-118.1	122.9	179	-173.6	0	0	0	0	109.4	C571 Y577 F580 Y605 A608 E612	C571-V575 PolarHBondContact O-N 3.3Å; V575-Y577 PolarHBondContact O-N 2.96Å; V575-F580 HydrophobicContact CG1-CE2 4.03Å; V575-Y605 HydrophobicContact CB-CE2 3.79Å; V575-Y605 HydrophobicContact CG1-CD2 4.04Å; V575-Y605 HydrophobicContact CG1-CE2 3.59Å; V575-Y605 PolarHBondContact O-OH 2.99Å; V575-A608 HydrophobicContact CG1-CB 3.89Å; V575-A608 HydrophobicContact CG2-CB 4.45Å; V575-E612 HydrophobicContact CG2-CG 4.18Å
576	D	88.6	Confident	90.4	Very high	97 Å²	97	53 Å²	53	52%	0.519	27%	0.267	S	S	.	.			trans	-63.4	105.3	176.6	-179.8	12.4	0	0	0	110.7	A578 T579 F580	D576-A578 VanDerWaalsContact C-N 3.28Å; D576-A578 PolarHBondContact O-N 3.18Å; D576-A578 WeakPolarHBondContact OD1-CB 3.2Å; D576-A578 PolarHBondContact OD1-N 3.29Å; D576-T579 PolarHBondContact O-OG1 3.37Å; D576-F580 WeakPolarHBondContact O-CD2 3.47Å
577	Y	92.1	Very high	90.1	Very high	70 Å²	70	45.3 Å²	45.3	28%	0.275	24%	0.239	S	C	.	.	H	α-helix	trans	-76.5	-15.3	-179.7	76.6	-94	0	0	0	112.5	L563 K564 H572 V575 T579 F580 Y581	L563-Y577 HydrophobicContact CD2-CD2 4.21Å; K564-Y577 HydrophobicContact CD-CE2 4.27Å; K564-Y577 HydrophobicContact CG-CD2 4.37Å; K564-Y577 HydrophobicContact CG-CE2 3.74Å; H572-Y577 HydrophobicContact CB-CD1 4.26Å; H572-Y577 AromaticContact CD2-CD1 3.79Å; H572-Y577 AromaticContact CG-CD1 3.97Å; V575-Y577 PolarHBondContact O-N 2.96Å; Y577-T579 VanDerWaalsContact C-N 3.29Å; Y577-T579 PolarHBondContact O-N 3.01Å; Y577-F580 PolarHBondContact O-N 3.18Å; Y577-Y581 WeakPolarHBondContact O-CB 2.94Å; Y577-Y581 PolarHBondContact O-N 3.34Å
578	A	90.6	Very high	89.9	Confident	41 Å²	41	42.9 Å²	42.9	34%	0.339	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-34.2	-172.2	0	0	0	0	0	112.1	D576 R582	D576-A578 VanDerWaalsContact C-N 3.28Å; D576-A578 PolarHBondContact O-N 3.18Å; D576-A578 WeakPolarHBondContact OD1-CB 3.2Å; D576-A578 PolarHBondContact OD1-N 3.29Å; A578-R582 VanDerWaalsContact O-CG 3.27Å; A578-R582 WeakPolarHBondContact O-CG 3.36Å; A578-R582 PolarHBondContact O-N 3.13Å; A578-R582 VanDerWaalsContact O-N 3.09Å
579	T	88.5	Confident	89.4	Confident	34 Å²	34	43.5 Å²	43.5	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-50.6	175.3	54.1	0	0	0	0	111	T379 D576 Y577 Y581 R582 S583	T379-T579 WeakPolarHBondContact OG1-CB 3.03Å; T379-T579 WeakPolarHBondContact OG1-CG2 3.46Å; D576-T579 PolarHBondContact O-OG1 3.37Å; Y577-T579 VanDerWaalsContact C-N 3.29Å; Y577-T579 PolarHBondContact O-N 3.01Å; T579-Y581 VanDerWaalsContact C-N 3.31Å; T579-Y581 PolarHBondContact O-N 3.34Å; T579-R582 PolarHBondContact O-N 2.08Å; T579-R582 VanDerWaalsContact O-N 3.13Å; T579-S583 PolarHBondContact O-N 2.04Å; T579-S583 PolarHBondContact O-OG 3.2Å
580	F	91.8	Very high	88.7	Confident	11 Å²	11	40.2 Å²	40.2	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-36.4	176.2	-63.2	-89.7	0	0	0	112.7	F367 L563 V575 D576 Y577 C584 A604 Y605 A608	F367-F580 HydrophobicContact CE1-CE1 4.26Å; F367-F580 HydrophobicContact CE2-CD1 4.27Å; F367-F580 AromaticContact CZ-CD1 3.91Å; F367-F580 HydrophobicContact CZ-CD1 3.91Å; F367-F580 HydrophobicContact CZ-CE1 4.06Å; L563-F580 HydrophobicContact CD2-CB 3.9Å; V575-F580 HydrophobicContact CG1-CE2 4.03Å; D576-F580 WeakPolarHBondContact O-CD2 3.47Å; Y577-F580 PolarHBondContact O-N 3.18Å; F580-C584 VanDerWaalsContact O-CB 3.29Å; F580-C584 WeakPolarHBondContact O-CB 3.23Å; F580-C584 PolarHBondContact O-N 3.03Å; F580-A604 HydrophobicContact CD1-CB 4.08Å; F580-A604 HydrophobicContact CE1-CB 3.82Å; F580-Y605 HydrophobicContact CB-CD2 4.31Å; F580-Y605 HydrophobicContact CD1-CD2 4.42Å; F580-Y605 AromaticContact CD2-CD2 3.48Å; F580-Y605 HydrophobicContact CD2-CD2 3.48Å; F580-Y605 VanDerWaalsContact CD2-CD2 3.48Å; F580-Y605 HydrophobicContact CD2-CE2 4.19Å; F580-Y605 HydrophobicContact CD2-CG 4.39Å; F580-Y605 AromaticContact CE2-CD2 3.8Å; F580-Y605 HydrophobicContact CE2-CD2 3.8Å; F580-Y605 HydrophobicContact CE2-CE2 4.46Å; F580-Y605 AromaticContact CG-CD2 3.82Å; F580-Y605 HydrophobicContact CG-CD2 3.82Å; F580-Y605 HydrophobicContact CG-CG 4.3Å; F580-Y605 HydrophobicContact CZ-CD2 4.4Å; F580-A608 HydrophobicContact CZ-CB 4.11Å
581	Y	92.8	Very high	88.1	Confident	33 Å²	33	37.3 Å²	37.3	13%	0.129	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-43	174.1	179.1	-94.2	0	0	0	111.7	H557 C560 Q561 Y577 T579 C584 V585	H557-Y581 AromaticContact ND1-CZ 3.75Å; H557-Y581 PolarHBondContact ND1-OH 3Å; C560-Y581 HydrophobicContact CB-CD2 4.03Å; C560-Y581 HydrophobicContact CB-CE2 3.81Å; C560-Y581 WeakPolarHBondContact O-CD2 2.97Å; C560-Y581 WeakPolarHBondContact O-CE2 3.38Å; Q561-Y581 HydrophobicContact CB-CE2 4.49Å; Y577-Y581 WeakPolarHBondContact O-CB 2.94Å; Y577-Y581 PolarHBondContact O-N 3.34Å; T579-Y581 VanDerWaalsContact C-N 3.31Å; T579-Y581 PolarHBondContact O-N 3.34Å; Y581-C584 WeakPolarHBondContact O-CB 3.05Å; Y581-C584 PolarHBondContact O-N 2.97Å; Y581-V585 HydrophobicContact CD1-CG2 4.33Å; Y581-V585 HydrophobicContact CE1-CG2 3.91Å; Y581-V585 WeakPolarHBondContact O-CG2 3.26Å; Y581-V585 PolarHBondContact O-N 3.46Å
582	R	89.6	Confident	87.5	Confident	146 Å²	146	39.8 Å²	39.8	55%	0.551	22%	0.215	S	C	*	.	H	α-helix	trans	-65.7	-45.1	178.1	-71.9	171.5	69.8	88.8	-0.9	111.3	L545 A578 T579 V585 T586	L545-R582 VanDerWaalsContact CD1-CZ 3.43Å; L545-R582 HydrophobicContact CD2-CB 3.98Å; L545-R582 HydrophobicContact CD2-CG 4.06Å; A578-R582 VanDerWaalsContact O-CG 3.27Å; A578-R582 WeakPolarHBondContact O-CG 3.36Å; A578-R582 PolarHBondContact O-N 3.13Å; A578-R582 VanDerWaalsContact O-N 3.09Å; T579-R582 PolarHBondContact O-N 2.08Å; T579-R582 VanDerWaalsContact O-N 3.13Å; R582-V585 PolarHBondContact O-N 2.87Å; R582-T586 PolarHBondContact O-N 2.89Å; R582-T586 VanDerWaalsContact O-N 3.07Å; R582-T586 PolarHBondContact O-OG1 2.81Å
583	S	89.2	Confident	86.8	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-54.3	-50.8	171.6	-72.4	0	0	0	0	111.6	H371 T579 V585 T586 D587	H371-S583 WeakPolarHBondContact CD2-CB 3.5Å; H371-S583 PolarHBondContact ND1-OG 2.83Å; H371-S583 WeakPolarHBondContact NE2-CB 3.38Å; H371-S583 PolarHBondContact NE2-O 3.2Å; T579-S583 PolarHBondContact O-N 2.04Å; T579-S583 PolarHBondContact O-OG 3.2Å; S583-V585 VanDerWaalsContact C-N 3.3Å; S583-V585 PolarHBondContact O-N 2.95Å; S583-T586 WeakPolarHBondContact O-CA 2.91Å; S583-T586 WeakPolarHBondContact O-CB 3.19Å; S583-T586 PolarHBondContact O-N 2.93Å; S583-D587 PolarHBondContact O-N 2.77Å
584	C	90.7	Very high	86.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.7	-43.7	177.3	179	0	0	0	0	112.8	C560 F580 Y581 T586 D587 M588 Y598 S601	C560-C584 WeakPolarHBondContact CA-SG 3.49Å; C560-C584 HydrophobicContact CB-CB 3.83Å; C560-C584 WeakPolarHBondContact CB-SG 3.35Å; C560-C584 WeakPolarHBondContact SG-CB 3Å; C560-C584 PolarHBondContact SG-O 3.02Å; C560-C584 CovalentContact SG-SG 2.04Å; C560-C584 PolarHBondContact SG-SG 2.92Å; F580-C584 VanDerWaalsContact O-CB 3.29Å; F580-C584 WeakPolarHBondContact O-CB 3.23Å; F580-C584 PolarHBondContact O-N 3.03Å; Y581-C584 WeakPolarHBondContact O-CB 3.05Å; Y581-C584 PolarHBondContact O-N 2.97Å; C584-T586 VanDerWaalsContact C-N 3.31Å; C584-T586 PolarHBondContact O-N 2.8Å; C584-D587 PolarHBondContact O-N 3.45Å; C584-M588 VanDerWaalsContact O-CB 3.27Å; C584-M588 WeakPolarHBondContact O-CB 3.33Å; C584-M588 WeakPolarHBondContact O-CG 3.43Å; C584-M588 PolarHBondContact O-N 2.9Å; C584-Y598 WeakPolarHBondContact SG-CB 3.41Å; C584-S601 WeakPolarHBondContact CA-OG 3.27Å; C584-S601 PolarHBondContact N-OG 2.81Å; C584-S601 VanDerWaalsContact N-OG 3.15Å
585	V	89.8	Confident	85.7	Confident	1 Å²	1	48 Å²	48	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-37.5	179.7	170.1	0	0	0	0	110.8	L545 A556 C560 Y581 R582 S583 C589	L545-V585 HydrophobicContact CD2-CB 4.05Å; L545-V585 HydrophobicContact CD2-CG1 3.96Å; A556-V585 HydrophobicContact CB-CG1 4.32Å; C560-V585 HydrophobicContact CB-CG2 3.88Å; C560-V585 PolarHBondContact SG-N 2.03Å; C560-V585 VanDerWaalsContact SG-N 3.39Å; Y581-V585 HydrophobicContact CD1-CG2 4.33Å; Y581-V585 HydrophobicContact CE1-CG2 3.91Å; Y581-V585 WeakPolarHBondContact O-CG2 3.26Å; Y581-V585 PolarHBondContact O-N 3.46Å; R582-V585 PolarHBondContact O-N 2.87Å; S583-V585 VanDerWaalsContact C-N 3.3Å; S583-V585 PolarHBondContact O-N 2.95Å; V585-C589 VanDerWaalsContact O-CB 3.28Å; V585-C589 WeakPolarHBondContact O-CB 3.31Å; V585-C589 PolarHBondContact O-N 2.82Å
586	T	85.3	Confident	85.2	Confident	16 Å²	16	48.8 Å²	48.8	10%	0.098	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-54.1	173.2	-62.7	0	0	0	0	110.9	L545 R582 S583 C584 M588 C589	L545-T586 PolarHBondContact O-OG1 3.21Å; R582-T586 PolarHBondContact O-N 2.89Å; R582-T586 VanDerWaalsContact O-N 3.07Å; R582-T586 PolarHBondContact O-OG1 2.81Å; S583-T586 WeakPolarHBondContact O-CA 2.91Å; S583-T586 WeakPolarHBondContact O-CB 3.19Å; S583-T586 PolarHBondContact O-N 2.93Å; C584-T586 VanDerWaalsContact C-N 3.31Å; C584-T586 PolarHBondContact O-N 2.8Å; T586-M588 VanDerWaalsContact C-N 3.3Å; T586-M588 PolarHBondContact O-N 3.04Å; T586-C589 WeakPolarHBondContact O-CB 2.86Å; T586-C589 PolarHBondContact O-N 2.04Å; T586-C589 VanDerWaalsContact O-N 3.11Å
587	D	84.5	Confident	84.9	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-51.7	-48.9	176.4	-74.4	-41.4	0	0	0	111.2	D369 H371 S583 C584 C589 C591 C597 S601	D369-D587 VanDerWaalsContact CB-OD1 3.23Å; D369-D587 WeakPolarHBondContact CB-OD1 3.27Å; D369-D587 PolarHBondContact N-OD1 3.02Å; D369-D587 VanDerWaalsContact N-OD1 3.14Å; H371-D587 IonicContact CD2-OD1 3.71Å; H371-D587 IonicContact CD2-OD2 3.41Å; H371-D587 IonicContact NE2-OD1 3.35Å; H371-D587 PolarHBondContact NE2-OD1 2.87Å; H371-D587 IonicContact NE2-OD2 2.7Å; H371-D587 PolarHBondContact NE2-OD2 3.21Å; S583-D587 PolarHBondContact O-N 2.77Å; C584-D587 PolarHBondContact O-N 3.45Å; D587-C589 PolarHBondContact O-N 3.35Å; D587-C591 VanDerWaalsContact O-CB 3.3Å; D587-C591 WeakPolarHBondContact O-CB 3.3Å; D587-C591 PolarHBondContact O-N 2.76Å; D587-C591 VanDerWaalsContact O-N 3.11Å; D587-C597 HydrophobicContact CB-CB 4.19Å; D587-S601 PolarHBondContact OD2-OG 3.42Å
588	M	86.4	Confident	84.6	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-73.8	-23.6	-176.3	-77.3	-61.7	-59.4	0	0	114.2	R555 A556 E559 C584 T586 E590 C591 C597 Y598	R555-M588 HydrophobicContact CG-CE 4.33Å; A556-M588 HydrophobicContact CB-CB 3.61Å; E559-M588 HydrophobicContact CB-CE 4.05Å; E559-M588 HydrophobicContact CG-CE 3.76Å; C584-M588 VanDerWaalsContact O-CB 3.27Å; C584-M588 WeakPolarHBondContact O-CB 3.33Å; C584-M588 WeakPolarHBondContact O-CG 3.43Å; C584-M588 PolarHBondContact O-N 2.9Å; T586-M588 VanDerWaalsContact C-N 3.3Å; T586-M588 PolarHBondContact O-N 3.04Å; M588-E590 VanDerWaalsContact C-N 3.35Å; M588-C591 PolarHBondContact O-N 2.73Å; M588-C591 HydrophobicContact SD-CB 4.15Å; M588-C597 HydrophobicContact SD-CB 4.15Å; M588-C597 PolarHBondContact SD-N 2.78Å; M588-C597 VanDerWaalsContact SD-N 3.45Å; M588-Y598 HydrophobicContact CE-CD1 4.33Å; M588-Y598 HydrophobicContact SD-CD1 3.78Å; M588-Y598 HydrophobicContact SD-CG 4.3Å; M588-Y598 PolarHBondContact SD-N 2.99Å
589	C	83.6	Confident	84.3	Confident	13 Å²	13	40 Å²	40	9%	0.088	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-41.5	178.3	-174.9	0	0	0	0	111.4	C546 G548 V552 V585 T586 D587	C546-C589 WeakPolarHBondContact CA-SG 3.48Å; C546-C589 HydrophobicContact CB-CB 3.48Å; C546-C589 VanDerWaalsContact CB-CB 3.48Å; C546-C589 WeakPolarHBondContact CB-SG 3.34Å; C546-C589 WeakPolarHBondContact SG-CB 3.4Å; C546-C589 CovalentContact SG-SG 2.01Å; C546-C589 PolarHBondContact SG-SG 2.95Å; G548-C589 PolarHBondContact N-SG 2.87Å; V552-C589 WeakPolarHBondContact CG1-O 3.13Å; V585-C589 VanDerWaalsContact O-CB 3.28Å; V585-C589 WeakPolarHBondContact O-CB 3.31Å; V585-C589 PolarHBondContact O-N 2.82Å; T586-C589 WeakPolarHBondContact O-CB 2.86Å; T586-C589 PolarHBondContact O-N 2.04Å; T586-C589 VanDerWaalsContact O-N 3.11Å; D587-C589 PolarHBondContact O-N 3.35Å
590	E	75.5	Confident	84.1	Confident	61 Å²	61	38.7 Å²	38.7	29%	0.285	19%	0.191	S	C	.	.	H	α-helix	trans	-92.7	-11.6	-179.5	-56.4	-168.4	172.1	0	0	110.9	F415 K540 M588	F415-E590 HydrophobicContact CE1-CB 3.49Å; F415-E590 VanDerWaalsContact CE1-CB 3.49Å; F415-E590 HydrophobicContact CE2-CB 4.43Å; F415-E590 HydrophobicContact CZ-CB 3.36Å; F415-E590 WeakPolarHBondContact CZ-O 3.13Å; K540-E590 IonicContact NZ-OE1 2.77Å; M588-E590 VanDerWaalsContact C-N 3.35Å
591	C	78.9	Confident	84	Confident	8 Å²	8	38.2 Å²	38.2	5%	0.054	19%	0.189	C	C	.	.	S	Bend	trans	-60.7	128.5	-179	-163.1	0	0	0	0	114.5	R555 D587 M588 K595 C597	R555-C591 PolarHBondContact NH1-O 3.2Å; D587-C591 VanDerWaalsContact O-CB 3.3Å; D587-C591 WeakPolarHBondContact O-CB 3.3Å; D587-C591 PolarHBondContact O-N 2.76Å; D587-C591 VanDerWaalsContact O-N 3.11Å; M588-C591 PolarHBondContact O-N 2.73Å; M588-C591 HydrophobicContact SD-CB 4.15Å; C591-K595 PolarHBondContact SG-O 2.75Å; C591-C597 HydrophobicContact CB-CB 3.62Å; C591-C597 WeakPolarHBondContact CB-SG 3.38Å; C591-C597 WeakPolarHBondContact SG-CB 3.48Å; C591-C597 PolarHBondContact SG-N 3.37Å; C591-C597 CovalentContact SG-SG 2.04Å; C591-C597 PolarHBondContact SG-SG 2.81Å
592	P	81.1	Confident	83.9	Confident	53 Å²	53	36.6 Å²	36.6	34%	0.344	18%	0.182	S	C	.	.			trans	-54.2	149.6	173.7	-26.4	34.5	0	0	0	113.5	R555 H594 K595	R555-P592 PolarHBondContact NH1-O 2.05Å; R555-P592 PolarHBondContact NH2-O 3.43Å; R555-P592 VanDerWaalsContact NH2-O 3.16Å; P592-H594 PolarHBondContact O-N 2.02Å; P592-H594 VanDerWaalsContact O-N 3.11Å; P592-K595 HydrophobicContact CB-CB 4.48Å; P592-K595 HydrophobicContact CB-CG 4.37Å; P592-K595 HydrophobicContact CG-CD 4.37Å; P592-K595 PolarHBondContact O-N 3.42Å
593	V	78.2	Confident	83.8	Confident	125 Å²	125	30.1 Å²	30.1	76%	0.758	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30	-174.1	-177.8	0	0	0	0	113.5	R555	R555-V593 PolarHBondContact NH2-O 2.69Å
594	H	75.8	Confident	83.8	Confident	156 Å²	156	30.2 Å²	30.2	72%	0.722	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	3.4	-178.5	59.2	-88.9	0	0	0	113.9	P592	P592-H594 PolarHBondContact O-N 2.02Å; P592-H594 VanDerWaalsContact O-N 3.11Å
595	K	76.3	Confident	83.9	Confident	117 Å²	117	30.2 Å²	30.2	51%	0.509	16%	0.159	S	C	.	.			trans	-117.2	154	179.3	-66.1	-164.9	177.9	-174.2	0	111.5	R555 C591 P592	R555-K595 PolarHBondContact NH2-O 2.87Å; C591-K595 PolarHBondContact SG-O 2.75Å; P592-K595 HydrophobicContact CB-CB 4.48Å; P592-K595 HydrophobicContact CB-CG 4.37Å; P592-K595 HydrophobicContact CG-CD 4.37Å; P592-K595 PolarHBondContact O-N 3.42Å
596	N	79.4	Confident	83.9	Confident	37 Å²	37	30.8 Å²	30.8	20%	0.198	16%	0.163	C	C	.	.			trans	-116.3	85.1	178.4	-74.3	-13.6	0	0	0	110.3	Y598 C599 N623	N596-Y598 VanDerWaalsContact C-N 3.29Å; N596-Y598 HydrophobicContact CB-CD1 3.93Å; N596-Y598 HydrophobicContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CG-CE1 3.49Å; N596-Y598 PolarHBondContact O-N 3.33Å; N596-C599 PolarHBondContact O-SG 2.96Å; N596-C599 VanDerWaalsContact O-SG 3.37Å; N596-N623 PolarHBondContact ND2-ND2 3.29Å; N596-N623 PolarHBondContact ND2-OD1 3.34Å
597	C	81.9	Confident	84	Confident	21 Å²	21	30.9 Å²	30.9	14%	0.142	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.3	-176.6	-52	0	0	0	0	113	D587 M588 C591 C599 E600	D587-C597 HydrophobicContact CB-CB 4.19Å; M588-C597 HydrophobicContact SD-CB 4.15Å; M588-C597 PolarHBondContact SD-N 2.78Å; M588-C597 VanDerWaalsContact SD-N 3.45Å; C591-C597 HydrophobicContact CB-CB 3.62Å; C591-C597 WeakPolarHBondContact CB-SG 3.38Å; C591-C597 WeakPolarHBondContact SG-CB 3.48Å; C591-C597 PolarHBondContact SG-N 3.37Å; C591-C597 CovalentContact SG-SG 2.04Å; C591-C597 PolarHBondContact SG-SG 2.81Å; C597-C599 PolarHBondContact O-N 2.82Å; C597-E600 PolarHBondContact O-N 2.89Å
598	Y	86.8	Confident	84.2	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-22.3	176.3	67.6	-101.8	0	0	0	113.8	E559 C584 M588 N596 E600 S601 F602 Q621	E559-Y598 HydrophobicContact CB-CD1 3.73Å; E559-Y598 HydrophobicContact CB-CE1 4.18Å; E559-Y598 HydrophobicContact CB-CG 4.33Å; E559-Y598 HydrophobicContact CG-CD1 4.21Å; E559-Y598 HydrophobicContact CG-CE1 4.35Å; C584-Y598 WeakPolarHBondContact SG-CB 3.41Å; M588-Y598 HydrophobicContact CE-CD1 4.33Å; M588-Y598 HydrophobicContact SD-CD1 3.78Å; M588-Y598 HydrophobicContact SD-CG 4.3Å; M588-Y598 PolarHBondContact SD-N 2.99Å; N596-Y598 VanDerWaalsContact C-N 3.29Å; N596-Y598 HydrophobicContact CB-CD1 3.93Å; N596-Y598 HydrophobicContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CG-CE1 3.49Å; N596-Y598 PolarHBondContact O-N 3.33Å; Y598-E600 VanDerWaalsContact C-N 3.29Å; Y598-E600 PolarHBondContact O-N 2.83Å; Y598-S601 PolarHBondContact O-N 2.84Å; Y598-F602 HydrophobicContact CD2-CD1 4.14Å; Y598-F602 HydrophobicContact CD2-CD2 4.42Å; Y598-F602 HydrophobicContact CD2-CE1 4.21Å; Y598-F602 HydrophobicContact CD2-CE2 4.47Å; Y598-F602 HydrophobicContact CD2-CG 4.26Å; Y598-F602 HydrophobicContact CD2-CZ 4.36Å; Y598-F602 WeakPolarHBondContact O-CD1 2.98Å; Y598-F602 PolarHBondContact O-N 3.04Å; Y598-F602 VanDerWaalsContact O-N 3.12Å; Y598-Q621 VanDerWaalsContact OH-CD 3.27Å; Y598-Q621 PolarHBondContact OH-OE1 3.43Å
599	C	84.9	Confident	84.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-38.3	-175.4	-62.4	0	0	0	0	112.7	N596 C597 F602 L603 C624	N596-C599 PolarHBondContact O-SG 2.96Å; N596-C599 VanDerWaalsContact O-SG 3.37Å; C597-C599 PolarHBondContact O-N 2.82Å; C599-F602 PolarHBondContact O-N 2.84Å; C599-L603 WeakPolarHBondContact O-CB 3.37Å; C599-L603 VanDerWaalsContact O-CG 3.27Å; C599-L603 WeakPolarHBondContact O-CG 3.45Å; C599-L603 PolarHBondContact O-N 2.89Å; C599-C624 HydrophobicContact CB-CB 3.56Å; C599-C624 WeakPolarHBondContact CB-SG 3.5Å; C599-C624 WeakPolarHBondContact SG-CA 3.27Å; C599-C624 WeakPolarHBondContact SG-CB 3.49Å; C599-C624 CovalentContact SG-SG 2.04Å; C599-C624 PolarHBondContact SG-SG 3Å
600	E	84.3	Confident	84.6	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-45.6	-178.4	-60.4	-51.1	130	0	0	111.4	W417 C597 Y598 F602 L603 A604	W417-E600 HydrophobicContact CH2-CG 4.11Å; W417-E600 HydrophobicContact CZ3-CG 4.14Å; C597-E600 PolarHBondContact O-N 2.89Å; Y598-E600 VanDerWaalsContact C-N 3.29Å; Y598-E600 PolarHBondContact O-N 2.83Å; E600-F602 VanDerWaalsContact C-N 3.34Å; E600-F602 PolarHBondContact O-N 2.97Å; E600-L603 PolarHBondContact O-N 3.02Å; E600-A604 WeakPolarHBondContact O-CB 3.03Å; E600-A604 PolarHBondContact O-N 2.92Å
601	S	90.1	Very high	85.1	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-37.3	175.4	-76.9	0	0	0	0	112.5	C584 D587 Y598 Y605	C584-S601 WeakPolarHBondContact CA-OG 3.27Å; C584-S601 PolarHBondContact N-OG 2.81Å; C584-S601 VanDerWaalsContact N-OG 3.15Å; D587-S601 PolarHBondContact OD2-OG 3.42Å; Y598-S601 PolarHBondContact O-N 2.84Å; S601-Y605 PolarHBondContact O-N 3.17Å
602	F	90.6	Very high	85.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.6	-40	179.1	-81.3	45.3	0	0	0	111.9	K562 L563 F568 Y598 C599 E600 Y605 T606 W618	K562-F602 HydrophobicContact CB-CE2 3.73Å; K562-F602 HydrophobicContact CB-CZ 3.79Å; L563-F602 HydrophobicContact CB-CE1 4.02Å; L563-F602 HydrophobicContact CB-CZ 3.91Å; L563-F602 HydrophobicContact CD1-CB 4.47Å; L563-F602 HydrophobicContact CD1-CD1 3.54Å; L563-F602 HydrophobicContact CD1-CD2 4.13Å; L563-F602 HydrophobicContact CD1-CE1 3.67Å; L563-F602 HydrophobicContact CD1-CE2 4.26Å; L563-F602 HydrophobicContact CD1-CG 3.79Å; L563-F602 HydrophobicContact CD1-CZ 4.04Å; L563-F602 HydrophobicContact CG-CE1 4.46Å; L563-F602 VanDerWaalsContact N-CZ 3.32Å; F568-F602 AromaticContact CE2-CD2 3.79Å; F568-F602 HydrophobicContact CE2-CD2 3.79Å; F568-F602 AromaticContact CE2-CE2 3.92Å; F568-F602 HydrophobicContact CE2-CE2 3.92Å; F568-F602 AromaticContact CZ-CD2 3.74Å; F568-F602 HydrophobicContact CZ-CD2 3.74Å; F568-F602 HydrophobicContact CZ-CE2 4.34Å; F568-F602 HydrophobicContact CZ-CG 4.4Å; Y598-F602 HydrophobicContact CD2-CD1 4.14Å; Y598-F602 HydrophobicContact CD2-CD2 4.42Å; Y598-F602 HydrophobicContact CD2-CE1 4.21Å; Y598-F602 HydrophobicContact CD2-CE2 4.47Å; Y598-F602 HydrophobicContact CD2-CG 4.26Å; Y598-F602 HydrophobicContact CD2-CZ 4.36Å; Y598-F602 WeakPolarHBondContact O-CD1 2.98Å; Y598-F602 PolarHBondContact O-N 3.04Å; Y598-F602 VanDerWaalsContact O-N 3.12Å; C599-F602 PolarHBondContact O-N 2.84Å; E600-F602 VanDerWaalsContact C-N 3.34Å; E600-F602 PolarHBondContact O-N 2.97Å; F602-Y605 PolarHBondContact O-N 2.75Å; F602-T606 WeakPolarHBondContact O-CB 3.21Å; F602-T606 PolarHBondContact O-N 2.81Å; F602-T606 PolarHBondContact O-OG1 3.3Å; F602-W618 HydrophobicContact CB-CE3 4.48Å; F602-W618 HydrophobicContact CB-CH2 3.57Å; F602-W618 HydrophobicContact CB-CZ2 3.84Å; F602-W618 HydrophobicContact CB-CZ3 3.93Å; F602-W618 HydrophobicContact CD2-CD2 4.23Å; F602-W618 AromaticContact CD2-CE2 3.63Å; F602-W618 HydrophobicContact CD2-CH2 4.3Å; F602-W618 AromaticContact CD2-CZ2 3.69Å; F602-W618 HydrophobicContact CD2-CZ2 3.69Å; F602-W618 AromaticContact CD2-NE1 3.82Å; F602-W618 HydrophobicContact CG-CH2 4.4Å; F602-W618 HydrophobicContact CG-CZ2 4.17Å
603	L	86.5	Confident	85.5	Confident	9 Å²	9	41 Å²	41	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-43.2	174.1	-74.5	165.9	0	0	0	110.9	C599 E600 Y605 T606 R607 W618 P620 A626	C599-L603 WeakPolarHBondContact O-CB 3.37Å; C599-L603 VanDerWaalsContact O-CG 3.27Å; C599-L603 WeakPolarHBondContact O-CG 3.45Å; C599-L603 PolarHBondContact O-N 2.89Å; E600-L603 PolarHBondContact O-N 3.02Å; L603-Y605 VanDerWaalsContact C-N 3.35Å; L603-Y605 PolarHBondContact O-N 3.14Å; L603-T606 PolarHBondContact O-N 3.04Å; L603-R607 WeakPolarHBondContact O-CB 2.91Å; L603-R607 VanDerWaalsContact O-CG 3.3Å; L603-R607 WeakPolarHBondContact O-CG 3.28Å; L603-R607 PolarHBondContact O-N 2.76Å; L603-W618 HydrophobicContact CD2-CZ3 4.18Å; L603-W618 HydrophobicContact CG-CH2 4.49Å; L603-W618 HydrophobicContact CG-CZ3 4.39Å; L603-P620 HydrophobicContact CD2-CB 4.49Å; L603-P620 HydrophobicContact CD2-CG 3.75Å; L603-A626 HydrophobicContact CD1-CB 3.37Å
604	A	89.6	Confident	85.9	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.033	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-43.1	175.5	0	0	0	0	0	111.8	F367 F480 F580 E600 R607 A608	F367-A604 HydrophobicContact CB-CB 4.09Å; F367-A604 HydrophobicContact CD1-CB 4Å; F367-A604 HydrophobicContact CD2-CB 3.67Å; F367-A604 HydrophobicContact CE1-CB 4.38Å; F367-A604 HydrophobicContact CE2-CB 4.06Å; F367-A604 HydrophobicContact CG-CB 3.64Å; F367-A604 HydrophobicContact CZ-CB 4.4Å; F480-A604 HydrophobicContact CD2-CB 4.48Å; F480-A604 HydrophobicContact CE2-CB 4.13Å; F580-A604 HydrophobicContact CD1-CB 4.08Å; F580-A604 HydrophobicContact CE1-CB 3.82Å; E600-A604 WeakPolarHBondContact O-CB 3.03Å; E600-A604 PolarHBondContact O-N 2.92Å; A604-R607 PolarHBondContact O-N 3.08Å; A604-A608 PolarHBondContact O-N 3.13Å
605	Y	91.9	Very high	86.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-45	175.1	-172.2	-116.1	0	0	0	112	L563 F568 C571 H572 V575 F580 S601 F602 L603 R607 A608 C609	L563-Y605 HydrophobicContact CD1-CD1 3.97Å; L563-Y605 HydrophobicContact CD1-CG 4.21Å; L563-Y605 HydrophobicContact CG-CD1 4.19Å; F568-Y605 HydrophobicContact CB-CE1 4.11Å; F568-Y605 AromaticContact CD1-CD1 3.58Å; F568-Y605 HydrophobicContact CD1-CD1 3.58Å; F568-Y605 AromaticContact CD1-CE1 3.76Å; F568-Y605 HydrophobicContact CD1-CE1 3.76Å; F568-Y605 AromaticContact CE1-CD1 3.93Å; F568-Y605 HydrophobicContact CE1-CD1 3.93Å; F568-Y605 HydrophobicContact CG-CD1 4.29Å; F568-Y605 HydrophobicContact CG-CE1 4.21Å; C571-Y605 HydrophobicContact CB-CE1 4.29Å; C571-Y605 PolarHBondContact O-OH 3.32Å; C571-Y605 PolarHBondContact SG-OH 2.04Å; H572-Y605 PolarHBondContact CD2-OH 2.89Å; H572-Y605 PolarHBondContact N-OH 3.32Å; V575-Y605 HydrophobicContact CB-CE2 3.79Å; V575-Y605 HydrophobicContact CG1-CD2 4.04Å; V575-Y605 HydrophobicContact CG1-CE2 3.59Å; V575-Y605 PolarHBondContact O-OH 2.99Å; F580-Y605 HydrophobicContact CB-CD2 4.31Å; F580-Y605 HydrophobicContact CD1-CD2 4.42Å; F580-Y605 AromaticContact CD2-CD2 3.48Å; F580-Y605 HydrophobicContact CD2-CD2 3.48Å; F580-Y605 VanDerWaalsContact CD2-CD2 3.48Å; F580-Y605 HydrophobicContact CD2-CE2 4.19Å; F580-Y605 HydrophobicContact CD2-CG 4.39Å; F580-Y605 AromaticContact CE2-CD2 3.8Å; F580-Y605 HydrophobicContact CE2-CD2 3.8Å; F580-Y605 HydrophobicContact CE2-CE2 4.46Å; F580-Y605 AromaticContact CG-CD2 3.82Å; F580-Y605 HydrophobicContact CG-CD2 3.82Å; F580-Y605 HydrophobicContact CG-CG 4.3Å; F580-Y605 HydrophobicContact CZ-CD2 4.4Å; S601-Y605 PolarHBondContact O-N 3.17Å; F602-Y605 PolarHBondContact O-N 2.75Å; L603-Y605 VanDerWaalsContact C-N 3.35Å; L603-Y605 PolarHBondContact O-N 3.14Å; Y605-R607 VanDerWaalsContact C-N 3.33Å; Y605-R607 PolarHBondContact O-N 3.45Å; Y605-A608 WeakPolarHBondContact O-CB 3.36Å; Y605-A608 PolarHBondContact O-N 3.03Å; Y605-A608 VanDerWaalsContact O-N 3.11Å; Y605-C609 PolarHBondContact O-N 2.03Å; Y605-C609 PolarHBondContact O-SG 2.8Å
606	T	89.6	Confident	86.6	Confident	14 Å²	14	32.7 Å²	32.7	9%	0.086	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-44.4	177.2	-57.7	0	0	0	0	111.5	F602 L603 A608 C609 Q610 V616	F602-T606 WeakPolarHBondContact O-CB 3.21Å; F602-T606 PolarHBondContact O-N 2.81Å; F602-T606 PolarHBondContact O-OG1 3.3Å; L603-T606 PolarHBondContact O-N 3.04Å; T606-A608 VanDerWaalsContact C-N 3.34Å; T606-A608 PolarHBondContact O-N 3.07Å; T606-C609 WeakPolarHBondContact O-CB 3.3Å; T606-C609 PolarHBondContact O-N 3.33Å; T606-Q610 HydrophobicContact CG2-CG 4.47Å; T606-Q610 VanDerWaalsContact O-CG 3.31Å; T606-Q610 WeakPolarHBondContact O-CG 3.31Å; T606-Q610 PolarHBondContact O-N 2.94Å; T606-V616 HydrophobicContact CG2-CB 4.15Å; T606-V616 HydrophobicContact CG2-CG1 4.4Å; T606-V616 HydrophobicContact CG2-CG2 4.34Å
607	R	87.4	Confident	86.8	Confident	18 Å²	18	36.2 Å²	36.2	7%	0.068	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-40.5	175.7	-72.5	174.4	-176.1	140.5	-2.8	111.7	Y461 D476 F480 L603 A604 Y605 C609 Q610 R611	Y461-R607 PolarHBondContact OH-NE 2.85Å; Y461-R607 PolarHBondContact OH-NH2 2.94Å; D476-R607 IonicContact OD2-NH2 3.24Å; F480-R607 VanDerWaalsContact CB-NH1 3.27Å; F480-R607 VanDerWaalsContact CD1-NH1 3.35Å; L603-R607 WeakPolarHBondContact O-CB 2.91Å; L603-R607 VanDerWaalsContact O-CG 3.3Å; L603-R607 WeakPolarHBondContact O-CG 3.28Å; L603-R607 PolarHBondContact O-N 2.76Å; A604-R607 PolarHBondContact O-N 3.08Å; Y605-R607 VanDerWaalsContact C-N 3.33Å; Y605-R607 PolarHBondContact O-N 3.45Å; R607-C609 VanDerWaalsContact C-N 3.34Å; R607-C609 PolarHBondContact O-N 3.01Å; R607-Q610 PolarHBondContact O-N 2.94Å; R607-R611 WeakPolarHBondContact O-CB 3.41Å; R607-R611 PolarHBondContact O-N 2.92Å
608	A	89.8	Confident	87	Confident	2 Å²	2	36.7 Å²	36.7	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-40.2	175.3	0	0	0	0	0	112.5	V575 F580 A604 Y605 T606 E612	V575-A608 HydrophobicContact CG1-CB 3.89Å; V575-A608 HydrophobicContact CG2-CB 4.45Å; F580-A608 HydrophobicContact CZ-CB 4.11Å; A604-A608 PolarHBondContact O-N 3.13Å; Y605-A608 WeakPolarHBondContact O-CB 3.36Å; Y605-A608 PolarHBondContact O-N 3.03Å; Y605-A608 VanDerWaalsContact O-N 3.11Å; T606-A608 VanDerWaalsContact C-N 3.34Å; T606-A608 PolarHBondContact O-N 3.07Å; A608-E612 PolarHBondContact O-N 2.83Å
609	C	90.3	Very high	86.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-46.2	174.6	-59.2	0	0	0	0	112.6	C571 Y605 T606 R607 R611 E612 G613 I614 V616	C571-C609 HydrophobicContact CB-CB 3.79Å; C571-C609 WeakPolarHBondContact CB-SG 3.43Å; C571-C609 WeakPolarHBondContact SG-CA 3.47Å; C571-C609 WeakPolarHBondContact SG-CB 3.08Å; C571-C609 CovalentContact SG-SG 2.01Å; C571-C609 PolarHBondContact SG-SG 2.84Å; Y605-C609 PolarHBondContact O-N 2.03Å; Y605-C609 PolarHBondContact O-SG 2.8Å; T606-C609 WeakPolarHBondContact O-CB 3.3Å; T606-C609 PolarHBondContact O-N 3.33Å; R607-C609 VanDerWaalsContact C-N 3.34Å; R607-C609 PolarHBondContact O-N 3.01Å; C609-R611 VanDerWaalsContact C-N 3.25Å; C609-R611 PolarHBondContact O-N 3.11Å; C609-E612 CarbonylContact O-C 3.5Å; C609-E612 WeakPolarHBondContact O-CA 3.06Å; C609-E612 PolarHBondContact O-N 2.75Å; C609-G613 PolarHBondContact O-N 2.87Å; C609-I614 CarbonylContact C-O 3.52Å; C609-I614 HydrophobicContact CB-CB 4.46Å; C609-I614 PolarHBondContact O-N 2.81Å; C609-V616 HydrophobicContact CB-CG2 3.43Å; C609-V616 VanDerWaalsContact CB-CG2 3.43Å
610	Q	86.9	Confident	86.1	Confident	113 Å²	113	43.8 Å²	43.8	53%	0.528	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-36.2	178.9	-74.4	173.4	-22.6	0	0	112	T606 R607 E612 G613	T606-Q610 HydrophobicContact CG2-CG 4.47Å; T606-Q610 VanDerWaalsContact O-CG 3.31Å; T606-Q610 WeakPolarHBondContact O-CG 3.31Å; T606-Q610 PolarHBondContact O-N 2.94Å; R607-Q610 PolarHBondContact O-N 2.94Å; Q610-E612 PolarHBondContact O-N 2.97Å; Q610-G613 WeakPolarHBondContact O-CA 3.32Å; Q610-G613 PolarHBondContact O-N 2.88Å
611	R	85.9	Confident	85.5	Confident	92 Å²	92	47.2 Å²	47.2	35%	0.347	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-28.3	175.5	-172.7	172.9	60.3	-112	-6.2	113.3	E482 R607 C609 G613	E482-R611 IonicContact OE2-CZ 3.97Å; E482-R611 IonicContact OE2-NH1 2.69Å; E482-R611 PolarHBondContact OE2-NH1 2.04Å; R607-R611 WeakPolarHBondContact O-CB 3.41Å; R607-R611 PolarHBondContact O-N 2.92Å; C609-R611 VanDerWaalsContact C-N 3.25Å; C609-R611 PolarHBondContact O-N 3.11Å; R611-G613 PolarHBondContact O-N 2.79Å
612	E	85.1	Confident	84.3	Confident	75 Å²	75	56 Å²	56	35%	0.35	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	6.6	171.5	-66.8	-65.4	148.7	0	0	112.6	K360 T574 V575 A608 C609 Q610 I614	K360-E612 IonicContact NZ-OE1 2.73Å; K360-E612 PolarHBondContact NZ-OE1 3Å; K360-E612 IonicContact NZ-OE2 2.9Å; K360-E612 PolarHBondContact NZ-OE2 3.39Å; T574-E612 HydrophobicContact CG2-CB 3.89Å; T574-E612 HydrophobicContact CG2-CG 3.83Å; V575-E612 HydrophobicContact CG2-CG 4.18Å; A608-E612 PolarHBondContact O-N 2.83Å; C609-E612 CarbonylContact O-C 3.5Å; C609-E612 WeakPolarHBondContact O-CA 3.06Å; C609-E612 PolarHBondContact O-N 2.75Å; Q610-E612 PolarHBondContact O-N 2.97Å; E612-I614 VanDerWaalsContact C-N 3.29Å; E612-I614 HydrophobicContact CB-CD1 4.32Å; E612-I614 HydrophobicContact CB-CG1 4.39Å; E612-I614 PolarHBondContact O-N 2.66Å
613	G	84.1	Confident	83.1	Confident	70 Å²	70	59.7 Å²	59.7	72%	0.722	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	11.8	179.7	0	0	0	0	0	114.1	C609 Q610 R611	C609-G613 PolarHBondContact O-N 2.87Å; Q610-G613 WeakPolarHBondContact O-CA 3.32Å; Q610-G613 PolarHBondContact O-N 2.88Å; R611-G613 PolarHBondContact O-N 2.79Å
614	I	86.5	Confident	82.5	Confident	31 Å²	31	59.3 Å²	59.3	16%	0.159	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-92.6	121	-177.6	-56.9	173.8	0	0	0	109	C571 T574 C609 E612	C571-I614 HydrophobicContact CB-CG2 4.22Å; T574-I614 HydrophobicContact CG2-CD1 3.92Å; T574-I614 WeakPolarHBondContact OG1-CD1 3.1Å; C609-I614 CarbonylContact C-O 3.52Å; C609-I614 HydrophobicContact CB-CB 4.46Å; C609-I614 PolarHBondContact O-N 2.81Å; E612-I614 VanDerWaalsContact C-N 3.29Å; E612-I614 HydrophobicContact CB-CD1 4.32Å; E612-I614 HydrophobicContact CB-CG1 4.39Å; E612-I614 PolarHBondContact O-N 2.66Å
615	K	81.2	Confident	81.1	Confident	175 Å²	175	61.6 Å²	61.6	76%	0.761	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-77.2	126.5	172.6	-169	175.7	-179.2	-179.7	0	109.6
616	V	85.6	Confident	79.6	Confident	16 Å²	16	62.9 Å²	62.9	10%	0.097	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-99	142.9	177.2	179.1	0	0	0	0	108.8	E567 F568 T606 C609 W618	E567-V616 WeakPolarHBondContact O-CG1 3.3Å; F568-V616 HydrophobicContact CD1-CG1 3.48Å; F568-V616 VanDerWaalsContact CD1-CG1 3.48Å; F568-V616 HydrophobicContact CE1-CG1 3.55Å; F568-V616 HydrophobicContact CG-CG1 4.38Å; F568-V616 HydrophobicContact CZ-CG1 4.48Å; T606-V616 HydrophobicContact CG2-CB 4.15Å; T606-V616 HydrophobicContact CG2-CG1 4.4Å; T606-V616 HydrophobicContact CG2-CG2 4.34Å; C609-V616 HydrophobicContact CB-CG2 3.43Å; C609-V616 VanDerWaalsContact CB-CG2 3.43Å; V616-W618 HydrophobicContact CG1-CB 3.91Å
617	H	84.3	Confident	78.2	Confident	112 Å²	112	63.1 Å²	63.1	52%	0.519	33%	0.326	S	S	.	.			trans	-91.3	-12.7	-178.5	-67.8	-73.3	0	0	0	113.6	W566 E567	W566-H617 HydrophobicContact CH2-CB 4.49Å; W566-H617 HydrophobicContact CZ3-CB 4.23Å; E567-H617 HydrophobicContact CB-CB 4.47Å; E567-H617 PolarHBondContact O-N 2.95Å
618	W	86	Confident	77.1	Confident	31 Å²	31	68.6 Å²	68.6	12%	0.117	35%	0.353	C	S	.	.			trans	-69.9	134.8	178.2	-179.3	81.8	0	0	0	112.2	E567 F568 F602 L603 V616 P620	E567-W618 HydrophobicContact CB-CB 3.98Å; F568-W618 HydrophobicContact CD1-CB 4.49Å; F568-W618 HydrophobicContact CD2-CB 4.33Å; F568-W618 HydrophobicContact CE1-CB 3.82Å; F568-W618 HydrophobicContact CE1-CD2 4.39Å; F568-W618 HydrophobicContact CE1-CE3 4.41Å; F568-W618 HydrophobicContact CE1-CG 4.16Å; F568-W618 HydrophobicContact CE2-CB 3.63Å; F568-W618 AromaticContact CE2-CD1 3.67Å; F568-W618 HydrophobicContact CE2-CD2 4.13Å; F568-W618 AromaticContact CE2-CG 3.51Å; F568-W618 HydrophobicContact CE2-CG 3.51Å; F568-W618 HydrophobicContact CZ-CB 3.35Å; F568-W618 AromaticContact CZ-CD1 3.85Å; F568-W618 AromaticContact CZ-CD2 3.49Å; F568-W618 HydrophobicContact CZ-CD2 3.49Å; F568-W618 VanDerWaalsContact CZ-CD2 3.49Å; F568-W618 AromaticContact CZ-CE3 3.86Å; F568-W618 HydrophobicContact CZ-CE3 3.86Å; F568-W618 AromaticContact CZ-CG 3.25Å; F568-W618 HydrophobicContact CZ-CG 3.25Å; F602-W618 HydrophobicContact CB-CE3 4.48Å; F602-W618 HydrophobicContact CB-CH2 3.57Å; F602-W618 HydrophobicContact CB-CZ2 3.84Å; F602-W618 HydrophobicContact CB-CZ3 3.93Å; F602-W618 HydrophobicContact CD2-CD2 4.23Å; F602-W618 AromaticContact CD2-CE2 3.63Å; F602-W618 HydrophobicContact CD2-CH2 4.3Å; F602-W618 AromaticContact CD2-CZ2 3.69Å; F602-W618 HydrophobicContact CD2-CZ2 3.69Å; F602-W618 AromaticContact CD2-NE1 3.82Å; F602-W618 HydrophobicContact CG-CH2 4.4Å; F602-W618 HydrophobicContact CG-CZ2 4.17Å; L603-W618 HydrophobicContact CD2-CZ3 4.18Å; L603-W618 HydrophobicContact CG-CH2 4.49Å; L603-W618 HydrophobicContact CG-CZ3 4.39Å; V616-W618 HydrophobicContact CG1-CB 3.91Å; W618-P620 HydrophobicContact CH2-CB 3.99Å; W618-P620 HydrophobicContact CH2-CG 4.06Å; W618-P620 HydrophobicContact CZ3-CB 4.27Å; W618-P620 HydrophobicContact CZ3-CG 3.82Å
619	E	77.8	Confident	76.1	Confident	126 Å²	126	69.9 Å²	69.9	59%	0.589	36%	0.361	S	S	*	.			trans	-113.8	140.5	173.9	-65.6	-172.3	161.9	0	0	111.3	Q621 T637	E619-Q621 PolarHBondContact O-N 3.02Å; E619-T637 HydrophobicContact CG-CG2 4.42Å
620	P	74.6	Confident	74.7	Confident	25 Å²	25	76 Å²	76	16%	0.162	39%	0.388	C	S	.	.			trans	-63.9	132.8	176.6	-20.2	32.9	0	0	0	111.9	L603 W618 T627 Y635	L603-P620 HydrophobicContact CD2-CB 4.49Å; L603-P620 HydrophobicContact CD2-CG 3.75Å; W618-P620 HydrophobicContact CH2-CB 3.99Å; W618-P620 HydrophobicContact CH2-CG 4.06Å; W618-P620 HydrophobicContact CZ3-CB 4.27Å; W618-P620 HydrophobicContact CZ3-CG 3.82Å; P620-T627 HydrophobicContact CB-CG2 3.59Å; P620-Y635 HydrophobicContact CG-CE1 4.42Å
621	Q	72.3	Confident	74	Confident	78 Å²	78	74.7 Å²	74.7	36%	0.364	38%	0.382	S	S	.	.			trans	-68.6	152.8	176.7	-63.9	-168.2	-9.2	0	0	111.6	Y598 E619 N623 C624 T627	Y598-Q621 VanDerWaalsContact OH-CD 3.27Å; Y598-Q621 PolarHBondContact OH-OE1 3.43Å; E619-Q621 PolarHBondContact O-N 3.02Å; Q621-N623 WeakPolarHBondContact CB-OD1 3.14Å; Q621-N623 PolarHBondContact O-N 2.89Å; Q621-N623 PolarHBondContact OE1-ND2 3.38Å; Q621-N623 PolarHBondContact OE1-OD1 3.21Å; Q621-C624 VanDerWaalsContact O-CB 3.29Å; Q621-C624 WeakPolarHBondContact O-CB 3.42Å; Q621-C624 PolarHBondContact O-N 2.82Å; Q621-C624 PolarHBondContact O-SG 2.9Å; Q621-T627 PolarHBondContact O-OG1 3.25Å
622	Q	64.2	Low	73.3	Confident	185 Å²	185	72.5 Å²	72.5	86%	0.864	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.1	178	-74	-168.3	-2.4	0	0	114.5	T627	Q622-T627 PolarHBondContact O-OG1 3.02Å
623	N	66.4	Low	72.8	Confident	78 Å²	78	69.9 Å²	69.9	42%	0.417	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	0.2	178.2	56.8	24.9	0	0	0	113.2	N596 Q621	N596-N623 PolarHBondContact ND2-ND2 3.29Å; N596-N623 PolarHBondContact ND2-OD1 3.34Å; Q621-N623 WeakPolarHBondContact CB-OD1 3.14Å; Q621-N623 PolarHBondContact O-N 2.89Å; Q621-N623 PolarHBondContact OE1-ND2 3.38Å; Q621-N623 PolarHBondContact OE1-OD1 3.21Å
624	C	72.3	Confident	72.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.37	C	S	.	.	S	Bend	trans	-71.5	136.9	170.1	-67.3	0	0	0	0	110.3	C599 Q621 A626 T627	C599-C624 HydrophobicContact CB-CB 3.56Å; C599-C624 WeakPolarHBondContact CB-SG 3.5Å; C599-C624 WeakPolarHBondContact SG-CA 3.27Å; C599-C624 WeakPolarHBondContact SG-CB 3.49Å; C599-C624 CovalentContact SG-SG 2.04Å; C599-C624 PolarHBondContact SG-SG 3Å; Q621-C624 VanDerWaalsContact O-CB 3.29Å; Q621-C624 WeakPolarHBondContact O-CB 3.42Å; Q621-C624 PolarHBondContact O-N 2.82Å; Q621-C624 PolarHBondContact O-SG 2.9Å; C624-A626 PolarHBondContact O-N 3.47Å; C624-T627 HydrophobicContact CB-CG2 4.3Å; C624-T627 PolarHBondContact O-N 2.89Å; C624-T627 PolarHBondContact O-OG1 3.3Å
625	A	61.6	Low	71.9	Confident	52 Å²	52	71.4 Å²	71.4	43%	0.43	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-58.6	-36.5	178.1	0	0	0	0	0	112.1	T627 Q628	A625-T627 PolarHBondContact O-N 3.02Å; A625-Q628 WeakPolarHBondContact O-CB 3.46Å; A625-Q628 PolarHBondContact O-N 3.42Å
626	A	58.8	Low	71.3	Confident	27 Å²	27	66.2 Å²	66.2	22%	0.223	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-63.6	-20.8	176.7	0	0	0	0	0	115.1	L603 C624	L603-A626 HydrophobicContact CD1-CB 3.37Å; C624-A626 PolarHBondContact O-N 3.47Å
627	T	60.9	Low	70.2	Confident	19 Å²	19	68.6 Å²	68.6	12%	0.117	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-91.6	-8	174.7	57.7	0	0	0	0	112.6	P620 Q621 Q622 C624 A625 C629 Y635	P620-T627 HydrophobicContact CB-CG2 3.59Å; Q621-T627 PolarHBondContact O-OG1 3.25Å; Q622-T627 PolarHBondContact O-OG1 3.02Å; C624-T627 HydrophobicContact CB-CG2 4.3Å; C624-T627 PolarHBondContact O-N 2.89Å; C624-T627 PolarHBondContact O-OG1 3.3Å; A625-T627 PolarHBondContact O-N 3.02Å; T627-C629 PolarHBondContact O-N 3.29Å; T627-C629 VanDerWaalsContact O-N 3.08Å; T627-Y635 HydrophobicContact CG2-CD1 3.77Å; T627-Y635 HydrophobicContact CG2-CD2 4.21Å; T627-Y635 HydrophobicContact CG2-CE1 3.9Å; T627-Y635 HydrophobicContact CG2-CE2 4.33Å; T627-Y635 HydrophobicContact CG2-CG 3.93Å
628	Q	65.2	Low	69.3	Low	134 Å²	134	66.5 Å²	66.5	63%	0.626	36%	0.363	S	S	*	.			trans	-83.3	81.8	175.1	-65.5	-173.6	-4.4	0	0	111	A625	A625-Q628 WeakPolarHBondContact O-CB 3.46Å; A625-Q628 PolarHBondContact O-N 3.42Å
629	C	67.2	Low	68.6	Low	28 Å²	28	65.1 Å²	65.1	19%	0.189	36%	0.358	C	S	.	.			trans	-68	136.1	175.4	-58.9	0	0	0	0	111.7	T627 A633 Y635 C663	T627-C629 PolarHBondContact O-N 3.29Å; T627-C629 VanDerWaalsContact O-N 3.08Å; C629-A633 VanDerWaalsContact CB-C 3.48Å; C629-A633 HydrophobicContact CB-CB 3.93Å; C629-A633 WeakPolarHBondContact CB-O 3.34Å; C629-Y635 WeakPolarHBondContact SG-CA 3.22Å; C629-Y635 VanDerWaalsContact SG-CB 3.57Å; C629-Y635 PolarHBondContact SG-N 3.08Å; C629-C663 WeakPolarHBondContact CA-SG 3.37Å; C629-C663 HydrophobicContact CB-CB 3.78Å; C629-C663 WeakPolarHBondContact CB-SG 3.36Å; C629-C663 WeakPolarHBondContact SG-CA 3.48Å; C629-C663 WeakPolarHBondContact SG-CB 3.04Å; C629-C663 CovalentContact SG-SG 2.03Å; C629-C663 PolarHBondContact SG-SG 2.83Å
630	K	62.4	Low	68.2	Low	129 Å²	129	62.6 Å²	62.6	56%	0.561	35%	0.353	S	S	*	.			trans	-99.7	161	178.7	-66	-178.6	-179.2	174.9	0	110.6	G632	K630-G632 PolarHBondContact O-N 3.45Å
631	H	71.6	Confident	67.8	Low	86 Å²	86	62 Å²	62	40%	0.398	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	38.3	172.5	-53.2	-53.6	0	0	0	115.8	A633 G674 R675 C676	H631-A633 VanDerWaalsContact C-N 3.29Å; H631-A633 PolarHBondContact O-N 2.04Å; H631-G674 PolarHBondContact CD2-O 3.46Å; H631-R675 HydrophobicContact CB-CB 4.08Å; H631-R675 HydrophobicContact CB-CG 3.81Å; H631-C676 PolarHBondContact O-N 3.43Å
632	G	71.7	Confident	67.9	Low	45 Å²	45	60.7 Å²	60.7	46%	0.464	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	4.6	173.1	0	0	0	0	0	114.9	K630 P666	K630-G632 PolarHBondContact O-N 3.45Å; G632-P666 VanDerWaalsContact O-CD 3.23Å; G632-P666 WeakPolarHBondContact O-CD 3.23Å
633	A	75.3	Confident	68.4	Low	20 Å²	20	54.8 Å²	54.8	17%	0.165	32%	0.323	C	S	.	.			trans	-76.5	156.1	167.6	0	0	0	0	0	110.7	C629 H631 C663 H664	C629-A633 VanDerWaalsContact CB-C 3.48Å; C629-A633 HydrophobicContact CB-CB 3.93Å; C629-A633 WeakPolarHBondContact CB-O 3.34Å; H631-A633 VanDerWaalsContact C-N 3.29Å; H631-A633 PolarHBondContact O-N 2.04Å; A633-C663 HydrophobicContact CB-CB 4.14Å; A633-H664 CarbonylContact C-O 3.54Å; A633-H664 VanDerWaalsContact CA-O 3.31Å; A633-H664 WeakPolarHBondContact CA-O 2.99Å
634	V	78.5	Confident	69	Low	89 Å²	89	56.8 Å²	56.8	54%	0.539	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.2	178.6	-178.9	0	0	0	0	108.6	D636 C663 H664 P666	V634-D636 PolarHBondContact O-N 2.93Å; V634-C663 WeakPolarHBondContact O-CA 3.39Å; V634-H664 PolarHBondContact N-O 3.42Å; V634-H664 PolarHBondContact O-N 2.97Å; V634-P666 HydrophobicContact CG2-CG 4.02Å
635	Y	71.5	Confident	69.4	Low	45 Å²	45	58.1 Å²	58.1	18%	0.176	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	124.1	177.5	-171.3	-92.8	0	0	0	109.4	P620 T627 C629 T637 G662	P620-Y635 HydrophobicContact CG-CE1 4.42Å; T627-Y635 HydrophobicContact CG2-CD1 3.77Å; T627-Y635 HydrophobicContact CG2-CD2 4.21Å; T627-Y635 HydrophobicContact CG2-CE1 3.9Å; T627-Y635 HydrophobicContact CG2-CE2 4.33Å; T627-Y635 HydrophobicContact CG2-CG 3.93Å; C629-Y635 WeakPolarHBondContact SG-CA 3.22Å; C629-Y635 VanDerWaalsContact SG-CB 3.57Å; C629-Y635 PolarHBondContact SG-N 3.08Å; Y635-T637 HydrophobicContact CE1-CG2 4.05Å; Y635-G662 CarbonylContact C-O 3.59Å; Y635-G662 WeakPolarHBondContact CA-O 3.39Å
636	D	69.3	Low	70.3	Confident	66 Å²	66	56.5 Å²	56.5	35%	0.353	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.2	175.5	-164.6	-25.4	0	0	0	108.5	V634 C638 G639 A661 G662	V634-D636 PolarHBondContact O-N 2.93Å; D636-C638 VanDerWaalsContact C-N 3.25Å; D636-C638 VanDerWaalsContact OD1-C 3.3Å; D636-C638 PolarHBondContact OD1-N 3.07Å; D636-G639 PolarHBondContact OD1-N 2.96Å; D636-G639 WeakPolarHBondContact OD2-CA 3.45Å; D636-A661 CarbonylContact O-C 3.57Å; D636-A661 WeakPolarHBondContact O-CA 3.19Å; D636-G662 PolarHBondContact N-O 3.28Å; D636-G662 PolarHBondContact O-N 2.03Å
637	T	62.6	Low	71.2	Confident	65 Å²	65	60.2 Å²	60.2	40%	0.399	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-16.8	175	52.2	0	0	0	0	112.1	E619 Y635 A661	E619-T637 HydrophobicContact CG-CG2 4.42Å; Y635-T637 HydrophobicContact CE1-CG2 4.05Å; T637-A661 WeakPolarHBondContact O-CA 3.34Å; T637-A661 VanDerWaalsContact O-CB 3.31Å; T637-A661 WeakPolarHBondContact O-CB 3.39Å
638	C	66.2	Low	72	Confident	69 Å²	69	61.9 Å²	61.9	47%	0.466	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	61.9	179.1	179.7	0	0	0	0	109.8	D636 C659	D636-C638 VanDerWaalsContact C-N 3.25Å; D636-C638 VanDerWaalsContact OD1-C 3.3Å; D636-C638 PolarHBondContact OD1-N 3.07Å; C638-C659 VanDerWaalsContact CA-SG 3.58Å; C638-C659 HydrophobicContact CB-CB 3.97Å; C638-C659 WeakPolarHBondContact CB-SG 3.33Å; C638-C659 WeakPolarHBondContact SG-CB 3.39Å; C638-C659 CovalentContact SG-SG 2.03Å; C638-C659 PolarHBondContact SG-SG 2.83Å
639	G	70	Confident	72.5	Confident	2 Å²	2	60.2 Å²	60.2	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	173.2	178.9	0	0	0	0	0	114.1	D636 G641 C659 I660	D636-G639 PolarHBondContact OD1-N 2.96Å; D636-G639 WeakPolarHBondContact OD2-CA 3.45Å; G639-G641 PolarHBondContact O-N 2.91Å; G639-C659 CarbonylContact O-C 3.57Å; G639-C659 WeakPolarHBondContact O-CA 3.46Å; G639-C659 VanDerWaalsContact O-CB 3.26Å; G639-C659 WeakPolarHBondContact O-CB 3.06Å; G639-I660 PolarHBondContact N-O 3.27Å; G639-I660 PolarHBondContact O-N 3.33Å
640	P	69.6	Low	72.8	Confident	73 Å²	73	64 Å²	64	47%	0.474	35%	0.353	S	S	.	.			trans	-62.3	124.2	-175.1	23.5	-32	0	0	0	112.1	C642 I660	P640-C642 PolarHBondContact O-N 2.9Å; P640-C642 VanDerWaalsContact O-N 3.17Å; P640-I660 WeakPolarHBondContact O-CD1 3.31Å
641	G	67.4	Low	73.1	Confident	11 Å²	11	65 Å²	65	11%	0.113	36%	0.359	C	S	.	.	S	Bend	trans	-61.6	-20.3	178.8	0	0	0	0	0	115.1	G639 K657 P658	G639-G641 PolarHBondContact O-N 2.91Å; G641-K657 VanDerWaalsContact O-CD 3.26Å; G641-K657 WeakPolarHBondContact O-CD 3.37Å; G641-P658 WeakPolarHBondContact CA-O 3.08Å
642	C	74.3	Confident	72.2	Confident	51 Å²	51	69.5 Å²	69.5	35%	0.345	39%	0.385	S	S	.	.	S	Bend	trans	-115.8	117	175.2	-56.4	0	0	0	0	109.5	P640 C655	P640-C642 PolarHBondContact O-N 2.9Å; P640-C642 VanDerWaalsContact O-N 3.17Å; C642-C655 HydrophobicContact CB-CB 3.76Å; C642-C655 WeakPolarHBondContact CB-SG 3.44Å; C642-C655 PolarHBondContact N-SG 3.49Å; C642-C655 WeakPolarHBondContact SG-CB 3.34Å; C642-C655 CovalentContact SG-SG 2.02Å; C642-C655 PolarHBondContact SG-SG 2.93Å
643	I	74.8	Confident	71.7	Confident	61 Å²	61	70 Å²	70	31%	0.313	39%	0.389	S	S	.	.			trans	-75.9	133	-180	-162.7	157.5	0	0	0	111.1	T645 N648 L671	I643-T645 HydrophobicContact CG2-CG2 4.15Å; I643-N648 PolarHBondContact O-ND2 3.25Å; I643-N648 VanDerWaalsContact O-ND2 3.09Å; I643-L671 HydrophobicContact CD1-CB 4.12Å; I643-L671 HydrophobicContact CD1-CD2 3.44Å; I643-L671 VanDerWaalsContact CD1-CD2 3.44Å; I643-L671 HydrophobicContact CD1-CG 4.36Å; I643-L671 HydrophobicContact CG1-CB 4.27Å; I643-L671 HydrophobicContact CG1-CD2 4.36Å
644	K	78.1	Confident	70.9	Confident	121 Å²	121	74.6 Å²	74.6	53%	0.526	42%	0.418	S	S	.	.			trans	-87.8	120.5	171.4	-63.7	-172.4	178.4	-175.2	0	109.7	N648 V670 L671	K644-N648 WeakPolarHBondContact CA-OD1 3.41Å; K644-V670 HydrophobicContact CB-CG1 4.11Å; K644-V670 WeakPolarHBondContact O-CA 3.45Å; K644-L671 PolarHBondContact O-N 2.88Å
645	T	79.8	Confident	70.4	Confident	28 Å²	28	73.2 Å²	73.2	17%	0.172	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-116.4	170.2	175.6	72.2	0	0	0	0	110	I643 D647 N648 W649 L671	I643-T645 HydrophobicContact CG2-CG2 4.15Å; T645-D647 PolarHBondContact O-N 2.89Å; T645-D647 PolarHBondContact OG1-N 2.87Å; T645-N648 PolarHBondContact N-OD1 2.92Å; T645-N648 PolarHBondContact O-N 3.38Å; T645-N648 PolarHBondContact O-OD1 3.11Å; T645-N648 PolarHBondContact OG1-OD1 3.37Å; T645-W649 WeakPolarHBondContact O-CB 3.35Å; T645-W649 PolarHBondContact O-N 2.65Å; T645-L671 VanDerWaalsContact CA-O 3.29Å; T645-L671 WeakPolarHBondContact CA-O 3.42Å; T645-L671 WeakPolarHBondContact CB-O 3.09Å; T645-L671 HydrophobicContact CG2-CB 4.5Å
646	C	82.3	Confident	70.3	Confident	17 Å²	17	78.3 Å²	78.3	12%	0.115	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.7	172.8	-76.4	0	0	0	0	114.3	C682	C646-C682 WeakPolarHBondContact CA-SG 3.47Å; C646-C682 HydrophobicContact CB-CB 3.59Å; C646-C682 WeakPolarHBondContact CB-SG 3.36Å; C646-C682 WeakPolarHBondContact SG-CA 2.94Å; C646-C682 WeakPolarHBondContact SG-CB 3.34Å; C646-C682 CovalentContact SG-SG 2.04Å; C646-C682 PolarHBondContact SG-SG 2.88Å
647	D	76.4	Confident	70.2	Confident	106 Å²	106	80.8 Å²	80.8	57%	0.567	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-26.1	-176.7	-57.6	-55.8	0	0	0	113.2	T645	T645-D647 PolarHBondContact O-N 2.89Å; T645-D647 PolarHBondContact OG1-N 2.87Å
648	N	77.3	Confident	70.4	Confident	54 Å²	54	82.7 Å²	82.7	29%	0.289	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	2.7	-170.6	73.6	1.5	0	0	0	114.7	I643 K644 T645 N650 E651	I643-N648 PolarHBondContact O-ND2 3.25Å; I643-N648 VanDerWaalsContact O-ND2 3.09Å; K644-N648 WeakPolarHBondContact CA-OD1 3.41Å; T645-N648 PolarHBondContact N-OD1 2.92Å; T645-N648 PolarHBondContact O-N 3.38Å; T645-N648 PolarHBondContact O-OD1 3.11Å; T645-N648 PolarHBondContact OG1-OD1 3.37Å; N648-N650 PolarHBondContact O-N 3.18Å; N648-N650 VanDerWaalsContact O-N 3.1Å; N648-E651 PolarHBondContact O-N 3.01Å
649	W	76.3	Confident	70.5	Confident	98 Å²	98	82.6 Å²	82.6	37%	0.371	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.6	-174.5	75.9	-84.4	0	0	0	114.5	T645 V670 P679	T645-W649 WeakPolarHBondContact O-CB 3.35Å; T645-W649 PolarHBondContact O-N 2.65Å; W649-V670 HydrophobicContact CB-CG1 3.49Å; W649-V670 VanDerWaalsContact CB-CG1 3.49Å; W649-V670 HydrophobicContact CG-CG1 4.1Å; W649-P679 HydrophobicContact CD2-CB 3.65Å; W649-P679 HydrophobicContact CD2-CG 4.27Å; W649-P679 HydrophobicContact CE3-CB 3.72Å; W649-P679 HydrophobicContact CE3-CG 4.03Å; W649-P679 HydrophobicContact CG-CB 4.31Å; W649-P679 HydrophobicContact CH2-CB 3.81Å; W649-P679 HydrophobicContact CZ2-CB 3.73Å; W649-P679 HydrophobicContact CZ3-CB 3.8Å; W649-P679 HydrophobicContact CZ3-CG 4.26Å
650	N	73.6	Confident	70.2	Confident	109 Å²	109	84.1 Å²	84.1	58%	0.583	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-6.8	177	-77.4	-21.9	0	0	0	113.9	N648 I652	N648-N650 PolarHBondContact O-N 3.18Å; N648-N650 VanDerWaalsContact O-N 3.1Å; N650-I652 PolarHBondContact O-N 2.96Å
651	E	69.4	Low	69.9	Low	149 Å²	149	82.2 Å²	82.2	70%	0.696	46%	0.459	S	S	*	.			trans	-81.1	112.3	-179.7	-65.9	-176.4	174.6	0	0	110.2	N648 G653	N648-E651 PolarHBondContact O-N 3.01Å; E651-G653 PolarHBondContact O-N 2.84Å
652	I	52.6	Low	69.9	Low	181 Å²	181	81.7 Å²	81.7	93%	0.928	45%	0.454	S	S	*	.			trans	-89.8	82.1	177.2	-53	171.1	0	0	0	107.8	N650	N650-I652 PolarHBondContact O-N 2.96Å
653	G	59.9	Low	69.9	Low	54 Å²	54	81.8 Å²	81.8	56%	0.557	46%	0.455	S	S	*	.			trans	-121.8	143.9	173.1	0	0	0	0	0	111.5	E651 C655	E651-G653 PolarHBondContact O-N 2.84Å; G653-C655 PolarHBondContact O-N 2.89Å
654	P	59.3	Low	70	Confident	118 Å²	118	79.5 Å²	79.5	77%	0.766	44%	0.443	S	S	*	.			trans	-63.9	119.9	174.8	24.6	-30.9	0	0	0	110.4	N656	P654-N656 PolarHBondContact O-N 2.86Å
655	C	68.6	Low	70.1	Confident	59 Å²	59	74.8 Å²	74.8	40%	0.399	43%	0.425	S	S	.	.			trans	-82	100.8	173.3	178.4	0	0	0	0	109.8	C642 G653 K657	C642-C655 HydrophobicContact CB-CB 3.76Å; C642-C655 WeakPolarHBondContact CB-SG 3.44Å; C642-C655 PolarHBondContact N-SG 3.49Å; C642-C655 WeakPolarHBondContact SG-CB 3.34Å; C642-C655 CovalentContact SG-SG 2.02Å; C642-C655 PolarHBondContact SG-SG 2.93Å; G653-C655 PolarHBondContact O-N 2.89Å; C655-K657 PolarHBondContact O-N 2.64Å
656	N	69.6	Low	70.3	Confident	153 Å²	153	75.3 Å²	75.3	82%	0.818	43%	0.429	S	S	*	.			trans	-86.9	16.1	177.1	-68.1	-19	0	0	0	113.3	P654	P654-N656 PolarHBondContact O-N 2.86Å
657	K	66.9	Low	70.2	Confident	118 Å²	118	79.6 Å²	79.6	51%	0.513	47%	0.465	S	S	.	.	S	Bend	trans	-84.8	138.8	177	-72.2	-170.1	173.2	-171.8	0	110.3	G641 C655	G641-K657 VanDerWaalsContact O-CD 3.26Å; G641-K657 WeakPolarHBondContact O-CD 3.37Å; C655-K657 PolarHBondContact O-N 2.64Å
658	P	65.8	Low	70.6	Confident	104 Å²	104	79.8 Å²	79.8	68%	0.675	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-60.9	154.8	174.1	27.5	-34.1	0	0	0	110.7	G641	G641-P658 WeakPolarHBondContact CA-O 3.08Å
659	C	68.6	Low	71.1	Confident	68 Å²	68	78.8 Å²	78.8	46%	0.459	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-64.9	149.3	175.4	74.2	0	0	0	0	111	C638 G639	C638-C659 VanDerWaalsContact CA-SG 3.58Å; C638-C659 HydrophobicContact CB-CB 3.97Å; C638-C659 WeakPolarHBondContact CB-SG 3.33Å; C638-C659 WeakPolarHBondContact SG-CB 3.39Å; C638-C659 CovalentContact SG-SG 2.03Å; C638-C659 PolarHBondContact SG-SG 2.83Å; G639-C659 CarbonylContact O-C 3.57Å; G639-C659 WeakPolarHBondContact O-CA 3.46Å; G639-C659 VanDerWaalsContact O-CB 3.26Å; G639-C659 WeakPolarHBondContact O-CB 3.06Å
660	I	64.1	Low	71.5	Confident	33 Å²	33	74.2 Å²	74.2	17%	0.169	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.2	-171.4	46.9	172.6	0	0	0	109.4	G639 P640 H664	G639-I660 PolarHBondContact N-O 3.27Å; G639-I660 PolarHBondContact O-N 3.33Å; P640-I660 WeakPolarHBondContact O-CD1 3.31Å; I660-H664 PolarHBondContact O-NE2 2.82Å
661	A	63.3	Low	71.7	Confident	33 Å²	33	71.2 Å²	71.2	27%	0.273	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.2	170.9	0	0	0	0	0	109.4	Y461 D636 T637	Y461-A661 WeakPolarHBondContact CD1-O 3.33Å; Y461-A661 WeakPolarHBondContact CE1-O 3.35Å; D636-A661 CarbonylContact O-C 3.57Å; D636-A661 WeakPolarHBondContact O-CA 3.19Å; T637-A661 WeakPolarHBondContact O-CA 3.34Å; T637-A661 VanDerWaalsContact O-CB 3.31Å; T637-A661 WeakPolarHBondContact O-CB 3.39Å
662	G	67.8	Low	72.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.8	-175.4	177.4	0	0	0	0	0	114.8	Y635 D636 H664	Y635-G662 CarbonylContact C-O 3.59Å; Y635-G662 WeakPolarHBondContact CA-O 3.39Å; D636-G662 PolarHBondContact N-O 3.28Å; D636-G662 PolarHBondContact O-N 2.03Å; G662-H664 PolarHBondContact O-CD2 3.38Å
663	C	74.5	Confident	73	Confident	53 Å²	53	65 Å²	65	36%	0.358	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.5	173.6	-70.1	0	0	0	0	111.1	C629 A633 V634	C629-C663 WeakPolarHBondContact CA-SG 3.37Å; C629-C663 HydrophobicContact CB-CB 3.78Å; C629-C663 WeakPolarHBondContact CB-SG 3.36Å; C629-C663 WeakPolarHBondContact SG-CA 3.48Å; C629-C663 WeakPolarHBondContact SG-CB 3.04Å; C629-C663 CovalentContact SG-SG 2.03Å; C629-C663 PolarHBondContact SG-SG 2.83Å; A633-C663 HydrophobicContact CB-CB 4.14Å; V634-C663 WeakPolarHBondContact O-CA 3.39Å
664	H	75.8	Confident	73.2	Confident	13 Å²	13	64.1 Å²	64.1	6%	0.06	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	149.7	-178.3	-65.1	-74.5	0	0	0	111.6	A633 V634 I660 G662	A633-H664 CarbonylContact C-O 3.54Å; A633-H664 VanDerWaalsContact CA-O 3.31Å; A633-H664 WeakPolarHBondContact CA-O 2.99Å; V634-H664 PolarHBondContact N-O 3.42Å; V634-H664 PolarHBondContact O-N 2.97Å; I660-H664 PolarHBondContact O-NE2 2.82Å; G662-H664 PolarHBondContact O-CD2 3.38Å
665	C	80.7	Confident	74	Confident	22 Å²	22	65.7 Å²	65.7	15%	0.149	37%	0.374	C	S	.	.			trans	-69.5	135	167.1	-67.9	0	0	0	0	109.6	L669 C676	C665-L669 HydrophobicContact CB-CB 4.17Å; C665-C676 WeakPolarHBondContact CA-SG 3.12Å; C665-C676 HydrophobicContact CB-CB 3.81Å; C665-C676 WeakPolarHBondContact CB-SG 3.44Å; C665-C676 WeakPolarHBondContact SG-CA 3.41Å; C665-C676 WeakPolarHBondContact SG-CB 3.29Å; C665-C676 CovalentContact SG-SG 2.05Å; C665-C676 PolarHBondContact SG-SG 3.32Å
666	P	84.6	Confident	74.7	Confident	40 Å²	40	63.7 Å²	63.7	26%	0.26	36%	0.36	S	S	.	.			trans	-48.4	152.1	170.2	-28.8	34	0	0	0	112	G632 V634 N668 L669	G632-P666 VanDerWaalsContact O-CD 3.23Å; G632-P666 WeakPolarHBondContact O-CD 3.23Å; V634-P666 HydrophobicContact CG2-CG 4.02Å; P666-N668 WeakPolarHBondContact CB-OD1 3.45Å; P666-N668 PolarHBondContact O-N 3.05Å; P666-L669 HydrophobicContact CB-CD1 4.42Å; P666-L669 HydrophobicContact CB-CG 4.48Å; P666-L669 HydrophobicContact CG-CD1 4.1Å; P666-L669 PolarHBondContact O-N 3.22Å
667	A	79.8	Confident	75.5	Confident	106 Å²	106	58.1 Å²	58.1	88%	0.876	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.6	-171.4	0	0	0	0	0	115.3
668	N	84.2	Confident	76.6	Confident	110 Å²	110	58.3 Å²	58.3	59%	0.588	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.6	178.6	65	-27.1	0	0	0	114.6	P666 P679	P666-N668 WeakPolarHBondContact CB-OD1 3.45Å; P666-N668 PolarHBondContact O-N 3.05Å; N668-P679 WeakPolarHBondContact O-CD 3.07Å
669	L	87.1	Confident	77.7	Confident	33 Å²	33	54.8 Å²	54.8	17%	0.173	31%	0.308	C	S	.	.			trans	-121.3	157.8	-179.4	-59.1	-178.7	0	0	0	110.8	C665 P666 C676 I677 K678	C665-L669 HydrophobicContact CB-CB 4.17Å; P666-L669 HydrophobicContact CB-CD1 4.42Å; P666-L669 HydrophobicContact CB-CG 4.48Å; P666-L669 HydrophobicContact CG-CD1 4.1Å; P666-L669 PolarHBondContact O-N 3.22Å; L669-C676 HydrophobicContact CB-CB 4Å; L669-C676 HydrophobicContact CD1-CB 3.77Å; L669-I677 CarbonylContact C-O 3.57Å; L669-I677 WeakPolarHBondContact CA-O 3.4Å; L669-K678 HydrophobicContact CD2-CB 4.36Å; L669-K678 HydrophobicContact CD2-CG 3.67Å
670	V	85.3	Confident	78.6	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.018	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	147	177.8	-63.4	0	0	0	0	109.7	K644 W649 H672 C676 I677 P679 C682	K644-V670 HydrophobicContact CB-CG1 4.11Å; K644-V670 WeakPolarHBondContact O-CA 3.45Å; W649-V670 HydrophobicContact CB-CG1 3.49Å; W649-V670 VanDerWaalsContact CB-CG1 3.49Å; W649-V670 HydrophobicContact CG-CG1 4.1Å; V670-H672 PolarHBondContact O-N 3.32Å; V670-C676 WeakPolarHBondContact O-CA 3.41Å; V670-I677 HydrophobicContact CG2-CG1 4.16Å; V670-I677 PolarHBondContact N-O 3.29Å; V670-I677 PolarHBondContact O-N 3.47Å; V670-P679 HydrophobicContact CG1-CG 3.93Å; V670-P679 HydrophobicContact CG2-CG 4.46Å; V670-C682 VanDerWaalsContact CG2-SG 3.54Å
671	L	78.1	Confident	79.7	Confident	45 Å²	45	61.3 Å²	61.3	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.2	177.7	-175.7	69.8	0	0	0	109.9	I643 K644 T645	I643-L671 HydrophobicContact CD1-CB 4.12Å; I643-L671 HydrophobicContact CD1-CD2 3.44Å; I643-L671 VanDerWaalsContact CD1-CD2 3.44Å; I643-L671 HydrophobicContact CD1-CG 4.36Å; I643-L671 HydrophobicContact CG1-CB 4.27Å; I643-L671 HydrophobicContact CG1-CD2 4.36Å; K644-L671 PolarHBondContact O-N 2.88Å; T645-L671 VanDerWaalsContact CA-O 3.29Å; T645-L671 WeakPolarHBondContact CA-O 3.42Å; T645-L671 WeakPolarHBondContact CB-O 3.09Å; T645-L671 HydrophobicContact CG2-CB 4.5Å
672	H	79.3	Confident	80.8	Confident	44 Å²	44	60.7 Å²	60.7	20%	0.204	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	121.7	171.3	-170.4	68.3	0	0	0	110.8	V670 G674 R675 I677	V670-H672 PolarHBondContact O-N 3.32Å; H672-G674 PolarHBondContact O-N 2.8Å; H672-R675 PolarHBondContact N-O 2.97Å; H672-R675 PolarHBondContact O-N 3.15Å; H672-I677 HydrophobicContact CB-CD1 3.5Å; H672-I677 VanDerWaalsContact CB-CD1 3.5Å; H672-I677 HydrophobicContact CB-CG1 3.8Å
673	K	69.2	Low	81.5	Confident	156 Å²	156	64.6 Å²	64.6	68%	0.678	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	32.3	178.4	-64.1	-179.9	179.7	175.8	0	114.7	R444	R444-K673 PolarHBondContact NH2-O 2.87Å
674	G	65.6	Low	81.1	Confident	36 Å²	36	71.2 Å²	71.2	37%	0.371	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	14.8	-179.3	0	0	0	0	0	114.8	H631 H672	H631-G674 PolarHBondContact CD2-O 3.46Å; H672-G674 PolarHBondContact O-N 2.8Å
675	R	74.9	Confident	79.9	Confident	151 Å²	151	83.8 Å²	83.8	57%	0.57	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.5	175	-57.3	-166.7	161.9	170.8	-4.3	111.2	H631 H672 I677	H631-R675 HydrophobicContact CB-CB 4.08Å; H631-R675 HydrophobicContact CB-CG 3.81Å; H672-R675 PolarHBondContact N-O 2.97Å; H672-R675 PolarHBondContact O-N 3.15Å; R675-I677 HydrophobicContact CB-CG2 4.36Å
676	C	82.8	Confident	79.9	Confident	17 Å²	17	86.9 Å²	86.9	12%	0.115	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	114.8	171.8	-60.8	0	0	0	0	109.4	H631 C665 L669 V670	H631-C676 PolarHBondContact O-N 3.43Å; C665-C676 WeakPolarHBondContact CA-SG 3.12Å; C665-C676 HydrophobicContact CB-CB 3.81Å; C665-C676 WeakPolarHBondContact CB-SG 3.44Å; C665-C676 WeakPolarHBondContact SG-CA 3.41Å; C665-C676 WeakPolarHBondContact SG-CB 3.29Å; C665-C676 CovalentContact SG-SG 2.05Å; C665-C676 PolarHBondContact SG-SG 3.32Å; L669-C676 HydrophobicContact CB-CB 4Å; L669-C676 HydrophobicContact CD1-CB 3.77Å; V670-C676 WeakPolarHBondContact O-CA 3.41Å
677	I	87.9	Confident	79.6	Confident	35 Å²	35	89.4 Å²	89.4	18%	0.179	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	159.5	-179.9	65.4	170.7	0	0	0	110.3	L669 V670 H672 R675 L681	L669-I677 CarbonylContact C-O 3.57Å; L669-I677 WeakPolarHBondContact CA-O 3.4Å; V670-I677 HydrophobicContact CG2-CG1 4.16Å; V670-I677 PolarHBondContact N-O 3.29Å; V670-I677 PolarHBondContact O-N 3.47Å; H672-I677 HydrophobicContact CB-CD1 3.5Å; H672-I677 VanDerWaalsContact CB-CD1 3.5Å; H672-I677 HydrophobicContact CB-CG1 3.8Å; R675-I677 HydrophobicContact CB-CG2 4.36Å; I677-L681 HydrophobicContact CB-CB 4.49Å; I677-L681 HydrophobicContact CD1-CB 4.24Å
678	K	89.3	Confident	79.6	Confident	123 Å²	123	88.4 Å²	88.4	54%	0.535	43%	0.434	S	S	.	.			trans	-67.1	143	172.7	-67.5	-175	177.3	-179.4	0	109.3	L669 V680 L681	L669-K678 HydrophobicContact CD2-CB 4.36Å; L669-K678 HydrophobicContact CD2-CG 3.67Å; K678-V680 HydrophobicContact CB-CG2 3.9Å; K678-V680 PolarHBondContact O-N 3.47Å; K678-V680 VanDerWaalsContact O-N 3.12Å; K678-L681 HydrophobicContact CB-CD1 4.26Å; K678-L681 HydrophobicContact CB-CG 4.3Å; K678-L681 WeakPolarHBondContact O-CB 3.02Å; K678-L681 PolarHBondContact O-N 3.04Å
679	P	88	Confident	79.4	Confident	29 Å²	29	87.2 Å²	87.2	19%	0.188	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-52	-35.8	177.4	-26.7	31.5	0	0	0	114.2	W649 N668 V670 L681 C682	W649-P679 HydrophobicContact CD2-CB 3.65Å; W649-P679 HydrophobicContact CD2-CG 4.27Å; W649-P679 HydrophobicContact CE3-CB 3.72Å; W649-P679 HydrophobicContact CE3-CG 4.03Å; W649-P679 HydrophobicContact CG-CB 4.31Å; W649-P679 HydrophobicContact CH2-CB 3.81Å; W649-P679 HydrophobicContact CZ2-CB 3.73Å; W649-P679 HydrophobicContact CZ3-CB 3.8Å; W649-P679 HydrophobicContact CZ3-CG 4.26Å; N668-P679 WeakPolarHBondContact O-CD 3.07Å; V670-P679 HydrophobicContact CG1-CG 3.93Å; V670-P679 HydrophobicContact CG2-CG 4.46Å; P679-L681 PolarHBondContact O-N 3.32Å; P679-C682 WeakPolarHBondContact O-CB 3.28Å; P679-C682 PolarHBondContact O-N 2.01Å; P679-C682 PolarHBondContact O-SG 2.83Å
680	V	87.6	Confident	78.9	Confident	122 Å²	122	90.6 Å²	90.6	74%	0.739	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-64.4	-17.6	177.1	-59.2	0	0	0	0	114.3	K678	K678-V680 HydrophobicContact CB-CG2 3.9Å; K678-V680 PolarHBondContact O-N 3.47Å; K678-V680 VanDerWaalsContact O-N 3.12Å
681	L	89	Confident	78.5	Confident	117 Å²	117	96.4 Å²	96.4	61%	0.613	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-94.9	2.4	177.2	-60.5	175.6	0	0	0	112.2	I677 K678 P679	I677-L681 HydrophobicContact CB-CB 4.49Å; I677-L681 HydrophobicContact CD1-CB 4.24Å; K678-L681 HydrophobicContact CB-CD1 4.26Å; K678-L681 HydrophobicContact CB-CG 4.3Å; K678-L681 WeakPolarHBondContact O-CB 3.02Å; K678-L681 PolarHBondContact O-N 3.04Å; P679-L681 PolarHBondContact O-N 3.32Å
682	C	86	Confident	78.5	Confident	19 Å²	19	100.1 Å²	100.1	13%	0.128	49%	0.486	C	S	.	.	S	Bend	trans	-63	136.1	172.8	-71.9	0	0	0	0	109.8	C646 V670 P679 Q684	C646-C682 WeakPolarHBondContact CA-SG 3.47Å; C646-C682 HydrophobicContact CB-CB 3.59Å; C646-C682 WeakPolarHBondContact CB-SG 3.36Å; C646-C682 WeakPolarHBondContact SG-CA 2.94Å; C646-C682 WeakPolarHBondContact SG-CB 3.34Å; C646-C682 CovalentContact SG-SG 2.04Å; C646-C682 PolarHBondContact SG-SG 2.88Å; V670-C682 VanDerWaalsContact CG2-SG 3.54Å; P679-C682 WeakPolarHBondContact O-CB 3.28Å; P679-C682 PolarHBondContact O-N 2.01Å; P679-C682 PolarHBondContact O-SG 2.83Å; C682-Q684 PolarHBondContact O-N 2.84Å
683	P	81.3	Confident	78.4	Confident	83 Å²	83	104.4 Å²	104.4	54%	0.539	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-56.7	127.1	174.4	21.9	-29.7	0	0	0	108.8
684	Q	65.9	Low	79.2	Confident	191 Å²	191	100.1 Å²	100.1	89%	0.893	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-61.7	139.7	175.7	-69.4	-165.7	-16	0	0	109.2	C682	C682-Q684 PolarHBondContact O-N 2.84Å
685	R	52	Low	80.4	Confident	278 Å²	278	105.9 Å²	105.9	100%	1.049	50%	0.504	S	S	*	.			trans	-66.8	0	176.4	-89.9	-172.5	178.5	175.7	3.4	111.6

Retrieved 685 of 685 residues in 112.6 ms (Link to these results)

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