A0A061IBE0_CRIGR Loading...

Amyloid beta A4 protein-binding family A member 2-like isoform 1

AlphaFold DB , UniProt , Accession A0A061IBE0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Apba2, Length 750 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	34.6	Very low	244 Å²	244	169.2 Å²	169.2	100%	1.202	88%	0.88	S	S	*	*				0	155.5	0	-64.3	-179.2	-175.3	0	0	108.9
2	A	32.7	Very low	34.6	Very low	101 Å²	101	163.4 Å²	163.4	84%	0.835	87%	0.865	S	S	*	*			trans	57.3	116.2	162.1	0	0	0	0	0	120.1
3	H	37.7	Very low	34.7	Very low	162 Å²	162	162.9 Å²	162.9	75%	0.75	86%	0.858	S	S	*	*			trans	-69.1	166.5	160	-42.8	-116.8	0	0	0	111.9
4	R	34.1	Very low	34.9	Very low	230 Å²	230	161.4 Å²	161.4	87%	0.868	85%	0.85	S	S	*	*				-166.5	136.8	109.5	-112.1	173.3	177.8	159.8	2	116
5	K	46.9	Very low	35	Very low	196 Å²	196	158.4 Å²	158.4	85%	0.852	83%	0.834	S	S	*	*			trans	-76	162.5	154.1	-69.4	179.6	175.2	177.8	0	110.4
6	R	33.2	Very low	35.1	Very low	231 Å²	231	157.6 Å²	157.6	87%	0.872	83%	0.825	S	S	*	*			trans	-153.1	151.9	141.7	-115.8	175.4	-174.2	-162.3	-1.4	112.8
7	Q	38.9	Very low	35	Very low	194 Å²	194	160.9 Å²	160.9	91%	0.907	82%	0.824	S	S	*	*			trans	-126.4	155.2	169.3	-74.2	175.2	-60.7	0	0	108.6
8	S	29.1	Very low	34.8	Very low	108 Å²	108	159.2 Å²	159.2	76%	0.755	82%	0.822	S	S	*	*			trans	-176.3	149.6	172.3	48.1	0	0	0	0	109.2
9	T	30.1	Very low	34.8	Very low	143 Å²	143	162.8 Å²	162.8	88%	0.877	82%	0.824	S	S	*	*			cis	-167.3	164	-16.5	21.4	0	0	0	0	107
10	S	35.8	Very low	35.8	Very low	122 Å²	122	160.8 Å²	160.8	85%	0.853	82%	0.822	S	S	*	*			trans	-100.6	153.3	179	48.6	0	0	0	0	114.3
11	S	32.3	Very low	35.5	Very low	130 Å²	130	156.3 Å²	156.3	91%	0.909	82%	0.816	S	S	*	*			trans	-167.8	-178.9	150.7	-154.7	0	0	0	0	112.3
12	S	34.7	Very low	36.7	Very low	100 Å²	100	151 Å²	151	70%	0.699	80%	0.8	S	S	*	*			trans	-147.1	158.4	-166.8	174.1	0	0	0	0	113.4
13	M	35.4	Very low	36.9	Very low	157 Å²	157	153.7 Å²	153.7	77%	0.773	80%	0.799	S	S	*	*			trans	164.4	135.2	130.9	-90.9	-165.2	-63.8	0	0	116.8
14	L	38.1	Very low	37.7	Very low	142 Å²	142	151.6 Å²	151.6	74%	0.743	80%	0.799	S	S	*	*			trans	63.5	158.2	143.3	-59	172.1	0	0	0	120.4
15	D	35.8	Very low	37.6	Very low	116 Å²	116	148.4 Å²	148.4	62%	0.62	79%	0.794	S	S	*	*			cis	-159.8	171.3	5.9	-140.1	-32.2	0	0	0	116.5
16	H	37	Very low	36.7	Very low	146 Å²	146	145.3 Å²	145.3	68%	0.676	79%	0.787	S	S	*	*			trans	81.7	113.1	142.2	-86.9	25.4	0	0	0	127
17	R	33	Very low	36.4	Very low	214 Å²	214	142.9 Å²	142.9	81%	0.808	79%	0.785	S	S	*	*				117.3	121.9	112.6	-123.2	-170.6	-176.6	158.9	3.2	125.6
18	T	30.8	Very low	36	Very low	130 Å²	130	142.1 Å²	142.1	80%	0.798	78%	0.782	S	S	*	*			trans	83.8	144.7	139.8	22.1	0	0	0	0	126.1
19	R	35.9	Very low	37	Very low	227 Å²	227	141.8 Å²	141.8	86%	0.857	78%	0.777	S	S	*	*			trans	-159.3	163.9	176.4	-164.6	-157.8	-175.1	-168.9	5	110.6
20	P	54.6	Low	36.9	Very low	122 Å²	122	142 Å²	142	79%	0.792	77%	0.773	S	S	*	*			trans	-138.4	175.7	140.8	27.6	-7.3	0	0	0	116.2
21	G	29.7	Very low	36.7	Very low	67 Å²	67	139.5 Å²	139.5	69%	0.691	76%	0.755	S	S	*	*			trans	-98.3	-152.3	-177.2	0	0	0	0	0	115.5
22	P	55.5	Low	36.7	Very low	133 Å²	133	141.5 Å²	141.5	86%	0.864	75%	0.75	S	S	*	*			cis	-141	-160.5	35.7	42.8	-22.2	0	0	0	116.8
23	I	35.9	Very low	36.4	Very low	157 Å²	157	143.6 Å²	143.6	81%	0.805	75%	0.754	S	S	*	*			trans	-143.3	150.5	-176.6	-52.5	167.5	0	0	0	111.7
24	P	54.2	Low	36.1	Very low	118 Å²	118	141 Å²	141	77%	0.766	75%	0.746	S	S	*	*			trans	-141.4	177.3	140	39.4	-25.8	0	0	0	113.6
25	H	32.6	Very low	35.6	Very low	164 Å²	164	142.6 Å²	142.6	76%	0.759	75%	0.75	S	S	*	*			cis	-166.8	170.4	-47.1	-146.5	-97	0	0	0	110
26	D	29.3	Very low	35.3	Very low	130 Å²	130	144.8 Å²	144.8	70%	0.695	76%	0.761	S	S	*	*			trans	67	151.9	167.8	-54.9	-35.6	0	0	0	118.5
27	Q	26.9	Very low	35.8	Very low	181 Å²	181	142.7 Å²	142.7	85%	0.846	76%	0.761	S	S	*	*			cis	-152.2	158.1	6.4	-141.8	163.3	27	0	0	113.1
28	E	30.6	Very low	35.5	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	76%	0.759	S	S	*	*			trans	-130.1	-175	171.1	-123.3	-176.1	-174.6	0	0	108.2
29	P	48.6	Very low	35.2	Very low	101 Å²	101	141.1 Å²	141.1	66%	0.656	76%	0.757	S	S	*	*			cis	-118.3	-139.4	20.2	30.5	-5.1	0	0	0	111.2
30	D	29	Very low	34.6	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	75%	0.754	S	S	*	*			cis	-165.7	173.7	9.4	-132.4	-17.1	0	0	0	107.8
31	S	31.8	Very low	33.1	Very low	70 Å²	70	140.1 Å²	140.1	49%	0.49	76%	0.756	S	S	.	*			cis	-157.8	170.5	0.9	61.5	0	0	0	0	111.4
32	E	30.8	Very low	33.1	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	76%	0.758	S	S	*	*			trans	58.4	151.8	147.8	-70.2	159.1	125.9	0	0	122.4
33	D	29.2	Very low	32.8	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	75%	0.75	S	S	*	*			cis	-176.6	166.9	-35	-123.8	44.2	0	0	0	108.2
34	T	29.5	Very low	32.3	Very low	101 Å²	101	140.7 Å²	140.7	62%	0.62	75%	0.753	S	S	*	*			cis	-161.9	165.1	-2.3	-147.3	0	0	0	0	113.4
35	E	27.4	Very low	31	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	75%	0.748	S	S	*	*			trans	55	-179.2	158.5	-67.3	-170.4	135.6	0	0	124.2
36	L	28.8	Very low	30.8	Very low	162 Å²	162	137.5 Å²	137.5	85%	0.848	75%	0.749	S	S	*	*			trans	-147.1	-160.2	-157	-71.8	174.4	0	0	0	108.2
37	P	48.5	Very low	30.7	Very low	102 Å²	102	139.9 Å²	139.9	66%	0.662	76%	0.756	S	S	*	*				-128.1	-163.7	-66.4	36.2	-18.7	0	0	0	113.5
38	L	27	Very low	30.8	Very low	147 Å²	147	137.5 Å²	137.5	77%	0.77	75%	0.749	S	S	*	*			trans	90.6	133.8	150	-73.6	166.1	0	0	0	122.7
39	E	24.3	Very low	30.6	Very low	164 Å²	164	137.7 Å²	137.7	77%	0.766	75%	0.75	S	S	*	*			trans	62.4	113	141.3	-78.4	-179.7	136.9	0	0	124.5
40	S	22.6	Very low	29.6	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	75%	0.748	S	S	*	*				101.5	160.9	120.7	81.5	0	0	0	0	121.2
41	Y	23.9	Very low	29.6	Very low	216 Å²	216	137.1 Å²	137.1	85%	0.847	74%	0.744	S	S	*	*			trans	86.4	140.6	160.2	-122.7	-95.5	0	0	0	121.6
42	V	29.9	Very low	29.3	Very low	120 Å²	120	143 Å²	143	73%	0.727	76%	0.756	S	S	*	*			trans	-156.7	148.8	-175.4	165.8	0	0	0	0	104.8
43	P	48.2	Very low	29.9	Very low	107 Å²	107	140.5 Å²	140.5	70%	0.695	75%	0.754	S	S	*	*			cis	-127	-161.8	5	39.8	-21.8	0	0	0	113.3
44	T	24.4	Very low	29.7	Very low	142 Å²	142	139.7 Å²	139.7	87%	0.871	75%	0.746	S	S	*	*			trans	-179.8	142.7	131.9	-73.3	0	0	0	0	112.4
45	G	27.3	Very low	29.6	Very low	64 Å²	64	140.3 Å²	140.3	66%	0.66	76%	0.755	S	S	*	*			trans	85.2	133.9	166.7	0	0	0	0	0	116.2
46	L	29	Very low	30.3	Very low	151 Å²	151	137.8 Å²	137.8	79%	0.791	75%	0.753	S	S	*	*			cis	67.9	145.8	8.9	-54.8	-176.7	0	0	0	116.3	L48	L46-L48 HydrophobicContact CD2-CD1 4.19Å
47	E	26.7	Very low	30.1	Very low	180 Å²	180	136.3 Å²	136.3	84%	0.841	75%	0.751	S	S	*	*			cis	-127.4	159.4	-2.7	-68.3	-174.2	113.7	0	0	110.1
48	L	29.8	Very low	29.7	Very low	132 Å²	132	136.1 Å²	136.1	69%	0.691	75%	0.75	S	S	*	*			cis	111.6	86.7	4.6	-157.1	175.4	0	0	0	115.5	L46	L46-L48 HydrophobicContact CD2-CD1 4.19Å
49	E	24.8	Very low	29.8	Very low	182 Å²	182	137.1 Å²	137.1	85%	0.85	75%	0.751	S	S	*	*			trans	-148.2	155.8	167.5	-80	-158	124	0	0	111.4
50	T	28.9	Very low	29.9	Very low	99 Å²	99	137.4 Å²	137.4	61%	0.607	75%	0.752	S	S	*	*			cis	177.9	157.2	-36.8	39.7	0	0	0	0	106.8
51	L	29.6	Very low	30	Very low	137 Å²	137	139.3 Å²	139.3	72%	0.717	75%	0.749	S	S	*	*			cis	-166.3	133.8	-17.9	-107.8	174	0	0	0	111
52	R	25.5	Very low	30.1	Very low	194 Å²	194	136.6 Å²	136.6	73%	0.732	74%	0.744	S	S	*	*			trans	56.7	174.5	146.7	-83.1	-178.5	166.9	153.3	6.6	120.5	E54	R52-E54 WeakPolarHBondContact CD-OE1 3.49Å; R52-E54 WeakPolarHBondContact CG-OE1 3.05Å; R52-E54 IonicContact CZ-OE2 3.41Å; R52-E54 IonicContact NE-OE1 3.16Å; R52-E54 PolarHBondContact NE-OE1 3Å; R52-E54 VanDerWaalsContact NE-OE1 3.16Å; R52-E54 IonicContact NE-OE2 2.78Å; R52-E54 PolarHBondContact NE-OE2 3.11Å; R52-E54 IonicContact NH2-OE2 3.39Å; R52-E54 PolarHBondContact NH2-OE2 3.21Å
53	P	41.6	Very low	30	Very low	119 Å²	119	135.8 Å²	135.8	77%	0.773	74%	0.742	S	S	*	*			cis	-124.7	-177.4	-6.8	39.2	-23.7	0	0	0	114.3
54	E	25	Very low	29	Very low	126 Å²	126	138.6 Å²	138.6	59%	0.589	75%	0.746	S	S	*	*			cis	-146	-92.1	-44.1	-141.3	83	18	0	0	110.4	R52	R52-E54 WeakPolarHBondContact CD-OE1 3.49Å; R52-E54 WeakPolarHBondContact CG-OE1 3.05Å; R52-E54 IonicContact CZ-OE2 3.41Å; R52-E54 IonicContact NE-OE1 3.16Å; R52-E54 PolarHBondContact NE-OE1 3Å; R52-E54 VanDerWaalsContact NE-OE1 3.16Å; R52-E54 IonicContact NE-OE2 2.78Å; R52-E54 PolarHBondContact NE-OE2 3.11Å; R52-E54 IonicContact NH2-OE2 3.39Å; R52-E54 PolarHBondContact NH2-OE2 3.21Å
55	S	28	Very low	29.2	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	74%	0.738	S	S	*	*			trans	-164.1	177.7	175.3	-43	0	0	0	0	111.2
56	P	41.3	Very low	29.4	Very low	123 Å²	123	143 Å²	143	80%	0.799	74%	0.743	S	S	*	*				-151.1	-174.8	58.5	42.4	-19.8	0	0	0	118.5
57	T	25.2	Very low	29.7	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	74%	0.74	S	S	*	*			trans	-85.6	-169.9	167.9	47.5	0	0	0	0	111.4
58	P	41.5	Very low	31.1	Very low	98 Å²	98	137 Å²	137	64%	0.636	73%	0.731	S	S	*	*			cis	-149	-174.6	13.8	47.1	-25.4	0	0	0	119.8
59	E	27.7	Very low	31.4	Very low	169 Å²	169	138.2 Å²	138.2	79%	0.79	74%	0.738	S	S	*	*			trans	52.4	123.9	138	-73.8	155.2	-160.5	0	0	125.9
60	E	27.3	Very low	32	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	73%	0.733	S	S	*	*				64.7	150.2	124.7	-63.7	-162.4	165.1	0	0	127.3
61	Q	24.9	Very low	32.3	Very low	151 Å²	151	136 Å²	136	71%	0.706	75%	0.746	S	S	*	*			trans	78.1	105.9	151.2	-81.4	-172.1	-49.8	0	0	125.1
62	E	26	Very low	32.9	Very low	159 Å²	159	135 Å²	135	74%	0.743	75%	0.75	S	S	*	*				58.9	156.2	120.2	-66.6	-171.2	112.8	0	0	125.2
63	C	26.5	Very low	33.7	Very low	102 Å²	102	130.3 Å²	130.3	69%	0.689	75%	0.747	S	S	*	*			trans	86.1	94.3	155.8	-74.7	0	0	0	0	122.7
64	H	28.9	Very low	33.6	Very low	167 Å²	167	130.1 Å²	130.1	77%	0.773	75%	0.748	S	S	*	*				76.3	147.1	117.5	-78.1	-56.7	0	0	0	124.9
65	N	27.9	Very low	34.4	Very low	131 Å²	131	131 Å²	131	70%	0.701	76%	0.757	S	S	*	*			trans	92.8	88.6	148.9	-63.3	-27.5	0	0	0	122.6
66	H	31.6	Very low	34.7	Very low	167 Å²	167	136.6 Å²	136.6	77%	0.773	76%	0.762	S	S	*	*				49.2	123.8	118.3	-74	-71.9	0	0	0	124
67	S	34.8	Very low	34.7	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	76%	0.76	S	S	*	*			trans	74.9	162	131.2	-68.4	0	0	0	0	120.6
68	P	56.5	Low	35	Very low	100 Å²	100	137.3 Å²	137.3	65%	0.649	76%	0.758	S	S	*	*			cis	-135.6	-162.2	-18.8	31.3	-7.6	0	0	0	114.3
69	D	36.5	Very low	34.6	Very low	158 Å²	158	139.9 Å²	139.9	85%	0.845	77%	0.767	S	S	*	*			trans	73	145.1	160	-49.8	-29.7	0	0	0	119.3
70	G	36.1	Very low	35	Very low	71 Å²	71	137.5 Å²	137.5	73%	0.732	76%	0.764	S	S	*	*			cis	175	146.1	-9.7	0	0	0	0	0	115.1
71	D	36	Very low	35.4	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	75%	0.754	S	S	*	*			trans	49.4	135.7	153.5	-156.4	19.7	0	0	0	123.7
72	S	41.4	Very low	36.1	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	76%	0.755	S	S	*	*			trans	178.4	154.8	136.3	-167.4	0	0	0	0	111.7
73	S	43.6	Very low	36.6	Very low	94 Å²	94	134.5 Å²	134.5	66%	0.657	76%	0.759	S	S	*	*			trans	-147.8	156.9	-171.6	176	0	0	0	0	113.3
74	S	38.5	Very low	37.1	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	76%	0.763	S	S	*	*			trans	179.2	144.6	138.6	30.9	0	0	0	0	114.2
75	D	42.6	Very low	37.3	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	77%	0.768	S	S	*	*			trans	-89.4	165.7	175.3	-43	-96.2	0	0	0	113.4
76	Y	33.1	Very low	37.6	Very low	232 Å²	232	141.2 Å²	141.2	91%	0.91	78%	0.775	S	S	*	*			trans	-153.5	143.9	141.2	-120.5	-79.7	0	0	0	112.1
77	V	42.3	Very low	37.8	Very low	125 Å²	125	141.3 Å²	141.3	76%	0.758	78%	0.781	S	S	*	*			trans	-117.4	145.6	176.7	-179.6	0	0	0	0	108.9
78	N	30.9	Very low	37.9	Very low	144 Å²	144	145 Å²	145	77%	0.77	79%	0.787	S	S	*	*			trans	-135.5	141.6	164.8	-173.3	36.9	0	0	0	110
79	N	34.1	Very low	36.6	Very low	153 Å²	153	143.8 Å²	143.8	82%	0.818	79%	0.792	S	S	*	*			trans	-156.6	103.1	-174.6	-150.9	23.3	0	0	0	111.5
80	T	34.5	Very low	36.4	Very low	118 Å²	118	144 Å²	144	72%	0.724	79%	0.792	S	S	*	*			trans	-170.5	145.3	174.7	25.7	0	0	0	0	107.3
81	S	37.6	Very low	36.4	Very low	84 Å²	84	146 Å²	146	59%	0.587	79%	0.793	S	S	*	*			cis	-161.5	-179.2	-10.9	-158.9	0	0	0	0	108.4
82	E	38.9	Very low	36.4	Very low	156 Å²	156	147.4 Å²	147.4	73%	0.729	79%	0.794	S	S	*	*			trans	2.1	139.5	169	56.7	-115.9	122.3	0	0	120.5
83	E	35.4	Very low	36.1	Very low	178 Å²	178	150.9 Å²	150.9	83%	0.832	80%	0.797	S	S	*	*				-149.2	172.4	54.3	-74.8	-76.8	-173	0	0	113.5
84	E	38.3	Very low	35.7	Very low	161 Å²	161	154.7 Å²	154.7	75%	0.752	81%	0.805	S	S	*	*			trans	-89.5	137.6	172.6	-62.9	-179.8	178.4	0	0	112.4
85	D	33.3	Very low	35.6	Very low	168 Å²	168	158 Å²	158	90%	0.898	81%	0.808	S	S	*	*			trans	-144.9	137.8	158.7	-123.1	-27.6	0	0	0	109.2
86	Y	34.1	Very low	35.1	Very low	212 Å²	212	153 Å²	153	83%	0.831	79%	0.791	S	S	*	*			trans	-94.1	130.4	-176.8	-80.7	-117.4	0	0	0	110.5
87	D	35.3	Very low	35.3	Very low	168 Å²	168	145.4 Å²	145.4	90%	0.898	77%	0.768	S	S	*	*			trans	-130.4	144.9	154.6	-159.7	2.5	0	0	0	109.7	G89	D87-G89 PolarHBondContact O-N 3.19Å
88	E	36.2	Very low	34.9	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	74%	0.744	S	S	*	*			trans	-93.3	98.7	-159.5	-165.5	165.6	-148.4	0	0	110.9	L90	E88-L90 PolarHBondContact O-N 3.23Å
89	G	30.8	Very low	35.2	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	72%	0.718	S	S	*	*			trans	-59.2	103.3	-177.2	0	0	0	0	0	113.3	D87	D87-G89 PolarHBondContact O-N 3.19Å
90	L	31.4	Very low	35.2	Very low	161 Å²	161	136.9 Å²	136.9	84%	0.843	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.1	164.8	-69.8	168.2	0	0	0	109.3	E88 E92	E88-L90 PolarHBondContact O-N 3.23Å; L90-E92 PolarHBondContact O-N 2.9Å
91	P	35.9	Very low	35.3	Very low	115 Å²	115	132 Å²	132	75%	0.747	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-66.5	135.5	174	28.5	-33.5	0	0	0	109.9	E93	P91-E93 PolarHBondContact O-N 2.92Å
92	E	37.1	Very low	34.9	Very low	193 Å²	193	132.7 Å²	132.7	90%	0.902	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-62.3	121.8	167.7	-63.9	-179.1	131.1	0	0	108.5	L90 E94	L90-E92 PolarHBondContact O-N 2.9Å; E92-E94 PolarHBondContact O-N 3.18Å
93	E	34.3	Very low	34.5	Very low	189 Å²	189	130 Å²	130	88%	0.883	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-67.3	121.3	174.8	-70.9	-168.2	164.3	0	0	109.3	P91 E95	P91-E93 PolarHBondContact O-N 2.92Å; E93-E95 PolarHBondContact O-N 3.11Å; E93-E95 VanDerWaalsContact O-N 3.16Å
94	E	35.3	Very low	34.1	Very low	175 Å²	175	124.9 Å²	124.9	82%	0.818	63%	0.632	S	S	*	*			trans	-57.7	113.1	-174.5	-170.9	174.5	-172.7	0	0	111.6	E92 G96	E92-E94 PolarHBondContact O-N 3.18Å; E94-G96 PolarHBondContact O-N 3.27Å
95	E	36.9	Very low	33.8	Very low	185 Å²	185	120.6 Å²	120.6	86%	0.864	62%	0.618	S	S	*	*			trans	-62	108.8	-179	-78.9	-159	124.3	0	0	111.3	E93 V97	E93-E95 PolarHBondContact O-N 3.11Å; E93-E95 VanDerWaalsContact O-N 3.16Å; E95-V97 PolarHBondContact O-N 3.23Å
96	G	32	Very low	33.9	Very low	40 Å²	40	117.4 Å²	117.4	41%	0.412	60%	0.598	S	S	.	*			trans	-50.4	126.7	179.6	0	0	0	0	0	113.3	E94 T98	E94-G96 PolarHBondContact O-N 3.27Å; G96-T98 PolarHBondContact O-N 3.01Å
97	V	38	Very low	33.8	Very low	71 Å²	71	112.1 Å²	112.1	43%	0.43	58%	0.584	S	S	.	*			trans	-78.2	97.9	-166.1	-174.2	0	0	0	0	110.3	E95 Y99	E95-V97 PolarHBondContact O-N 3.23Å; V97-Y99 HydrophobicContact CB-CE2 4.22Å; V97-Y99 HydrophobicContact CG1-CE1 4.08Å; V97-Y99 HydrophobicContact CG1-CE2 4.24Å; V97-Y99 VanDerWaalsContact CG1-OH 3.26Å; V97-Y99 WeakPolarHBondContact CG1-OH 3.48Å; V97-Y99 WeakPolarHBondContact O-CD2 3.5Å; V97-Y99 WeakPolarHBondContact O-CE2 3.25Å; V97-Y99 PolarHBondContact O-N 2.74Å; V97-Y99 VanDerWaalsContact O-N 3.15Å
98	T	32.2	Very low	33.6	Very low	42 Å²	42	110 Å²	110	26%	0.258	57%	0.572	S	S	.	*			trans	-87.1	93.4	-165	38.2	0	0	0	0	115	G96 Y100 K391 M395	G96-T98 PolarHBondContact O-N 3.01Å; T98-Y100 PolarHBondContact O-N 3.46Å; T98-K391 VanDerWaalsContact CB-CE 3.49Å; T98-K391 PolarHBondContact O-NZ 3.22Å; T98-K391 WeakPolarHBondContact OG1-CE 3.39Å; T98-K391 PolarHBondContact OG1-NZ 3.47Å; T98-M395 HydrophobicContact CG2-CE 3.34Å
99	Y	38.7	Very low	33.4	Very low	57 Å²	57	106.3 Å²	106.3	22%	0.224	57%	0.567	C	S	.	*			trans	-60.8	125.7	175.6	-55.2	-74.4	0	0	0	113.1	V97 A514 Q515	V97-Y99 HydrophobicContact CB-CE2 4.22Å; V97-Y99 HydrophobicContact CG1-CE1 4.08Å; V97-Y99 HydrophobicContact CG1-CE2 4.24Å; V97-Y99 VanDerWaalsContact CG1-OH 3.26Å; V97-Y99 WeakPolarHBondContact CG1-OH 3.48Å; V97-Y99 WeakPolarHBondContact O-CD2 3.5Å; V97-Y99 WeakPolarHBondContact O-CE2 3.25Å; V97-Y99 PolarHBondContact O-N 2.74Å; V97-Y99 VanDerWaalsContact O-N 3.15Å; Y99-A514 HydrophobicContact CD2-CB 4.08Å; Y99-A514 HydrophobicContact CE2-CB 4.4Å; Y99-Q515 HydrophobicContact CD2-CG 4.42Å; Y99-Q515 HydrophobicContact CE1-CG 3.8Å; Y99-Q515 HydrophobicContact CE2-CB 4.43Å; Y99-Q515 HydrophobicContact CE2-CG 3.53Å; Y99-Q515 WeakPolarHBondContact OH-CG 3.3Å; Y99-Q515 PolarHBondContact OH-NE2 3.09Å; Y99-Q515 VanDerWaalsContact OH-NE2 3.08Å
100	Y	32.4	Very low	33.7	Very low	145 Å²	145	113 Å²	113	57%	0.569	57%	0.57	S	S	*	*			trans	-107.9	110.7	-175.1	-178.7	-113.1	0	0	0	112.8	T98 R102	T98-Y100 PolarHBondContact O-N 3.46Å; Y100-R102 HydrophobicContact CD1-CG 4.11Å; Y100-R102 HydrophobicContact CE1-CG 3.85Å; Y100-R102 PolarHBondContact O-N 2.84Å
101	I	38.1	Very low	33.9	Very low	14 Å²	14	111.5 Å²	111.5	7%	0.072	56%	0.562	C	S	.	*			trans	-75.3	110.2	173.7	-55.9	163.2	0	0	0	109.1	I458 I461 F521	I101-I458 HydrophobicContact CD1-CG2 3.88Å; I101-I461 HydrophobicContact CD1-CB 4.27Å; I101-I461 HydrophobicContact CD1-CG2 3.74Å; I101-I461 HydrophobicContact CG1-CG2 4.19Å; I101-F521 HydrophobicContact CB-CD2 4.46Å; I101-F521 HydrophobicContact CD1-CD2 3.86Å; I101-F521 HydrophobicContact CD1-CE2 3.32Å; I101-F521 HydrophobicContact CD1-CZ 3.71Å; I101-F521 HydrophobicContact CG1-CD2 3.63Å; I101-F521 HydrophobicContact CG1-CE2 3.66Å; I101-F521 HydrophobicContact CG1-CG 4.19Å; I101-F521 HydrophobicContact CG1-CZ 4.19Å; I101-F521 HydrophobicContact CG2-CD1 3.56Å; I101-F521 HydrophobicContact CG2-CD2 4.05Å; I101-F521 HydrophobicContact CG2-CE1 3.56Å; I101-F521 HydrophobicContact CG2-CE2 4.1Å; I101-F521 HydrophobicContact CG2-CG 3.82Å; I101-F521 HydrophobicContact CG2-CZ 3.87Å
102	R	28.7	Very low	34	Very low	99 Å²	99	115.6 Å²	115.6	37%	0.374	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-71.7	133	166.1	-69.2	-165.1	-159.9	-121.7	10.3	109.3	Y100 D546	Y100-R102 HydrophobicContact CD1-CG 4.11Å; Y100-R102 HydrophobicContact CE1-CG 3.85Å; Y100-R102 PolarHBondContact O-N 2.84Å; R102-D546 IonicContact CZ-OD1 3.79Å; R102-D546 IonicContact NH1-OD1 3.96Å; R102-D546 PolarHBondContact NH1-OD1 3.24Å; R102-D546 IonicContact NH2-OD1 2.7Å
103	Y	31.1	Very low	34	Very low	100 Å²	100	110 Å²	110	39%	0.392	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-62.1	135.8	-175.1	-103	-142.4	0	0	0	114	S459 R473	Y103-S459 PolarHBondContact OH-OG 2.98Å; Y103-R473 VanDerWaalsContact CE1-NH1 3.34Å
104	C	25.5	Very low	33.8	Very low	71 Å²	71	109.3 Å²	109.3	48%	0.48	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-77	130.6	146.7	-63.6	0	0	0	0	109.5	E106	C104-E106 PolarHBondContact O-N 3.45Å
105	P	32.5	Very low	33.5	Very low	70 Å²	70	108.7 Å²	108.7	46%	0.455	57%	0.567	S	S	.	*			trans	-84.9	104.4	167.8	32.4	-29.3	0	0	0	109.7
106	E	36.6	Very low	33	Very low	102 Å²	102	105.2 Å²	105.2	48%	0.477	56%	0.562	S	S	.	*			trans	-127.5	131.3	172.4	-67.7	-133.2	102.9	0	0	111.6	C104 R456 R686	C104-E106 PolarHBondContact O-N 3.45Å; E106-R456 WeakPolarHBondContact OE2-CD 3.34Å; E106-R456 IonicContact OE2-NE 2.81Å; E106-R456 PolarHBondContact OE2-NE 3.41Å; E106-R686 IonicContact OE1-CZ 2.7Å; E106-R686 IonicContact OE1-NH1 3.46Å; E106-R686 PolarHBondContact OE1-NH1 2.92Å
107	D	30.9	Very low	32.9	Very low	101 Å²	101	110.7 Å²	110.7	54%	0.54	58%	0.581	S	S	.	*			trans	-75	139.7	178	-54.5	-81.1	0	0	0	111.9	S109 R686	D107-S109 PolarHBondContact O-N 3.36Å; D107-R686 VanDerWaalsContact N-NH2 3.2Å; D107-R686 IonicContact OD2-CZ 3.69Å; D107-R686 IonicContact OD2-NE 3.94Å; D107-R686 IonicContact OD2-NH2 2.66Å; D107-R686 PolarHBondContact OD2-NH2 2.86Å
108	D	30.2	Very low	32.5	Very low	122 Å²	122	111.1 Å²	111.1	65%	0.652	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	3.1	176.6	-77.2	-44.6	0	0	0	114	Y110 R475	D108-Y110 VanDerWaalsContact C-N 3.33Å; D108-Y110 PolarHBondContact O-N 3.07Å; D108-R475 IonicContact OD1-CZ 3.81Å; D108-R475 IonicContact OD1-NE 3.32Å; D108-R475 PolarHBondContact OD1-NE 2.71Å; D108-R475 IonicContact OD1-NH2 3.74Å; D108-R475 PolarHBondContact OD1-NH2 2.75Å
109	S	32.7	Very low	32.3	Very low	105 Å²	105	118 Å²	118	73%	0.734	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-2.2	-175.2	59.4	0	0	0	0	115.7	D107	D107-S109 PolarHBondContact O-N 3.36Å
110	Y	36.8	Very low	31.8	Very low	215 Å²	215	124.1 Å²	124.1	84%	0.843	66%	0.66	S	S	*	*	S	Bend	trans	-113.6	51.3	-175.1	-145.8	-86.1	0	0	0	113.1	D108	D108-Y110 VanDerWaalsContact C-N 3.33Å; D108-Y110 PolarHBondContact O-N 3.07Å
111	L	35.5	Very low	31.6	Very low	131 Å²	131	128.2 Å²	128.2	69%	0.686	68%	0.676	S	S	*	*			trans	-156.7	40.7	169.7	-137.5	146.5	0	0	0	113.3	R475	L111-R475 VanDerWaalsContact CB-NH1 3.27Å; L111-R475 VanDerWaalsContact CD1-NH1 3.31Å
112	E	38.4	Very low	31	Very low	201 Å²	201	135.4 Å²	135.4	94%	0.939	71%	0.713	S	S	*	*	S	Bend	trans	-129.2	110.1	166.8	-159.6	164.6	-121.1	0	0	106.6
113	G	37.3	Very low	31	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	73%	0.729	S	S	*	*	S	Bend	trans	106.9	57.2	-175.7	0	0	0	0	0	116.5
114	M	29.6	Very low	30.7	Very low	174 Å²	174	139.7 Å²	139.7	86%	0.857	76%	0.756	S	S	*	*			trans	-161.2	79.5	151.2	-112.4	169.3	-173.2	0	0	110.3	C116	M114-C116 PolarHBondContact O-N 3.43Å; M114-C116 VanDerWaalsContact O-N 3.13Å
115	D	28.2	Very low	30.6	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	77%	0.767	S	S	*	*			trans	-71.4	98.6	162.8	-70.6	-54.9	0	0	0	108.3	N117	D115-N117 PolarHBondContact O-N 2.93Å
116	C	27.4	Very low	30.3	Very low	113 Å²	113	141.1 Å²	141.1	76%	0.764	79%	0.785	S	S	*	*			trans	-75.6	93.2	176.2	-66.7	0	0	0	0	110	M114 G118	M114-C116 PolarHBondContact O-N 3.43Å; M114-C116 VanDerWaalsContact O-N 3.13Å; C116-G118 PolarHBondContact O-N 3.34Å
117	N	29.8	Very low	29.7	Very low	154 Å²	154	143.9 Å²	143.9	82%	0.824	80%	0.798	S	S	*	*			trans	-52.4	124.5	153	-78.1	-6.4	0	0	0	107.9	D115 E119	D115-N117 PolarHBondContact O-N 2.93Å; N117-E119 PolarHBondContact O-N 2.74Å
118	G	29.4	Very low	29.5	Very low	81 Å²	81	144.9 Å²	144.9	84%	0.835	81%	0.809	S	S	*	*			trans	-75.4	108.3	176.8	0	0	0	0	0	110.4	C116	C116-G118 PolarHBondContact O-N 3.34Å
119	E	28.3	Very low	29.3	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	81%	0.81	S	S	*	*			trans	-107.5	135.3	161.5	-71.2	-167.3	156	0	0	109.9	N117	N117-E119 PolarHBondContact O-N 2.74Å
120	E	27.2	Very low	29	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	81%	0.808	S	S	*	*			trans	-88.6	146.9	-166	-168.1	172.1	-174.6	0	0	111.6	I122	E120-I122 PolarHBondContact O-N 3.2Å
121	Y	29.3	Very low	28.6	Very low	230 Å²	230	142.2 Å²	142.2	90%	0.902	81%	0.811	S	S	*	*			trans	-68.6	106.3	177.6	-90.6	-93.5	0	0	0	110.8	A123	Y121-A123 PolarHBondContact O-N 3.08Å
122	I	26.1	Very low	28.1	Very low	165 Å²	165	143.5 Å²	143.5	85%	0.846	82%	0.818	S	S	*	*			trans	-60.5	110.9	171.8	-64.9	179.1	0	0	0	109.8	E120	E120-I122 PolarHBondContact O-N 3.2Å
123	A	27.3	Very low	27.6	Very low	86 Å²	86	142.4 Å²	142.4	71%	0.711	81%	0.813	S	S	*	*			trans	-77.5	142	165.5	0	0	0	0	0	110.5	Y121 G125	Y121-A123 PolarHBondContact O-N 3.08Å; A123-G125 PolarHBondContact O-N 2.95Å; A123-G125 VanDerWaalsContact O-N 3.13Å
124	H	25.2	Very low	27.1	Very low	204 Å²	204	143.1 Å²	143.1	94%	0.944	81%	0.805	S	S	*	*			trans	-69.2	106.6	172.5	-74.6	-66.9	0	0	0	111
125	G	23.7	Very low	26.8	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	80%	0.8	S	S	*	*			trans	-172.6	81.5	177.7	0	0	0	0	0	117	A123	A123-G125 PolarHBondContact O-N 2.95Å; A123-G125 VanDerWaalsContact O-N 3.13Å
126	A	25.4	Very low	26.7	Very low	101 Å²	101	143.6 Å²	143.6	84%	0.835	80%	0.8	S	S	*	*			trans	52.7	117.8	157.1	0	0	0	0	0	120.5
127	H	24.6	Very low	26.6	Very low	160 Å²	160	142.2 Å²	142.2	74%	0.741	80%	0.797	S	S	*	*			trans	-63.2	154.9	156.6	-92.3	-82.5	0	0	0	112.1	V129	H127-V129 HydrophobicContact CB-CG2 4.2Å; H127-V129 WeakPolarHBondContact ND1-CG2 3.38Å
128	P	26.1	Very low	26.4	Very low	121 Å²	121	140.8 Å²	140.8	79%	0.786	79%	0.794	S	S	*	*				-114	176.2	107.1	-9.3	28.4	0	0	0	114
129	V	26.6	Very low	26.4	Very low	109 Å²	109	145.5 Å²	145.5	66%	0.661	79%	0.794	S	S	*	*			trans	-151.7	147.9	-169.6	168.2	0	0	0	0	108.1	H127	H127-V129 HydrophobicContact CB-CG2 4.2Å; H127-V129 WeakPolarHBondContact ND1-CG2 3.38Å
130	D	26.8	Very low	26.3	Very low	131 Å²	131	144.6 Å²	144.6	70%	0.701	79%	0.79	S	S	*	*			cis	-170.6	154.5	-31.9	-89.2	-38.9	0	0	0	106.6
131	T	27.5	Very low	26.3	Very low	146 Å²	146	146.4 Å²	146.4	90%	0.896	79%	0.788	S	S	*	*			trans	-150.7	137.8	172.6	45.1	0	0	0	0	115.4
132	D	26.4	Very low	26.2	Very low	158 Å²	158	141 Å²	141	85%	0.845	78%	0.779	S	S	*	*			trans	-74	157.5	170.4	-65.1	-75	0	0	0	114.8
133	E	27.8	Very low	26.1	Very low	179 Å²	179	140 Å²	140	84%	0.836	78%	0.776	S	S	*	*				-175.5	149	106.8	-105.3	-167.2	140.3	0	0	115.3
134	C	25.5	Very low	26.1	Very low	89 Å²	89	140.6 Å²	140.6	60%	0.601	78%	0.775	S	S	*	*			trans	50	107.2	150.5	-70.5	0	0	0	0	124.8
135	Q	24.2	Very low	26.1	Very low	162 Å²	162	137.9 Å²	137.9	76%	0.757	77%	0.772	S	S	*	*				59.5	117.8	115.6	-70.8	169.1	-84.7	0	0	124.2
136	E	25.2	Very low	26.2	Very low	185 Å²	185	137.6 Å²	137.6	86%	0.864	77%	0.769	S	S	*	*				76.5	154.9	128	-157.9	162.4	-145.9	0	0	121.1
137	A	25.8	Very low	26.8	Very low	83 Å²	83	138 Å²	138	69%	0.686	76%	0.763	S	S	*	*			trans	73	93.6	169.9	0	0	0	0	0	120.6
138	V	26.4	Very low	26.8	Very low	125 Å²	125	139 Å²	139	76%	0.758	77%	0.768	S	S	*	*				35.9	125.5	110.8	-175.1	0	0	0	0	120.1
139	E	29	Very low	26.8	Very low	180 Å²	180	137.5 Å²	137.5	84%	0.841	77%	0.766	S	S	*	*			trans	84.7	144	151.4	-81.4	166.1	-170.1	0	0	124.2
140	E	25.6	Very low	26.7	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	78%	0.776	S	S	*	*			trans	71.1	99.5	153.3	-111.9	177.7	165.4	0	0	125.8
141	W	28.2	Very low	26.6	Very low	222 Å²	222	140 Å²	140	84%	0.841	78%	0.777	S	S	*	*			trans	46.2	146.1	133.8	-68.7	69.3	0	0	0	124.4
142	T	26.5	Very low	26.5	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	78%	0.776	S	S	*	*			trans	76.3	99.1	151.9	41.4	0	0	0	0	123.2
143	D	25	Very low	26.5	Very low	144 Å²	144	138.2 Å²	138.2	77%	0.77	77%	0.773	S	S	*	*				78.1	121.8	114.1	-121.8	-36.2	0	0	0	124.4
144	S	26.3	Very low	26.6	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	77%	0.771	S	S	*	*			trans	86	134.6	136.9	-83.9	0	0	0	0	125.1
145	V	26.1	Very low	26.7	Very low	146 Å²	146	138.4 Å²	138.4	89%	0.885	78%	0.782	S	S	*	*			trans	78.7	131.7	162.7	-154.1	0	0	0	0	119.8
146	G	24.6	Very low	26.8	Very low	64 Å²	64	136.9 Å²	136.9	66%	0.66	78%	0.779	S	S	*	*			trans	-105.1	-142.8	171.2	0	0	0	0	0	113.4
147	P	38.9	Very low	27.1	Very low	109 Å²	109	132.4 Å²	132.4	71%	0.708	77%	0.768	S	S	*	*			cis	-140.5	-178.3	-0.8	44.6	-26.9	0	0	0	116.8
148	H	23.6	Very low	27.1	Very low	183 Å²	183	136.5 Å²	136.5	85%	0.847	77%	0.773	S	S	*	*			trans	55.8	124.7	155.1	-65.3	-58.8	0	0	0	122.9
149	A	26.1	Very low	27.2	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	77%	0.765	S	S	*	*				154.3	129.7	103.2	0	0	0	0	0	117.2
150	H	24.6	Very low	27.2	Very low	191 Å²	191	137.3 Å²	137.3	88%	0.884	76%	0.761	S	S	*	*			trans	20.7	131.2	150.6	-60.8	-82.2	0	0	0	124
151	S	25	Very low	28	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	76%	0.757	S	S	*	*				156.1	130.8	98.5	-174.3	0	0	0	0	116.9
152	H	26.7	Very low	27.8	Very low	192 Å²	192	130.1 Å²	130.1	89%	0.889	75%	0.751	S	S	*	*			trans	9	143.9	154.7	-62.3	-89.8	0	0	0	123.6
153	G	26.1	Very low	27.8	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	76%	0.756	S	S	*	*			trans	-142.8	-52.7	177.4	0	0	0	0	0	123.3
154	A	29.5	Very low	27.9	Very low	97 Å²	97	132 Å²	132	80%	0.802	76%	0.759	S	S	*	*			trans	70.2	132.7	174.3	0	0	0	0	0	123
155	E	28.2	Very low	28.2	Very low	176 Å²	176	135 Å²	135	82%	0.822	77%	0.767	S	S	*	*			trans	87.6	129.2	138	-78.2	178.9	-170.1	0	0	126.3
156	N	26.3	Very low	28.7	Very low	130 Å²	130	134.2 Å²	134.2	70%	0.695	77%	0.765	S	S	*	*			trans	90.6	91.5	142.9	-79.7	-39.5	0	0	0	125
157	S	30.3	Very low	29.1	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	77%	0.771	S	S	*	*				68.6	137	101.3	-57.2	0	0	0	0	124
158	Q	26.7	Very low	29.1	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	77%	0.773	S	S	*	*			trans	76.6	145.4	152.2	-71.4	-178.3	-79.4	0	0	120.2
159	E	26.9	Very low	29.3	Very low	127 Å²	127	138.4 Å²	138.4	59%	0.593	77%	0.772	S	S	*	*			cis	-171.5	150.8	-22.1	-127	174.7	161.1	0	0	111.8
160	Y	29.9	Very low	29.4	Very low	194 Å²	194	142.3 Å²	142.3	76%	0.761	78%	0.78	S	S	*	*			trans	68.3	168.4	156.1	-71.3	-55.4	0	0	0	119.8
161	P	41.7	Very low	29.5	Very low	108 Å²	108	140.3 Å²	140.3	70%	0.701	78%	0.776	S	S	*	*				-146.4	-171.1	-82.9	40.7	-18	0	0	0	118.1
162	D	25.4	Very low	30.5	Very low	131 Å²	131	140.1 Å²	140.1	70%	0.701	77%	0.772	S	S	*	*			trans	80.1	139.5	143.3	-161.5	24.4	0	0	0	120.7
163	S	26.1	Very low	30.5	Very low	119 Å²	119	136 Å²	136	83%	0.832	77%	0.765	S	S	*	*			trans	-172.7	132.8	165.7	-82.1	0	0	0	0	112.6
164	H	26.8	Very low	30.6	Very low	180 Å²	180	136.9 Å²	136.9	83%	0.833	77%	0.765	S	S	*	*			trans	-100.1	160.7	178	-99	-104.8	0	0	0	113.4
165	L	33.2	Very low	30.4	Very low	165 Å²	165	139.9 Å²	139.9	86%	0.864	77%	0.767	S	S	*	*			trans	-71.4	162.2	170.7	-58.6	171.9	0	0	0	112.9
166	P	36.1	Very low	30.2	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	77%	0.765	S	S	*	*				-150.3	-177.2	104.7	39	-21.3	0	0	0	116.9
167	I	32.5	Very low	30.2	Very low	154 Å²	154	140.1 Å²	140.1	79%	0.79	77%	0.773	S	S	*	*			trans	-104.3	161.1	-177.8	-28.4	176.5	0	0	0	111
168	P	39.3	Very low	29.9	Very low	116 Å²	116	143.4 Å²	143.4	75%	0.753	78%	0.778	S	S	*	*				-152.7	-160.6	108.8	38.9	-20.1	0	0	0	114
169	E	28.8	Very low	29.9	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	77%	0.77	S	S	*	*				-159.6	166.1	-76.6	-98.8	-177.9	145.3	0	0	110.1
170	D	27.4	Very low	29.9	Very low	169 Å²	169	141.2 Å²	141.2	90%	0.904	77%	0.771	S	S	*	*			trans	74.8	161.9	161.4	-78.6	-35	0	0	0	124.7
171	D	26.3	Very low	29.8	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	77%	0.773	S	S	*	*			trans	-139.5	-143.5	-164.3	-162.7	31.6	0	0	0	109.4
172	P	46.3	Very low	29.2	Very low	98 Å²	98	143.2 Å²	143.2	64%	0.636	78%	0.779	S	S	*	*			cis	-142.2	-177.5	-15.6	45	-25.4	0	0	0	119.1
173	S	27.3	Very low	29.2	Very low	106 Å²	106	144 Å²	144	74%	0.741	78%	0.783	S	S	*	*			trans	91.1	114	145.1	-64.2	0	0	0	0	124.7
174	A	26.8	Very low	29.3	Very low	93 Å²	93	140.9 Å²	140.9	77%	0.769	77%	0.769	S	S	*	*				84.9	135.9	116.2	0	0	0	0	0	126
175	L	26.3	Very low	29.4	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	77%	0.769	S	S	*	*			trans	92	149.3	147.3	-75.4	170	0	0	0	124.3
176	E	24.4	Very low	29	Very low	169 Å²	169	143.1 Å²	143.1	79%	0.79	77%	0.768	S	S	*	*			trans	-75.6	166.2	-158.6	-56	160.2	134.7	0	0	118.3
177	V	25.7	Very low	28.6	Very low	143 Å²	143	141.1 Å²	141.1	87%	0.867	76%	0.756	S	S	*	*				178.2	162.5	117.9	150	0	0	0	0	112.7
178	H	24.3	Very low	29	Very low	160 Å²	160	139.5 Å²	139.5	74%	0.741	76%	0.755	S	S	*	*			trans	-54.7	175.4	176.8	-84	24.9	0	0	0	116.8
179	D	25.5	Very low	28.3	Very low	114 Å²	114	140.9 Å²	140.9	61%	0.61	76%	0.756	S	S	*	*			cis	-163.7	170.5	29.5	-135.2	-44.4	0	0	0	115.6
180	Q	27.5	Very low	28.3	Very low	135 Å²	135	139.2 Å²	139.2	63%	0.631	75%	0.746	S	S	*	*			trans	53.9	116.5	155	-81.6	141.2	58.5	0	0	122
181	E	27.4	Very low	28.3	Very low	171 Å²	171	138.3 Å²	138.3	80%	0.799	74%	0.737	S	S	*	*				98.5	149.1	87	-81.9	175.8	-174.3	0	0	113
182	E	29.7	Very low	28.2	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	74%	0.736	S	S	*	*			cis	-150	167	11.4	-154.6	-177.2	-174.5	0	0	112.5
183	D	25.9	Very low	27.4	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	74%	0.742	S	S	*	*			trans	67.6	133	158.1	-145.2	38.1	0	0	0	120.8
184	G	28.1	Very low	27.3	Very low	53 Å²	53	144.4 Å²	144.4	55%	0.546	74%	0.738	S	S	.	*			cis	-174.8	158.9	-2.3	0	0	0	0	0	115
185	H	29.6	Very low	27.3	Very low	178 Å²	178	145.8 Å²	145.8	82%	0.824	73%	0.732	S	S	*	*			trans	59.8	109.2	171.9	-52.6	-66.3	0	0	0	117.6
186	Y	24.5	Very low	27.3	Very low	213 Å²	213	148.5 Å²	148.5	84%	0.835	73%	0.733	S	S	*	*			cis	71.3	125.8	25.2	-131.7	-108.3	0	0	0	113.5
187	C	27.1	Very low	27.7	Very low	86 Å²	86	150.8 Å²	150.8	58%	0.581	74%	0.736	S	S	*	*			cis	-178.2	-154.7	-5.6	-126.6	0	0	0	0	109.3
188	P	40.8	Very low	28.5	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	73%	0.732	S	S	*	*			cis	-125.6	-159.3	-45	37.8	-20.8	0	0	0	112
189	N	24.8	Very low	28.9	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	73%	0.73	S	S	*	*			trans	-122.3	172	-177.6	-162.8	-5.4	0	0	0	111.7
190	K	29.2	Very low	29.2	Very low	140 Å²	140	150 Å²	150	61%	0.609	74%	0.738	S	S	*	*			trans	80	134.6	155.4	-79.4	167.1	156.5	-86.1	0	123.5
191	E	27.7	Very low	29.4	Very low	149 Å²	149	147.1 Å²	147.1	70%	0.696	74%	0.737	S	S	*	*			trans	62.7	126.4	136.1	-68.9	149.2	-173.1	0	0	119.3
192	N	24.1	Very low	29.6	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	74%	0.743	S	S	*	*				-165.9	-177.3	65.1	-146.5	-12	0	0	0	115.8
193	Y	28.5	Very low	29.6	Very low	194 Å²	194	142.1 Å²	142.1	76%	0.761	74%	0.738	S	S	*	*			trans	-27.8	125.6	177.1	-98.1	-120.2	0	0	0	121.9
194	Q	26.1	Very low	29.9	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.654	74%	0.739	S	S	*	*				74.6	142.9	111.4	-171.4	162.9	-10.1	0	0	124
195	D	25.5	Very low	29.9	Very low	122 Å²	122	145.7 Å²	145.7	65%	0.652	75%	0.749	S	S	*	*			trans	103.7	131.7	151.5	-87.3	-4	0	0	0	123
196	Y	27.8	Very low	29.8	Very low	217 Å²	217	141.1 Å²	141.1	85%	0.851	75%	0.75	S	S	*	*			trans	62.8	127.7	158.4	-88	-98.2	0	0	0	123.9
197	Y	32.7	Very low	29.9	Very low	216 Å²	216	135 Å²	135	85%	0.847	75%	0.751	S	S	*	*			trans	-80.7	158	165.9	-104.3	-83.6	0	0	0	112.1
198	P	42.7	Very low	29.9	Very low	122 Å²	122	135.7 Å²	135.7	79%	0.792	76%	0.764	S	S	*	*				-143	178.8	102.9	38.5	-23.6	0	0	0	116.1
199	T	32.3	Very low	29.3	Very low	114 Å²	114	135.6 Å²	135.6	70%	0.699	77%	0.766	S	S	*	*			trans	-90.2	170.6	-168.6	-31.8	0	0	0	0	114.5
200	E	31.2	Very low	30.8	Very low	164 Å²	164	133.2 Å²	133.2	77%	0.766	76%	0.758	S	S	*	*				148	120.7	127.1	-75.7	-52.5	123.3	0	0	116.9
201	A	32.3	Very low	30.7	Very low	75 Å²	75	137.3 Å²	137.3	62%	0.62	77%	0.772	S	S	*	*			trans	58.3	137.5	138.9	0	0	0	0	0	126.7
202	N	31.9	Very low	30.8	Very low	172 Å²	172	140.8 Å²	140.8	92%	0.92	78%	0.778	S	S	*	*			trans	66.1	149.2	151.9	-68.3	-31.6	0	0	0	121.4
203	G	29.8	Very low	30.9	Very low	68 Å²	68	141 Å²	141	70%	0.701	78%	0.776	S	S	*	*			cis	158.2	145	-14.8	0	0	0	0	0	117.6
204	N	31.4	Very low	30.9	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	78%	0.776	S	S	*	*			trans	87.2	148.8	147.6	-150.4	12.6	0	0	0	123.6
205	T	28.7	Very low	31	Very low	125 Å²	125	145.6 Å²	145.6	77%	0.767	79%	0.786	S	S	*	*			trans	61.5	147	166.4	52.7	0	0	0	0	121.1
206	G	27.6	Very low	31	Very low	82 Å²	82	143 Å²	143	85%	0.845	79%	0.788	S	S	*	*			cis	130	113.8	-12.1	0	0	0	0	0	116.1
207	G	25	Very low	31	Very low	83 Å²	83	141 Å²	141	86%	0.856	79%	0.792	S	S	*	*			trans	174.3	153.6	173.8	0	0	0	0	0	114.2
208	A	27.8	Very low	30.9	Very low	102 Å²	102	133.8 Å²	133.8	84%	0.843	78%	0.783	S	S	*	*			trans	-156.7	162.1	-164	0	0	0	0	0	118.9
209	S	28.2	Very low	30.3	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	79%	0.786	S	S	*	*			trans	72.4	173.8	152	-124.7	0	0	0	0	118.7
210	P	56.7	Low	30.3	Very low	96 Å²	96	138.7 Å²	138.7	62%	0.623	80%	0.797	S	S	*	*			cis	-136.5	176.4	-8.4	41.6	-25.2	0	0	0	116.5
211	Y	26.8	Very low	30.5	Very low	227 Å²	227	139.4 Å²	139.4	89%	0.89	80%	0.801	S	S	*	*				-177	171.2	121.3	-108.2	-78.7	0	0	0	114.7
212	R	28.8	Very low	30.6	Very low	221 Å²	221	143.3 Å²	143.3	83%	0.834	81%	0.811	S	S	*	*			trans	-98.1	168	-160.7	-102.5	-173.3	175.6	170	-1.7	114.5
213	M	26.8	Very low	30.7	Very low	151 Å²	151	141.8 Å²	141.8	74%	0.744	80%	0.799	S	S	*	*			cis	-172.3	162.9	-9.1	-163.4	-160.4	177.5	0	0	111.3
214	R	28.8	Very low	31.5	Very low	203 Å²	203	147.8 Å²	147.8	77%	0.766	81%	0.808	S	S	*	*			trans	102.8	111.5	131.4	-157.4	-173.1	-157	-163	6.5	120.8
215	R	27.8	Very low	32	Very low	229 Å²	229	147.3 Å²	147.3	86%	0.864	80%	0.801	S	S	*	*				158.3	134.2	109.3	-173.1	-169.7	-56.3	-117.7	8.6	112.2
216	G	25.6	Very low	32.9	Very low	67 Å²	67	146.1 Å²	146.1	69%	0.691	79%	0.79	S	S	*	*			trans	136.2	117.2	161.7	0	0	0	0	0	114.2
217	D	28.5	Very low	34	Very low	176 Å²	176	148.8 Å²	148.8	94%	0.941	78%	0.784	S	S	*	*			trans	-75	165.2	177.3	-36.5	-65.1	0	0	0	111.4
218	G	29.2	Very low	35.1	Very low	63 Å²	63	151.4 Å²	151.4	65%	0.649	78%	0.778	S	S	*	*			cis	175.4	149	-3.5	0	0	0	0	0	112.8
219	D	30.3	Very low	36.2	Very low	158 Å²	158	151 Å²	151	85%	0.845	76%	0.759	S	S	*	*			trans	40.7	107.5	155	-47.1	-13.2	0	0	0	121.5
220	L	33.7	Very low	37.4	Very low	181 Å²	181	150.2 Å²	150.2	95%	0.948	74%	0.744	S	S	*	*			trans	-141.3	107.9	131.9	-81.2	-176.8	0	0	0	108.3
221	E	34.6	Very low	37.3	Very low	179 Å²	179	149.6 Å²	149.6	84%	0.836	74%	0.738	S	S	*	*			trans	-97.6	178.8	160.9	-65.7	-174.4	142.1	0	0	108.9
222	D	34.7	Very low	38.6	Very low	157 Å²	157	140.2 Å²	140.2	84%	0.84	71%	0.708	S	S	*	*			trans	98.5	134.6	-172.6	-60.6	-19.9	0	0	0	114.4
223	Q	34.6	Very low	39.7	Very low	141 Å²	141	135.4 Å²	135.4	66%	0.659	70%	0.695	S	S	*	*			cis	-157.3	137.9	-24.4	176.4	65.7	3	0	0	106.4	E225	Q223-E225 HydrophobicContact CG-CB 4.45Å; Q223-E225 PolarHBondContact NE2-OE1 3.39Å; Q223-E225 PolarHBondContact O-N 3.36Å
224	E	45.3	Very low	40.8	Very low	193 Å²	193	133.2 Å²	133.2	90%	0.902	69%	0.685	S	S	*	*			trans	-92.4	83.5	-178.5	-171.9	175.7	-158	0	0	111.5
225	E	42.5	Very low	41.5	Very low	142 Å²	142	131 Å²	131	66%	0.664	68%	0.681	S	S	*	*			trans	-143.7	179.4	179.2	-103	157.9	-101.7	0	0	112.1	Q223	Q223-E225 HydrophobicContact CG-CB 4.45Å; Q223-E225 PolarHBondContact NE2-OE1 3.39Å; Q223-E225 PolarHBondContact O-N 3.36Å
226	D	47.7	Very low	42.2	Very low	101 Å²	101	126.7 Å²	126.7	54%	0.54	67%	0.673	S	S	.	*			trans	74.2	16.8	170.4	-79.2	8.7	0	0	0	121.3	Q229 I230	D226-Q229 HydrophobicContact CB-CB 3.73Å; D226-Q229 HydrophobicContact CB-CG 4.44Å; D226-Q229 PolarHBondContact O-N 2.77Å; D226-Q229 WeakPolarHBondContact OD1-CB 3.34Å; D226-I230 PolarHBondContact O-N 3.45Å
227	I	51.7	Low	42.9	Very low	138 Å²	138	128.3 Å²	128.3	71%	0.708	67%	0.673	S	S	*	*	H	α-helix	trans	-63.9	-43.5	159.9	-65.2	179.4	0	0	0	110.9	Q229 I230 V231	I227-Q229 VanDerWaalsContact C-N 3.27Å; I227-Q229 PolarHBondContact O-N 3.27Å; I227-I230 PolarHBondContact O-N 3.45Å; I227-V231 PolarHBondContact O-N 2.87Å
228	D	47.6	Very low	43.4	Very low	137 Å²	137	127.1 Å²	127.1	73%	0.733	67%	0.666	S	S	*	*	H	α-helix	trans	-67.5	-27	177.6	-75.7	-53.6	0	0	0	112.8	V231 A232	D228-V231 PolarHBondContact O-N 3.31Å; D228-A232 WeakPolarHBondContact O-CB 3.26Å; D228-A232 PolarHBondContact O-N 2.99Å
229	Q	49.7	Very low	43.7	Very low	95 Å²	95	128.3 Å²	128.3	44%	0.444	67%	0.665	S	S	.	*	H	α-helix	trans	-69.1	-39.5	176.4	-176.8	63.4	8.3	0	0	111.8	D226 I227 V231 A232 E233	D226-Q229 HydrophobicContact CB-CB 3.73Å; D226-Q229 HydrophobicContact CB-CG 4.44Å; D226-Q229 PolarHBondContact O-N 2.77Å; D226-Q229 WeakPolarHBondContact OD1-CB 3.34Å; I227-Q229 VanDerWaalsContact C-N 3.27Å; I227-Q229 PolarHBondContact O-N 3.27Å; Q229-V231 VanDerWaalsContact C-N 3.32Å; Q229-V231 PolarHBondContact O-N 3.31Å; Q229-A232 WeakPolarHBondContact O-CB 3.4Å; Q229-A232 PolarHBondContact O-N 3.26Å; Q229-A232 VanDerWaalsContact O-N 3.15Å; Q229-E233 PolarHBondContact O-N 2.93Å
230	I	54.5	Low	43.8	Very low	100 Å²	100	127.1 Å²	127.1	51%	0.513	66%	0.656	S	S	.	*	H	α-helix	trans	-63.3	-39.9	172.8	-64.8	167.3	0	0	0	110.6	D226 I227 A232 E233 I234	D226-I230 PolarHBondContact O-N 3.45Å; I227-I230 PolarHBondContact O-N 3.45Å; I230-A232 VanDerWaalsContact C-N 3.31Å; I230-A232 PolarHBondContact O-N 3.13Å; I230-E233 PolarHBondContact O-N 2.76Å; I230-I234 HydrophobicContact CG2-CD1 4.01Å; I230-I234 WeakPolarHBondContact O-CG1 3.21Å; I230-I234 PolarHBondContact O-N 2.96Å; I230-I234 VanDerWaalsContact O-N 3.13Å
231	V	55.1	Low	43.8	Very low	82 Å²	82	125.1 Å²	125.1	50%	0.497	65%	0.651	S	S	.	*	H	α-helix	trans	-65.8	-35.3	174.5	177.4	0	0	0	0	111.2	I227 D228 Q229 K235	I227-V231 PolarHBondContact O-N 2.87Å; D228-V231 PolarHBondContact O-N 3.31Å; Q229-V231 VanDerWaalsContact C-N 3.32Å; Q229-V231 PolarHBondContact O-N 3.31Å; V231-K235 VanDerWaalsContact O-CB 3.25Å; V231-K235 WeakPolarHBondContact O-CB 3.32Å; V231-K235 PolarHBondContact O-N 3.44Å
232	A	52.4	Low	43.8	Very low	31 Å²	31	121.6 Å²	121.6	26%	0.256	65%	0.646	S	S	.	*	H	α-helix	trans	-67.3	-46.2	174.1	0	0	0	0	0	112.5	D228 Q229 I230 I234 K235 M236	D228-A232 WeakPolarHBondContact O-CB 3.26Å; D228-A232 PolarHBondContact O-N 2.99Å; Q229-A232 WeakPolarHBondContact O-CB 3.4Å; Q229-A232 PolarHBondContact O-N 3.26Å; Q229-A232 VanDerWaalsContact O-N 3.15Å; I230-A232 VanDerWaalsContact C-N 3.31Å; I230-A232 PolarHBondContact O-N 3.13Å; A232-I234 PolarHBondContact O-N 3.13Å; A232-K235 PolarHBondContact O-N 2.84Å; A232-K235 VanDerWaalsContact O-N 3.16Å; A232-M236 WeakPolarHBondContact O-CG 3.33Å; A232-M236 PolarHBondContact O-N 3.12Å
233	E	52.9	Low	43.7	Very low	119 Å²	119	121.2 Å²	121.2	56%	0.556	64%	0.642	S	S	*	*	H	α-helix	trans	-59.5	-45.6	177.4	-76.4	-164.2	127.9	0	0	112.3	Q229 I230 K235 M236 S237	Q229-E233 PolarHBondContact O-N 2.93Å; I230-E233 PolarHBondContact O-N 2.76Å; E233-K235 VanDerWaalsContact C-N 3.26Å; E233-K235 PolarHBondContact O-N 3.31Å; E233-M236 PolarHBondContact O-N 2.82Å; E233-S237 WeakPolarHBondContact O-CB 3.28Å; E233-S237 PolarHBondContact O-N 3.02Å; E233-S237 PolarHBondContact O-OG 2.97Å
234	I	50.3	Low	43.4	Very low	105 Å²	105	120.3 Å²	120.3	54%	0.538	65%	0.647	S	S	.	*	H	α-helix	trans	-62.3	-37.4	177.4	-67	168.4	0	0	0	110.6	I230 A232	I230-I234 HydrophobicContact CG2-CD1 4.01Å; I230-I234 WeakPolarHBondContact O-CG1 3.21Å; I230-I234 PolarHBondContact O-N 2.96Å; I230-I234 VanDerWaalsContact O-N 3.13Å; A232-I234 PolarHBondContact O-N 3.13Å
235	K	43.7	Very low	43	Very low	158 Å²	158	116.2 Å²	116.2	69%	0.687	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-31.2	179.9	-163.2	171.6	-175.1	177.7	0	113.2	V231 A232 E233 S239	V231-K235 VanDerWaalsContact O-CB 3.25Å; V231-K235 WeakPolarHBondContact O-CB 3.32Å; V231-K235 PolarHBondContact O-N 3.44Å; A232-K235 PolarHBondContact O-N 2.84Å; A232-K235 VanDerWaalsContact O-N 3.16Å; E233-K235 VanDerWaalsContact C-N 3.26Å; E233-K235 PolarHBondContact O-N 3.31Å; K235-S239 PolarHBondContact O-OG 2.84Å
236	M	41.6	Very low	42.5	Very low	138 Å²	138	113.7 Å²	113.7	68%	0.68	64%	0.643	S	S	*	*	H	α-helix	trans	-73.7	-36.6	171.3	-70.6	-173.8	-176.2	0	0	112.1	A232 E233 L238 S239	A232-M236 WeakPolarHBondContact O-CG 3.33Å; A232-M236 PolarHBondContact O-N 3.12Å; E233-M236 PolarHBondContact O-N 2.82Å; M236-L238 PolarHBondContact O-N 2.93Å; M236-L238 VanDerWaalsContact O-N 3.1Å; M236-S239 PolarHBondContact O-N 3.22Å
237	S	40.6	Very low	41.8	Very low	101 Å²	101	113.4 Å²	113.4	71%	0.706	65%	0.649	S	S	*	*	H	α-helix	trans	-58.8	-22.8	179	-62	0	0	0	0	114.1	E233	E233-S237 WeakPolarHBondContact O-CB 3.28Å; E233-S237 PolarHBondContact O-N 3.02Å; E233-S237 PolarHBondContact O-OG 2.97Å
238	L	37.9	Very low	40.7	Very low	151 Å²	151	115.8 Å²	115.8	79%	0.791	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	4.3	176.5	-73.2	166	0	0	0	114.3	M236	M236-L238 PolarHBondContact O-N 2.93Å; M236-L238 VanDerWaalsContact O-N 3.1Å
239	S	36	Very low	39.8	Very low	88 Å²	88	113.2 Å²	113.2	62%	0.615	66%	0.655	S	S	*	*	S	Bend	trans	-120.7	8.7	-171.5	-58.2	0	0	0	0	115.4	K235 M236	K235-S239 PolarHBondContact O-OG 2.84Å; M236-S239 PolarHBondContact O-N 3.22Å
240	M	33.1	Very low	38.8	Very low	133 Å²	133	114.3 Å²	114.3	66%	0.655	67%	0.673	S	S	*	*			trans	-127.1	55.1	-174.9	-78.1	-88.6	70.3	0	0	115.1	I243	M240-I243 HydrophobicContact CE-CD1 4.42Å; M240-I243 HydrophobicContact CE-CG1 4.08Å
241	T	33.6	Very low	38.5	Very low	139 Å²	139	114.3 Å²	114.3	85%	0.853	68%	0.679	S	S	*	*	S	Bend	trans	-134.2	46	160.6	60	0	0	0	0	112.8
242	S	33.8	Very low	37.3	Very low	105 Å²	105	118.4 Å²	118.4	73%	0.734	69%	0.693	S	S	*	*			trans	-172	101.7	165.1	-83.5	0	0	0	0	113.2
243	I	33.5	Very low	36	Very low	148 Å²	148	124.9 Å²	124.9	76%	0.759	72%	0.718	S	S	*	*			trans	179	154.3	145.1	38.9	178.6	0	0	0	109.3	M240	M240-I243 HydrophobicContact CE-CD1 4.42Å; M240-I243 HydrophobicContact CE-CG1 4.08Å
244	T	28.4	Very low	34.6	Very low	123 Å²	123	126.9 Å²	126.9	76%	0.755	73%	0.729	S	S	*	*			cis	-123.9	-89.6	32.2	53.8	0	0	0	0	118.5
245	S	37.5	Very low	34.4	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	73%	0.732	S	S	*	*			trans	-160.9	175.4	-144.3	59.9	0	0	0	0	111.4
246	A	31.7	Very low	33.5	Very low	90 Å²	90	126.5 Å²	126.5	74%	0.744	74%	0.736	S	S	*	*			cis	-151.4	-174.9	17.8	0	0	0	0	0	109.6
247	S	31.5	Very low	32.7	Very low	95 Å²	95	126.5 Å²	126.5	66%	0.664	74%	0.738	S	S	*	*			cis	-161.3	155.9	15.5	50	0	0	0	0	112.4
248	E	29.6	Very low	31.9	Very low	187 Å²	187	128.4 Å²	128.4	87%	0.874	74%	0.74	S	S	*	*			trans	60.1	158.7	157.1	-65.3	175.5	131.3	0	0	120.7
249	A	29.5	Very low	32.3	Very low	83 Å²	83	127.2 Å²	127.2	69%	0.686	74%	0.741	S	S	*	*			cis	-170.7	122.2	-41.4	0	0	0	0	0	111.9
250	S	27.6	Very low	31.8	Very low	119 Å²	119	127 Å²	127	83%	0.832	75%	0.752	S	S	*	*			trans	66.3	163.8	149.3	-77.4	0	0	0	0	122
251	P	49.2	Very low	31.4	Very low	99 Å²	99	128.1 Å²	128.1	64%	0.643	76%	0.761	S	S	*	*			cis	-135.6	162.9	-19.1	34.1	-15.8	0	0	0	116.6
252	E	28.7	Very low	31.1	Very low	169 Å²	169	126.7 Å²	126.7	79%	0.79	76%	0.757	S	S	*	*			trans	63.6	154.4	145.5	-72.4	159.9	-140.2	0	0	120.2
253	H	25.8	Very low	30.8	Very low	167 Å²	167	127.6 Å²	127.6	77%	0.773	76%	0.758	S	S	*	*			cis	-146	176.1	18.1	-143.5	47.8	0	0	0	113
254	M	23.8	Very low	30.4	Very low	161 Å²	161	129.9 Å²	129.9	79%	0.793	77%	0.766	S	S	*	*			trans	-125.3	-173.4	-173.1	-88	-98.2	88.3	0	0	111.3
255	P	45.1	Very low	30.3	Very low	93 Å²	93	128.1 Å²	128.1	60%	0.604	76%	0.763	S	S	*	*			cis	-111.8	-118.4	-9.9	19.3	6.4	0	0	0	111.7
256	E	25.1	Very low	29.7	Very low	162 Å²	162	128.6 Å²	128.6	76%	0.757	77%	0.766	S	S	*	*			cis	-170.8	158.9	-5	-134.3	178.9	145.7	0	0	106
257	L	24.9	Very low	30.1	Very low	138 Å²	138	129.7 Å²	129.7	72%	0.723	77%	0.765	S	S	*	*			cis	-158.1	167.2	-7.9	-140.8	179.1	0	0	0	108.7
258	D	23.7	Very low	30.3	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	77%	0.766	S	S	*	*			trans	-82.7	-167.3	170.7	-70.3	-66.7	0	0	0	113.9
259	P	47.4	Very low	30	Very low	126 Å²	126	125.9 Å²	125.9	82%	0.818	76%	0.757	S	S	*	*				-129	-179.8	-59.1	36.9	-22.1	0	0	0	113
260	G	25.2	Very low	29.7	Very low	82 Å²	82	130.8 Å²	130.8	85%	0.845	77%	0.766	S	S	*	*			trans	179.3	144.3	163.5	0	0	0	0	0	115.8
261	D	24.1	Very low	29.6	Very low	157 Å²	157	131.3 Å²	131.3	84%	0.84	77%	0.769	S	S	*	*			trans	-126.2	127.1	173.6	174.4	28.3	0	0	0	110.5
262	S	27.7	Very low	28.4	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	78%	0.777	S	S	*	*			trans	-166.4	103.5	163.7	61.4	0	0	0	0	112
263	T	26.5	Very low	28.3	Very low	125 Å²	125	132 Å²	132	77%	0.767	78%	0.784	S	S	*	*			trans	-12.3	131.4	158.9	55.4	0	0	0	0	119.4
264	E	26.2	Very low	28.4	Very low	195 Å²	195	127.6 Å²	127.6	91%	0.911	78%	0.784	S	S	*	*				-159.8	154	112.7	-114.5	-169.8	115.1	0	0	113.9
265	A	24.9	Very low	29.1	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	78%	0.782	S	S	*	*			trans	-61.2	164.5	-173.3	0	0	0	0	0	114.7
266	C	25.8	Very low	28.2	Very low	117 Å²	117	127.1 Å²	127.1	79%	0.791	79%	0.786	S	S	*	*				176.1	172.8	56.4	-129.4	0	0	0	0	109.7
267	P	39.6	Very low	28.3	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	79%	0.788	S	S	*	*				-122.4	-139.4	-63.3	36.4	-15.3	0	0	0	111.1
268	P	35.3	Very low	28.5	Very low	107 Å²	107	131.4 Å²	131.4	70%	0.695	79%	0.793	S	S	*	*				-130.4	-175.6	-112.5	40.8	-21	0	0	0	117.1
269	S	24.2	Very low	28.6	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	80%	0.795	S	S	*	*			trans	57.7	116.3	152.3	56.7	0	0	0	0	119
270	E	23.7	Very low	27.5	Very low	186 Å²	186	130.7 Å²	130.7	87%	0.869	79%	0.788	S	S	*	*				96.3	147	55.9	-88.7	-159.6	115.5	0	0	115
271	S	24	Very low	27.7	Very low	129 Å²	129	136.3 Å²	136.3	90%	0.902	78%	0.784	S	S	*	*			trans	73.3	145.3	164.1	79.9	0	0	0	0	119.4
272	G	25.6	Very low	28.1	Very low	79 Å²	79	134.3 Å²	134.3	81%	0.814	78%	0.779	S	S	*	*			trans	156.9	85.5	173.4	0	0	0	0	0	115.4
273	H	25.9	Very low	28.1	Very low	203 Å²	203	137.2 Å²	137.2	94%	0.94	78%	0.778	S	S	*	*			trans	-95.3	127.9	175.9	-90.9	-69.6	0	0	0	113.5
274	G	27.3	Very low	28.1	Very low	75 Å²	75	136 Å²	136	77%	0.773	78%	0.775	S	S	*	*			trans	70.3	-167.9	160.8	0	0	0	0	0	116.7
275	P	39.8	Very low	28.2	Very low	115 Å²	115	134 Å²	134	75%	0.747	77%	0.77	S	S	*	*			cis	-140.7	178.5	-1.8	42.4	-25.1	0	0	0	116.8
276	N	26.1	Very low	28.1	Very low	129 Å²	129	137 Å²	137	69%	0.69	77%	0.774	S	S	*	*			trans	68.1	130.7	144.1	-95.5	-42	0	0	0	125.4
277	R	26.3	Very low	28.4	Very low	212 Å²	212	139.2 Å²	139.2	80%	0.8	78%	0.777	S	S	*	*			trans	42	134.4	130.8	-76.3	174.8	165.5	159.9	-4.3	123.4
278	H	28.8	Very low	28.2	Very low	178 Å²	178	139.5 Å²	139.5	82%	0.824	78%	0.778	S	S	*	*				-176.7	129.6	114.8	-96	-75.5	0	0	0	108.2
279	E	25.8	Very low	28.7	Very low	171 Å²	171	140.1 Å²	140.1	80%	0.799	78%	0.783	S	S	*	*				80.9	119.3	67.4	-85.5	-86.4	108	0	0	117
280	A	24.7	Very low	28.9	Very low	81 Å²	81	142.1 Å²	142.1	67%	0.669	78%	0.781	S	S	*	*			trans	67.1	93.2	143.6	0	0	0	0	0	125.1
281	R	29.2	Very low	29.1	Very low	201 Å²	201	137.6 Å²	137.6	76%	0.758	78%	0.776	S	S	*	*				54	117.6	111.8	-170.1	-173.9	-178.4	173.1	3.4	123.3
282	P	33.1	Very low	29.4	Very low	115 Å²	115	138.8 Å²	138.8	75%	0.747	77%	0.765	S	S	*	*			trans	-89.9	160.6	132.3	-7.8	27.6	0	0	0	112.2
283	K	26.5	Very low	29.5	Very low	169 Å²	169	143.5 Å²	143.5	74%	0.735	77%	0.765	S	S	*	*			cis	82.5	142.3	7.3	-50	171.1	-173.2	171.1	0	115.7
284	S	28.3	Very low	29.5	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	76%	0.758	S	S	*	*				172.7	154.1	-56.6	50.9	0	0	0	0	110.1
285	L	26.9	Very low	29.5	Very low	154 Å²	154	138.9 Å²	138.9	81%	0.806	76%	0.763	S	S	*	*			trans	82.6	151.8	178.5	-46.7	171.7	0	0	0	114.3
286	N	23.9	Very low	28.8	Very low	149 Å²	149	139 Å²	139	80%	0.797	76%	0.758	S	S	*	*			cis	-141.9	177.1	21.1	-96.4	-58.5	0	0	0	115.4
287	L	31.7	Very low	29.5	Very low	164 Å²	164	138.8 Å²	138.8	86%	0.859	76%	0.763	S	S	*	*			trans	-96.1	-159.7	177.1	-64.4	158.2	0	0	0	110.9
288	P	36.3	Very low	29.5	Very low	117 Å²	117	136 Å²	136	76%	0.76	76%	0.759	S	S	*	*			cis	-137.7	-148.5	-0.4	46.1	-25	0	0	0	112.8
289	P	44.7	Very low	29.4	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	77%	0.766	S	S	*	*			cis	-124.6	-161	-11	43.4	-25.2	0	0	0	113.1
290	E	28.9	Very low	29.4	Very low	137 Å²	137	134.7 Å²	134.7	64%	0.64	76%	0.761	S	S	*	*			cis	-119.9	-106.6	-0.3	-168.1	-165.3	71.2	0	0	112.8	K292	E290-K292 WeakPolarHBondContact OE1-CD 3.23Å; E290-K292 WeakPolarHBondContact OE1-CE 3.41Å; E290-K292 WeakPolarHBondContact OE1-CG 3.37Å; E290-K292 IonicContact OE1-NZ 2.69Å; E290-K292 PolarHBondContact OE1-NZ 3.07Å; E290-K292 IonicContact OE2-NZ 2.99Å; E290-K292 PolarHBondContact OE2-NZ 3.1Å
291	A	27.5	Very low	29.6	Very low	92 Å²	92	138.6 Å²	138.6	76%	0.76	77%	0.77	S	S	*	*			cis	-148.7	164	-1.2	0	0	0	0	0	113.5
292	K	29.9	Very low	29.4	Very low	153 Å²	153	137.8 Å²	137.8	67%	0.665	77%	0.772	S	S	*	*			trans	-81.2	153	-173.8	-75.4	158.2	-175.1	116.4	0	115.7	E290	E290-K292 WeakPolarHBondContact OE1-CD 3.23Å; E290-K292 WeakPolarHBondContact OE1-CE 3.41Å; E290-K292 WeakPolarHBondContact OE1-CG 3.37Å; E290-K292 IonicContact OE1-NZ 2.69Å; E290-K292 PolarHBondContact OE1-NZ 3.07Å; E290-K292 IonicContact OE2-NZ 2.99Å; E290-K292 PolarHBondContact OE2-NZ 3.1Å
293	H	28.2	Very low	29	Very low	178 Å²	178	138.2 Å²	138.2	82%	0.824	77%	0.772	S	S	*	*			cis	-170.2	161.8	-19.3	-143.1	-68.4	0	0	0	112.3
294	A	26.1	Very low	29	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	77%	0.774	S	S	*	*			trans	87	130.9	149.9	0	0	0	0	0	121.8
295	G	26.7	Very low	28.7	Very low	86 Å²	86	139.5 Å²	139.5	89%	0.887	78%	0.775	S	S	*	*			trans	147.8	77.1	167.2	0	0	0	0	0	116.5
296	D	25.2	Very low	28.6	Very low	119 Å²	119	143.5 Å²	143.5	64%	0.636	78%	0.779	S	S	*	*			trans	-123.5	148.6	172.3	-163.2	17.6	0	0	0	107.9	Q298	D296-Q298 PolarHBondContact OD1-N 3.47Å
297	P	40.3	Very low	28.7	Very low	123 Å²	123	142.6 Å²	142.6	80%	0.799	78%	0.78	S	S	*	*				-146.6	127.6	81.2	35.2	-14.9	0	0	0	117.4
298	Q	27.3	Very low	29.3	Very low	154 Å²	154	139.9 Å²	139.9	72%	0.72	77%	0.772	S	S	*	*			trans	-12.6	139	150.9	-48.6	-177.8	-1.5	0	0	120.7	D296	D296-Q298 PolarHBondContact OD1-N 3.47Å
299	R	26.8	Very low	28.7	Very low	255 Å²	255	141.7 Å²	141.7	96%	0.962	77%	0.77	S	S	*	*				179.4	153.6	119.3	-98	175.5	-170.8	-155.3	4.6	110.6
300	G	24.8	Very low	27.8	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	77%	0.768	S	S	*	*			cis	161	79.9	-6.1	0	0	0	0	0	115.6
301	L	28.6	Very low	27.6	Very low	163 Å²	163	146.9 Å²	146.9	85%	0.853	78%	0.775	S	S	*	*			trans	52.8	115.5	148.6	-71	164.2	0	0	0	121.4
302	K	26.1	Very low	28	Very low	184 Å²	184	148.8 Å²	148.8	80%	0.8	78%	0.78	S	S	*	*				155	130.1	115.1	-94.1	161.3	-178	176.2	0	117.9
303	T	23.9	Very low	27.6	Very low	123 Å²	123	151 Å²	151	76%	0.755	79%	0.789	S	S	*	*			trans	30.3	144.9	135.6	54.2	0	0	0	0	122.7
304	K	26.2	Very low	27.6	Very low	180 Å²	180	153.8 Å²	153.8	78%	0.783	79%	0.793	S	S	*	*			cis	179.3	163.4	-0.3	179.8	-174.8	-177.5	176.4	0	110.9
305	T	23.2	Very low	27.6	Very low	116 Å²	116	154.7 Å²	154.7	71%	0.712	79%	0.79	S	S	*	*			trans	78.5	115.9	154.7	8	0	0	0	0	122.4
306	R	24	Very low	27.4	Very low	237 Å²	237	158.3 Å²	158.3	89%	0.894	78%	0.784	S	S	*	*				169.3	162.5	106.4	-98.3	-175.3	174.4	178.1	-0.9	115.3
307	T	25.6	Very low	27.4	Very low	131 Å²	131	159.8 Å²	159.8	80%	0.804	79%	0.787	S	S	*	*			trans	-147.7	179.8	169.5	55.1	0	0	0	0	107.5
308	P	44.7	Very low	26.6	Very low	106 Å²	106	162.1 Å²	162.1	69%	0.688	79%	0.787	S	S	*	*			cis	-137	-146	6.6	42.1	-19	0	0	0	114.6
309	E	24.4	Very low	26.4	Very low	156 Å²	156	160.7 Å²	160.7	73%	0.729	79%	0.789	S	S	*	*			trans	74.5	148.1	174.5	-67.1	171.3	122.2	0	0	117.6
310	E	26.1	Very low	26.2	Very low	160 Å²	160	154.2 Å²	154.2	75%	0.748	78%	0.781	S	S	*	*			cis	-156.6	-170.9	-39	-141.4	-151.3	130.9	0	0	111.7
311	R	24.8	Very low	26.1	Very low	207 Å²	207	159.1 Å²	159.1	78%	0.781	79%	0.792	S	S	*	*			trans	-51.5	164.8	-174.6	-117.9	-174.1	-153.8	113.7	-5.7	118.3
312	P	35.4	Very low	25.8	Very low	132 Å²	132	154.8 Å²	154.8	86%	0.857	79%	0.787	S	S	*	*				-151.6	-151.2	85.5	43.1	-22.7	0	0	0	117.3
313	K	21	Very low	25.7	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.865	79%	0.787	S	S	*	*			trans	-114.5	174.2	-158.2	-124.3	-177.3	179.3	-172	0	114.2
314	W	28.6	Very low	25.8	Very low	237 Å²	237	155.5 Å²	155.5	90%	0.898	79%	0.789	S	S	*	*			trans	-62	164.7	175	-83.8	63.8	0	0	0	116.4
315	P	25.9	Very low	25.8	Very low	113 Å²	113	155.8 Å²	155.8	73%	0.734	79%	0.793	S	S	*	*				-135.2	169.3	128.7	39	-27.9	0	0	0	116.1
316	Q	21.9	Very low	26.3	Very low	162 Å²	162	155.2 Å²	155.2	76%	0.757	79%	0.791	S	S	*	*			trans	-72.9	-177	167.9	-84.9	156.7	-119.8	0	0	111.4
317	E	26.1	Very low	26.4	Very low	151 Å²	151	155 Å²	155	71%	0.706	79%	0.79	S	S	*	*			cis	-168.6	-173.8	27.4	-157.1	152.1	-118.5	0	0	113.8
318	Q	22.9	Very low	26.5	Very low	171 Å²	171	158.1 Å²	158.1	80%	0.799	79%	0.792	S	S	*	*			trans	89.2	140.4	160.1	-52.8	-171.4	0.2	0	0	118.5
319	V	22.5	Very low	25.7	Very low	124 Å²	124	161.5 Å²	161.5	75%	0.752	80%	0.799	S	S	*	*			cis	-155.4	154	-17	121.5	0	0	0	0	108.6
320	C	22.8	Very low	25.8	Very low	119 Å²	119	163.7 Å²	163.7	80%	0.804	81%	0.809	S	S	*	*			trans	-88.6	153.1	176.7	-58.8	0	0	0	0	113.6
321	N	23.2	Very low	25.7	Very low	170 Å²	170	166.9 Å²	166.9	91%	0.909	81%	0.814	S	S	*	*			trans	-149	152.9	151.2	-92.5	-35.7	0	0	0	107.4
322	G	23.1	Very low	25.9	Very low	73 Å²	73	161.1 Å²	161.1	75%	0.753	81%	0.806	S	S	*	*			trans	-151.2	-143.9	-174.6	0	0	0	0	0	113.1
323	L	24.3	Very low	25.5	Very low	152 Å²	152	161.2 Å²	161.2	80%	0.796	80%	0.799	S	S	*	*			trans	106.1	134.6	171.8	-162.6	64.3	0	0	0	116.8
324	E	24.8	Very low	26.1	Very low	170 Å²	170	159 Å²	159	79%	0.794	80%	0.796	S	S	*	*			trans	73.8	148.6	156.9	-83.9	158	-174.4	0	0	124.1
325	Q	25.6	Very low	26.1	Very low	186 Å²	186	154.9 Å²	154.9	87%	0.869	79%	0.792	S	S	*	*			trans	-102	-161.8	174.6	-52.3	-176	-7.3	0	0	108.5
326	P	35	Very low	26.1	Very low	103 Å²	103	153 Å²	153	67%	0.669	79%	0.793	S	S	*	*			cis	-140.9	174.9	-6.3	42.1	-23.1	0	0	0	117.8
327	R	24.9	Very low	27	Very low	233 Å²	233	151.3 Å²	151.3	88%	0.879	80%	0.796	S	S	*	*			trans	38.3	120.7	145.4	-73.3	177.6	166.2	150.1	-4.4	121.6
328	K	28.4	Very low	27.3	Very low	196 Å²	196	150.9 Å²	150.9	85%	0.852	80%	0.804	S	S	*	*				-177.2	132.1	120	-94.1	151.3	-174.6	178.7	0	107.5
329	Q	27.3	Very low	27.7	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	80%	0.804	S	S	*	*				65.1	90.7	53.4	-147.2	-176	23.8	0	0	113.7
330	Q	26.9	Very low	28	Very low	202 Å²	202	151.8 Å²	151.8	94%	0.944	81%	0.81	S	S	*	*				-162.2	169.4	125.2	-116.6	176.3	-100.9	0	0	113.1
331	R	24.3	Very low	28.6	Very low	226 Å²	226	153.2 Å²	153.2	85%	0.853	81%	0.81	S	S	*	*			trans	-111.9	172.9	-172.1	-161.7	-178.5	-167.3	168.2	3.7	109.8
332	S	29.2	Very low	29	Very low	86 Å²	86	151.9 Å²	151.9	60%	0.601	80%	0.803	S	S	*	*			trans	105.6	98.3	149.9	-71.1	0	0	0	0	121.5
333	D	27.3	Very low	29.5	Very low	134 Å²	134	155.4 Å²	155.4	72%	0.717	80%	0.803	S	S	*	*				81.6	148.4	111.9	-47.5	-31.2	0	0	0	123.5
334	L	32.5	Very low	30.2	Very low	152 Å²	152	153.1 Å²	153.1	80%	0.796	80%	0.797	S	S	*	*			trans	94.9	106.6	159.5	-55.5	178.8	0	0	0	121.1
335	N	30	Very low	30.9	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	80%	0.804	S	S	*	*			trans	51.5	123.9	133	-55.6	-7.8	0	0	0	121.8
336	G	25.5	Very low	31.2	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	80%	0.8	S	S	*	*			trans	-90.7	-152.4	157.2	0	0	0	0	0	112.5
337	P	41.3	Very low	31.3	Very low	126 Å²	126	156.8 Å²	156.8	82%	0.818	81%	0.811	S	S	*	*			cis	-124.4	171.1	-2	41.5	-28.6	0	0	0	113.9
338	T	30.6	Very low	31.5	Very low	141 Å²	141	155 Å²	155	87%	0.865	81%	0.81	S	S	*	*			trans	-157.3	135.6	158.7	-44.9	0	0	0	0	110.7
339	D	32	Very low	31.7	Very low	148 Å²	148	151.9 Å²	151.9	79%	0.791	81%	0.807	S	S	*	*			trans	-72.6	149.2	178.1	-55.8	-85.4	0	0	0	114
340	N	30	Very low	32	Very low	166 Å²	166	147.2 Å²	147.2	89%	0.888	80%	0.799	S	S	*	*			trans	-169.1	137.9	135.5	-104.9	-58.3	0	0	0	112.4
341	N	34.8	Very low	32.3	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	79%	0.785	S	S	*	*			trans	-90.9	131.6	176.1	-75.2	-55.4	0	0	0	111.8
342	N	31.9	Very low	32.8	Very low	141 Å²	141	136.4 Å²	136.4	75%	0.754	77%	0.767	S	S	*	*				172	147.3	118.7	-106.3	-60.5	0	0	0	116
343	I	33.2	Very low	33.4	Very low	147 Å²	147	136.5 Å²	136.5	75%	0.754	77%	0.765	S	S	*	*			trans	67.2	138.6	151.3	-60	157.2	0	0	0	117.6
344	P	38.8	Very low	34.3	Very low	104 Å²	104	135.4 Å²	135.4	68%	0.675	77%	0.768	S	S	*	*			cis	-122.7	-178.7	-26.4	36	-18.7	0	0	0	112.7	T346	P344-T346 PolarHBondContact O-N 2.88Å; P344-T346 VanDerWaalsContact O-N 3.14Å
345	E	39.8	Very low	35.2	Very low	202 Å²	202	130.6 Å²	130.6	94%	0.944	74%	0.741	S	S	*	*			trans	-65.9	108.3	171.4	-65	-175.6	113.7	0	0	112.8
346	T	31.6	Very low	36.3	Very low	128 Å²	128	126.1 Å²	126.1	79%	0.785	72%	0.719	S	S	*	*			trans	-92.5	135.8	157.3	44.2	0	0	0	0	109.8	P344 K348	P344-T346 PolarHBondContact O-N 2.88Å; P344-T346 VanDerWaalsContact O-N 3.14Å; T346-K348 PolarHBondContact O-N 3.25Å; T346-K348 VanDerWaalsContact O-N 3.15Å
347	K	36.8	Very low	37.8	Very low	207 Å²	207	126.6 Å²	126.6	90%	0.9	72%	0.715	S	S	*	*			trans	-42.3	116.9	-174.2	-63.5	173.9	179.8	177.4	0	112.4	V349	K347-V349 PolarHBondContact O-N 3.27Å
348	K	29.6	Very low	38.7	Very low	196 Å²	196	121.2 Å²	121.2	85%	0.852	68%	0.68	S	S	*	*			trans	-57.5	111.5	163.2	-79.4	-172.7	175.8	-177.3	0	108.8	T346	T346-K348 PolarHBondContact O-N 3.25Å; T346-K348 VanDerWaalsContact O-N 3.15Å
349	V	32.8	Very low	40.4	Very low	130 Å²	130	120.4 Å²	120.4	79%	0.788	68%	0.677	S	S	*	*			trans	-57.3	139.3	144.4	176.8	0	0	0	0	106	K347 S351	K347-V349 PolarHBondContact O-N 3.27Å; V349-S351 VanDerWaalsContact C-N 3.29Å; V349-S351 PolarHBondContact O-N 3.32Å
350	A	32.2	Very low	42.3	Very low	80 Å²	80	115.4 Å²	115.4	66%	0.661	66%	0.661	S	S	*	*			trans	-67.1	90	177.7	0	0	0	0	0	109.8	F352	A350-F352 PolarHBondContact O-N 3.39Å; A350-F352 VanDerWaalsContact O-N 3.1Å
351	S	33.2	Very low	44.7	Very low	95 Å²	95	110.3 Å²	110.3	66%	0.664	64%	0.637	S	S	*	*			trans	-66.7	102.8	163.7	54.7	0	0	0	0	107.3	V349	V349-S351 VanDerWaalsContact C-N 3.29Å; V349-S351 PolarHBondContact O-N 3.32Å
352	F	35.1	Very low	47	Very low	106 Å²	106	104.4 Å²	104.4	47%	0.465	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-50.6	129.6	162.7	-71.1	-87.5	0	0	0	107.8	A350	A350-F352 PolarHBondContact O-N 3.39Å; A350-F352 VanDerWaalsContact O-N 3.1Å
353	P	43.1	Very low	49.6	Very low	88 Å²	88	104 Å²	104	57%	0.571	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.2	144.8	172.1	26.5	-33	0	0	0	109.2	V356	P353-V356 HydrophobicContact CG-CG2 4.02Å
354	S	45.4	Very low	51.8	Low	111 Å²	111	97.8 Å²	97.8	78%	0.776	57%	0.57	S	S	*	*	S	Bend	trans	-53.1	149	160.9	49	0	0	0	0	109.4	V356	S354-V356 PolarHBondContact O-N 3.37Å
355	F	51.4	Low	54	Low	50 Å²	50	97.3 Å²	97.3	22%	0.219	56%	0.559	C	S	.	*			trans	-26.8	115.1	-166.6	-108.7	-74.4	0	0	0	114.8	A357 P364 E365 I368 V523 E527	F355-A357 PolarHBondContact O-N 3.44Å; F355-P364 HydrophobicContact CB-CB 4.3Å; F355-P364 HydrophobicContact CB-CG 4.19Å; F355-P364 HydrophobicContact CD1-CB 3.54Å; F355-P364 HydrophobicContact CD1-CG 3.94Å; F355-P364 HydrophobicContact CD2-CB 3.79Å; F355-P364 HydrophobicContact CE1-CB 3.71Å; F355-P364 HydrophobicContact CE2-CB 3.93Å; F355-P364 HydrophobicContact CG-CB 3.59Å; F355-P364 HydrophobicContact CG-CG 3.98Å; F355-P364 HydrophobicContact CZ-CB 3.9Å; F355-E365 WeakPolarHBondContact CD2-OE1 3.47Å; F355-I368 HydrophobicContact CE2-CD1 3.79Å; F355-I368 HydrophobicContact CZ-CD1 4.05Å; F355-V523 HydrophobicContact CE1-CG1 3.89Å; F355-V523 HydrophobicContact CZ-CG1 3.68Å; F355-E527 HydrophobicContact CZ-CG 4.38Å
356	V	54.2	Low	56.3	Low	58 Å²	58	91.7 Å²	91.7	35%	0.352	54%	0.535	S	S	.	.			trans	-66.3	104.4	169.6	178.8	0	0	0	0	106.2	P353 S354 V358 P536	P353-V356 HydrophobicContact CG-CG2 4.02Å; S354-V356 PolarHBondContact O-N 3.37Å; V356-V358 PolarHBondContact O-N 3.34Å; V356-P536 HydrophobicContact CG2-CG 4.34Å
357	A	55.3	Low	58.9	Low	84 Å²	84	85.6 Å²	85.6	69%	0.694	50%	0.498	S	S	*	.			trans	-48.2	103.6	-164.6	0	0	0	0	0	112.2	F355 P359	F355-A357 PolarHBondContact O-N 3.44Å; A357-P359 VanDerWaalsContact O-CD 3.27Å; A357-P359 WeakPolarHBondContact O-CD 3.47Å
358	V	61.3	Low	61.2	Low	13 Å²	13	77.9 Å²	77.9	8%	0.079	47%	0.466	C	S	.	.			trans	-70.7	116.2	176.8	-179.9	0	0	0	0	107.3	V356 G360 Q519 V523	V356-V358 PolarHBondContact O-N 3.34Å; V358-G360 PolarHBondContact O-N 3.09Å; V358-Q519 HydrophobicContact CB-CG 4.33Å; V358-Q519 HydrophobicContact CG1-CG 3.76Å; V358-Q519 PolarHBondContact O-NE2 3.37Å; V358-V523 HydrophobicContact CB-CG2 4.15Å; V358-V523 HydrophobicContact CG1-CG2 4.28Å; V358-V523 HydrophobicContact CG2-CG2 3.96Å
359	P	66.3	Low	63.9	Low	124 Å²	124	75.5 Å²	75.5	81%	0.805	46%	0.462	S	S	*	.	S	Bend	trans	-61	123.1	-177.1	-23.8	35.1	0	0	0	111.5	A357	A357-P359 VanDerWaalsContact O-CD 3.27Å; A357-P359 WeakPolarHBondContact O-CD 3.47Å
360	G	72.7	Confident	66.6	Low	44 Å²	44	70.4 Å²	70.4	45%	0.454	44%	0.436	S	S	.	.	S	Bend	trans	170.4	177.6	179.6	0	0	0	0	0	111.3	V358 Q519	V358-G360 PolarHBondContact O-N 3.09Å; G360-Q519 VanDerWaalsContact CA-CD 3.49Å
361	P	78.6	Confident	69.5	Low	59 Å²	59	67.9 Å²	67.9	38%	0.383	41%	0.411	S	S	.	.	S	Bend	trans	-81.9	-13.5	-170.4	32.1	-37.5	0	0	0	114.8	Q515 S516	P361-Q515 HydrophobicContact CG-CB 3.83Å; P361-S516 WeakPolarHBondContact CG-OG 3.17Å
362	C	84.7	Confident	72.4	Confident	26 Å²	26	67.8 Å²	67.8	18%	0.176	40%	0.403	C	S	.	.	S	Bend	trans	-114.4	159.2	-173.8	-59.2	0	0	0	0	112.3	L367 I371 S516 Q519	C362-L367 HydrophobicContact CB-CD1 4.19Å; C362-L367 HydrophobicContact CB-CD2 4.3Å; C362-L367 HydrophobicContact CB-CG 4.06Å; C362-I371 HydrophobicContact CB-CD1 4.17Å; C362-I371 WeakPolarHBondContact SG-CD1 3.33Å; C362-S516 PolarHBondContact SG-OG 2.9Å; C362-S516 VanDerWaalsContact SG-OG 3.38Å; C362-Q519 VanDerWaalsContact N-OE1 3.08Å; C362-Q519 PolarHBondContact O-NE2 2.82Å; C362-Q519 PolarHBondContact O-OE1 2.86Å
363	E	84.9	Confident	75.3	Confident	131 Å²	131	64.1 Å²	64.1	61%	0.612	39%	0.386	S	S	*	.			trans	-72.6	138.3	170.1	-58	-159.8	163.6	0	0	109.7	E365 D366 L367	E363-E365 PolarHBondContact O-N 3.49Å; E363-D366 PolarHBondContact O-N 2.78Å; E363-L367 PolarHBondContact O-N 3.44Å
364	P	80.5	Confident	77.8	Confident	17 Å²	17	63.2 Å²	63.2	11%	0.11	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-32.8	-177.9	-26.4	35.7	0	0	0	113.8	F355 L367 I368 V523	F355-P364 HydrophobicContact CB-CB 4.3Å; F355-P364 HydrophobicContact CB-CG 4.19Å; F355-P364 HydrophobicContact CD1-CB 3.54Å; F355-P364 HydrophobicContact CD1-CG 3.94Å; F355-P364 HydrophobicContact CD2-CB 3.79Å; F355-P364 HydrophobicContact CE1-CB 3.71Å; F355-P364 HydrophobicContact CE2-CB 3.93Å; F355-P364 HydrophobicContact CG-CB 3.59Å; F355-P364 HydrophobicContact CG-CG 3.98Å; F355-P364 HydrophobicContact CZ-CB 3.9Å; P364-L367 PolarHBondContact O-N 3.46Å; P364-I368 WeakPolarHBondContact O-CG1 3.34Å; P364-I368 PolarHBondContact O-N 3.3Å; P364-V523 HydrophobicContact CB-CG1 4.38Å; P364-V523 HydrophobicContact CB-CG2 4.07Å
365	E	84	Confident	80.2	Confident	95 Å²	95	58.1 Å²	58.1	44%	0.444	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-46.1	175.2	-73.3	73.2	-172.3	0	0	111.9	F355 E363 L367 I368 D369	F355-E365 WeakPolarHBondContact CD2-OE1 3.47Å; E363-E365 PolarHBondContact O-N 3.49Å; E365-L367 PolarHBondContact O-N 2.84Å; E365-I368 WeakPolarHBondContact O-CB 3.38Å; E365-I368 PolarHBondContact O-N 2.93Å; E365-D369 PolarHBondContact O-N 2.71Å
366	D	88.2	Confident	82.3	Confident	84 Å²	84	57.9 Å²	57.9	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-32	175.9	-69.6	-23.7	0	0	0	111.8	E363 I368 G370 I371	E363-D366 PolarHBondContact O-N 2.78Å; D366-I368 VanDerWaalsContact C-N 3.28Å; D366-I368 PolarHBondContact O-N 2.84Å; D366-G370 CarbonylContact O-C 3.55Å; D366-G370 VanDerWaalsContact O-CA 3.23Å; D366-G370 WeakPolarHBondContact O-CA 3.42Å; D366-G370 PolarHBondContact O-N 3.25Å; D366-I371 HydrophobicContact CB-CG2 3.68Å
367	L	86.8	Confident	84.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-73.4	-15	175.5	-69.9	171.8	0	0	0	113.7	C362 E363 P364 E365 I371 S435 T436 Q519 A520 V523	C362-L367 HydrophobicContact CB-CD1 4.19Å; C362-L367 HydrophobicContact CB-CD2 4.3Å; C362-L367 HydrophobicContact CB-CG 4.06Å; E363-L367 PolarHBondContact O-N 3.44Å; P364-L367 PolarHBondContact O-N 3.46Å; E365-L367 PolarHBondContact O-N 2.84Å; L367-I371 HydrophobicContact CD2-CD1 3.51Å; L367-I371 HydrophobicContact CD2-CG1 4.02Å; L367-S435 CarbonylContact O-C 3.52Å; L367-S435 WeakPolarHBondContact O-CA 3.38Å; L367-S435 WeakPolarHBondContact O-CB 3.36Å; L367-T436 PolarHBondContact O-N 3.46Å; L367-Q519 HydrophobicContact CD1-CB 3.88Å; L367-Q519 HydrophobicContact CD1-CG 3.7Å; L367-A520 HydrophobicContact CD2-CB 4.28Å; L367-V523 HydrophobicContact CD1-CG2 4.04Å
368	I	84.3	Confident	86	Confident	45 Å²	45	53.6 Å²	53.6	23%	0.231	31%	0.313	C	S	.	.	H	α-helix	trans	-83.2	-50.3	175.8	-67.8	168.4	0	0	0	110.3	F355 P364 E365 D366 T436 V523 E527	F355-I368 HydrophobicContact CE2-CD1 3.79Å; F355-I368 HydrophobicContact CZ-CD1 4.05Å; P364-I368 WeakPolarHBondContact O-CG1 3.34Å; P364-I368 PolarHBondContact O-N 3.3Å; E365-I368 WeakPolarHBondContact O-CB 3.38Å; E365-I368 PolarHBondContact O-N 2.93Å; D366-I368 VanDerWaalsContact C-N 3.28Å; D366-I368 PolarHBondContact O-N 2.84Å; I368-T436 HydrophobicContact CG1-CG2 3.95Å; I368-V523 HydrophobicContact CG1-CG1 4.28Å; I368-E527 HydrophobicContact CD1-CG 4.47Å
369	D	86.9	Confident	87.4	Confident	145 Å²	145	53.7 Å²	53.7	78%	0.775	32%	0.316	S	S	*	.	H	α-helix	trans	-71.1	-40.6	176.4	-75.6	-12.5	0	0	0	111	E365	E365-D369 PolarHBondContact O-N 2.71Å
370	G	89.1	Confident	88.7	Confident	23 Å²	23	49.5 Å²	49.5	24%	0.237	29%	0.29	C	S	.	.			trans	115.5	133.5	167.7	0	0	0	0	0	114.1	D366 I434	D366-G370 CarbonylContact O-C 3.55Å; D366-G370 VanDerWaalsContact O-CA 3.23Å; D366-G370 WeakPolarHBondContact O-CA 3.42Å; D366-G370 PolarHBondContact O-N 3.25Å; G370-I434 VanDerWaalsContact CA-O 3.29Å; G370-I434 WeakPolarHBondContact CA-O 3.39Å
371	I	93.8	Very high	89.6	Confident	27 Å²	27	48.4 Å²	48.4	14%	0.138	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	160.3	-179.4	61.5	-179.1	0	0	0	111.7	C362 D366 L367 F373 F433 I434	C362-I371 HydrophobicContact CB-CD1 4.17Å; C362-I371 WeakPolarHBondContact SG-CD1 3.33Å; D366-I371 HydrophobicContact CB-CG2 3.68Å; L367-I371 HydrophobicContact CD2-CD1 3.51Å; L367-I371 HydrophobicContact CD2-CG1 4.02Å; I371-F373 HydrophobicContact CD1-CD2 4.48Å; I371-F373 HydrophobicContact CD1-CE2 3.57Å; I371-F373 HydrophobicContact CD1-CZ 4.18Å; I371-F373 HydrophobicContact CG1-CE2 4.12Å; I371-F433 CarbonylContact O-C 3.58Å; I371-F433 VanDerWaalsContact O-CA 3.26Å; I371-F433 WeakPolarHBondContact O-CA 3.42Å; I371-I434 HydrophobicContact CG1-CB 4.17Å; I371-I434 PolarHBondContact N-O 3.05Å; I371-I434 PolarHBondContact O-N 2.8Å
372	I	94.9	Very high	90.1	Very high	94 Å²	94	49.5 Å²	49.5	48%	0.482	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.9	179.7	-60.9	176.3	0	0	0	109.8	D431 L432 F433	I372-D431 HydrophobicContact CG2-CB 3.59Å; I372-L432 WeakPolarHBondContact CA-O 3.21Å; I372-F433 HydrophobicContact CD1-CD2 4.47Å; I372-F433 HydrophobicContact CG1-CB 4.16Å; I372-F433 HydrophobicContact CG1-CD2 3.96Å
373	F	95.9	Very high	90.1	Very high	28 Å²	28	48.6 Å²	48.6	12%	0.123	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142	167.1	-68.2	-94.3	0	0	0	111	I371 L432 I434 D509 L512 I513 S516	I371-F373 HydrophobicContact CD1-CD2 4.48Å; I371-F373 HydrophobicContact CD1-CE2 3.57Å; I371-F373 HydrophobicContact CD1-CZ 4.18Å; I371-F373 HydrophobicContact CG1-CE2 4.12Å; F373-L432 PolarHBondContact N-O 3.35Å; F373-L432 VanDerWaalsContact N-O 3.07Å; F373-L432 PolarHBondContact O-N 3.47Å; F373-I434 HydrophobicContact CD2-CD1 3.76Å; F373-I434 HydrophobicContact CE2-CD1 3.94Å; F373-D509 HydrophobicContact CD1-CB 4.15Å; F373-D509 HydrophobicContact CE1-CB 4.49Å; F373-L512 HydrophobicContact CE1-CB 4.06Å; F373-L512 HydrophobicContact CZ-CB 4.42Å; F373-I513 HydrophobicContact CB-CD1 3.84Å; F373-I513 HydrophobicContact CB-CG1 3.68Å; F373-I513 HydrophobicContact CD1-CD1 4.46Å; F373-I513 HydrophobicContact CD1-CG1 3.74Å; F373-I513 HydrophobicContact CD2-CG1 3.88Å; F373-I513 HydrophobicContact CE1-CG1 4.3Å; F373-I513 HydrophobicContact CE2-CG1 4.4Å; F373-I513 HydrophobicContact CG-CD1 4.2Å; F373-I513 HydrophobicContact CG-CG1 3.5Å; F373-S516 WeakPolarHBondContact CZ-OG 3.31Å
374	A	94.9	Very high	90	Very high	70 Å²	70	46.9 Å²	46.9	58%	0.579	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	135.3	169.4	0	0	0	0	0	110.9	S507	A374-S507 PolarHBondContact O-OG 2.81Å
375	A	95.6	Very high	89.7	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161.8	174	0	0	0	0	0	112.1	V430 F505	A375-V430 HydrophobicContact CB-CG2 4.25Å; A375-V430 PolarHBondContact N-O 3Å; A375-V430 VanDerWaalsContact O-CG2 3.23Å; A375-V430 WeakPolarHBondContact O-CG2 3.15Å; A375-V430 PolarHBondContact O-N 3.36Å; A375-F505 HydrophobicContact CB-CB 4.21Å
376	N	94.8	Very high	89.2	Confident	45 Å²	45	45.1 Å²	45.1	24%	0.241	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.1	170.3	-74.8	-95	0	0	0	109.3	L378 L427 F505 E506	N376-L378 PolarHBondContact O-N 2.95Å; N376-L427 HydrophobicContact CB-CB 4.35Å; N376-L427 WeakPolarHBondContact OD1-CB 3.5Å; N376-F505 CarbonylContact O-C 3.56Å; N376-F505 VanDerWaalsContact O-CA 3.28Å; N376-F505 WeakPolarHBondContact O-CA 3.1Å; N376-E506 HydrophobicContact CB-CB 4.19Å; N376-E506 WeakPolarHBondContact CB-O 3.49Å; N376-E506 PolarHBondContact N-O 2.92Å; N376-E506 PolarHBondContact O-N 3.12Å
377	Y	94.9	Very high	87.9	Confident	42 Å²	42	49.4 Å²	49.4	17%	0.165	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	110	174.5	172	-119.7	0	0	0	110.3	G379 S380 T428 M450 M451 F505	Y377-G379 VanDerWaalsContact CE2-O 3.3Å; Y377-G379 WeakPolarHBondContact CE2-O 3.3Å; Y377-G379 VanDerWaalsContact CZ-CA 3.48Å; Y377-S380 WeakPolarHBondContact OH-CB 3.29Å; Y377-S380 PolarHBondContact OH-N 2.95Å; Y377-S380 PolarHBondContact OH-OG 3.48Å; Y377-T428 PolarHBondContact N-O 2.92Å; Y377-M450 HydrophobicContact CD1-CE 3.92Å; Y377-M450 HydrophobicContact CE1-CE 4.17Å; Y377-M451 HydrophobicContact CD2-CE 4.19Å; Y377-M451 HydrophobicContact CE1-CE 4.26Å; Y377-M451 HydrophobicContact CE2-CE 3.46Å; Y377-M451 VanDerWaalsContact CE2-CE 3.46Å; Y377-M451 VanDerWaalsContact CZ-CE 3.49Å; Y377-F505 AromaticContact CD2-CD1 3.99Å; Y377-F505 HydrophobicContact CD2-CD1 3.99Å; Y377-F505 AromaticContact CD2-CE1 3.71Å; Y377-F505 HydrophobicContact CD2-CE1 3.71Å; Y377-F505 HydrophobicContact CD2-CZ 4.42Å; Y377-F505 HydrophobicContact CG-CE1 4.41Å
378	L	92.5	Very high	86.7	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-29.4	-179.4	-62	-164.9	0	0	0	112.7	N376 V405 K406 Q409 L427 I467 V504 E506	N376-L378 PolarHBondContact O-N 2.95Å; L378-V405 HydrophobicContact CB-CG1 3.81Å; L378-V405 WeakPolarHBondContact O-CG1 3.5Å; L378-K406 HydrophobicContact CD1-CG 4.33Å; L378-Q409 WeakPolarHBondContact O-CG 3.28Å; L378-Q409 PolarHBondContact O-NE2 2.94Å; L378-L427 HydrophobicContact CD2-CD2 3.45Å; L378-L427 VanDerWaalsContact CD2-CD2 3.45Å; L378-I467 HydrophobicContact CD1-CD1 3.84Å; L378-V504 HydrophobicContact CB-CB 4.48Å; L378-V504 HydrophobicContact CB-CG1 4.29Å; L378-V504 WeakPolarHBondContact CB-O 3.45Å; L378-V504 HydrophobicContact CD1-CG1 4.13Å; L378-V504 PolarHBondContact N-O 2.89Å; L378-E506 HydrophobicContact CD1-CB 3.99Å; L378-E506 HydrophobicContact CD2-CB 3.84Å; L378-E506 HydrophobicContact CG-CB 3.86Å
379	G	91.6	Very high	86.2	Confident	14 Å²	14	54.4 Å²	54.4	14%	0.144	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-180	-179.6	0	0	0	0	0	113.2	Y377 V504	Y377-G379 VanDerWaalsContact CE2-O 3.3Å; Y377-G379 WeakPolarHBondContact CE2-O 3.3Å; Y377-G379 VanDerWaalsContact CZ-CA 3.48Å; G379-V504 PolarHBondContact N-O 3.28Å; G379-V504 PolarHBondContact O-N 2.95Å
380	S	92.5	Very high	85.8	Confident	36 Å²	36	50.3 Å²	50.3	25%	0.252	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.8	175.6	-58.2	0	0	0	0	110.8	Y377 C502 H503	Y377-S380 WeakPolarHBondContact OH-CB 3.29Å; Y377-S380 PolarHBondContact OH-N 2.95Å; Y377-S380 PolarHBondContact OH-OG 3.48Å; S380-C502 CarbonylContact C-O 3.48Å; S380-C502 VanDerWaalsContact CA-O 3.29Å; S380-C502 WeakPolarHBondContact CA-O 3.48Å; S380-H503 PolarHBondContact OG-ND1 3.21Å
381	T	92.5	Very high	85	Confident	21 Å²	21	53.6 Å²	53.6	13%	0.129	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	161.4	168.1	-162.2	0	0	0	0	110.8	A401 R404 V405 C502	T381-A401 HydrophobicContact CG2-CB 3.66Å; T381-R404 HydrophobicContact CG2-CB 4.49Å; T381-V405 HydrophobicContact CG2-CG2 4.33Å; T381-C502 HydrophobicContact CG2-CB 4.38Å; T381-C502 PolarHBondContact N-O 2.93Å; T381-C502 PolarHBondContact O-N 2.98Å
382	Q	88.2	Confident	84.5	Confident	82 Å²	82	57.6 Å²	57.6	38%	0.383	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.9	174.1	-70	175.8	43.6	0	0	109.1	R404 M500 I501	Q382-R404 PolarHBondContact O-NH1 3.32Å; Q382-M500 WeakPolarHBondContact CA-O 3.5Å; Q382-I501 HydrophobicContact CG-CG1 4.39Å
383	L	85.9	Confident	84	Confident	7 Å²	7	56 Å²	56	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.5	176.8	63.4	82.8	0	0	0	111.3	Q397 A401 M471 M500 C502	L383-Q397 HydrophobicContact CD1-CB 4.07Å; L383-Q397 HydrophobicContact CD1-CG 3.86Å; L383-Q397 HydrophobicContact CD2-CB 3.83Å; L383-Q397 HydrophobicContact CD2-CG 4.34Å; L383-Q397 WeakPolarHBondContact CD2-O 3.29Å; L383-A401 HydrophobicContact CD2-CB 4.23Å; L383-M471 HydrophobicContact CD1-CE 4.08Å; L383-M471 HydrophobicContact CD2-CE 4.25Å; L383-M500 HydrophobicContact CD1-CB 3.84Å; L383-M500 HydrophobicContact CD1-CG 4.19Å; L383-M500 HydrophobicContact CG-CB 4.22Å; L383-M500 PolarHBondContact N-O 2.89Å; L383-M500 VanDerWaalsContact N-O 3.07Å; L383-M500 PolarHBondContact O-N 2.86Å; L383-C502 WeakPolarHBondContact CD2-SG 3.15Å
384	L	81.5	Confident	83.5	Confident	95 Å²	95	55.1 Å²	55.1	50%	0.497	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.8	177.8	-61.5	175.8	0	0	0	108.9	Q397 Q497 K499	L384-Q397 PolarHBondContact O-NE2 3.26Å; L384-Q497 HydrophobicContact CB-CB 4.17Å; L384-Q497 HydrophobicContact CB-CG 4.26Å; L384-Q497 HydrophobicContact CD2-CB 4.49Å; L384-K499 HydrophobicContact CD2-CG 3.84Å
385	S	75.1	Confident	83.2	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.4	-174.6	179.3	0	0	0	0	110.1	R394 Q497 Y498	S385-R394 PolarHBondContact OG-NH1 3.47Å; S385-Q497 CarbonylContact O-C 3.35Å; S385-Q497 VanDerWaalsContact O-CA 3.28Å; S385-Q497 WeakPolarHBondContact O-CA 3.45Å; S385-Y498 PolarHBondContact N-O 2.75Å; S385-Y498 PolarHBondContact O-N 3.16Å
386	E	72.7	Confident	82.8	Confident	74 Å²	74	59.6 Å²	59.6	35%	0.346	30%	0.301	S	S	.	.			trans	-63.6	165.7	162.4	-58.5	-174.6	177.1	0	0	110.2	N388 P389 K495	E386-N388 PolarHBondContact O-N 3.45Å; E386-P389 WeakPolarHBondContact O-CD 3.39Å; E386-K495 HydrophobicContact CG-CD 4.34Å; E386-K495 WeakPolarHBondContact OE1-CD 3.46Å; E386-K495 WeakPolarHBondContact OE1-CE 3.31Å; E386-K495 IonicContact OE1-NZ 2.75Å; E386-K495 PolarHBondContact OE1-NZ 2.77Å; E386-K495 IonicContact OE2-NZ 3.26Å
387	R	61.4	Low	82.6	Confident	174 Å²	174	58.4 Å²	58.4	66%	0.657	29%	0.294	S	S	*	.	S	Bend	trans	-59.4	-48.9	-173.9	-169.4	174.8	-177.9	-168.5	1.3	112.7	Y498	R387-Y498 HydrophobicContact CB-CD2 4.15Å; R387-Y498 HydrophobicContact CB-CE2 3.56Å; R387-Y498 HydrophobicContact CG-CD2 4.49Å; R387-Y498 HydrophobicContact CG-CE2 3.65Å
388	N	62.1	Low	82.4	Confident	128 Å²	128	56.4 Å²	56.4	68%	0.684	29%	0.286	S	S	*	.	S	Bend	trans	-131	74.6	-175.9	-65.5	-10.4	0	0	0	109.8	E386	E386-N388 PolarHBondContact O-N 3.45Å
389	P	73.9	Confident	82.4	Confident	22 Å²	22	60.1 Å²	60.1	14%	0.143	30%	0.303	C	S	.	.			trans	-74.2	150.4	179.4	30.6	-31.9	0	0	0	111.4	E386 I393 R394	E386-P389 WeakPolarHBondContact O-CD 3.39Å; P389-I393 HydrophobicContact CB-CB 4.02Å; P389-I393 HydrophobicContact CB-CG2 3.66Å; P389-R394 HydrophobicContact CG-CG 4.08Å
390	S	78.1	Confident	82.5	Confident	60 Å²	60	63.2 Å²	63.2	42%	0.42	31%	0.314	S	S	.	.			trans	-69.8	163.5	176.3	74.3	0	0	0	0	112.5	N392 I393 R394	S390-N392 PolarHBondContact O-N 2.81Å; S390-I393 PolarHBondContact O-N 2.95Å; S390-I393 VanDerWaalsContact O-N 3.11Å; S390-I393 WeakPolarHBondContact OG-CG1 3.47Å; S390-I393 PolarHBondContact OG-N 3.39Å; S390-R394 PolarHBondContact O-N 2.87Å
391	K	72.2	Confident	82.5	Confident	92 Å²	92	61.5 Å²	61.5	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-53.3	-40.2	174.6	179.8	176.1	171.7	175.6	0	112.2	T98 R394 M395	T98-K391 VanDerWaalsContact CB-CE 3.49Å; T98-K391 PolarHBondContact O-NZ 3.22Å; T98-K391 WeakPolarHBondContact OG1-CE 3.39Å; T98-K391 PolarHBondContact OG1-NZ 3.47Å; K391-R394 PolarHBondContact O-N 2.85Å; K391-M395 PolarHBondContact O-N 3.46Å
392	N	82.9	Confident	82.6	Confident	111 Å²	111	60.9 Å²	60.9	59%	0.594	30%	0.298	S	S	*	.	H	α-helix	trans	-67.3	-43.3	177.9	-178.3	-78.7	0	0	0	111.8	S390 R394 M395 M396	S390-N392 PolarHBondContact O-N 2.81Å; N392-R394 VanDerWaalsContact C-N 3.32Å; N392-R394 PolarHBondContact O-N 3.34Å; N392-M395 PolarHBondContact O-N 3.13Å; N392-M396 PolarHBondContact O-N 3.45Å; N392-M396 WeakPolarHBondContact OD1-CE 3.36Å
393	I	84.9	Confident	82.8	Confident	61 Å²	61	59.5 Å²	59.5	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-38.7	174.3	-65.3	167.5	0	0	0	111.1	P389 S390 M396 Q397	P389-I393 HydrophobicContact CB-CB 4.02Å; P389-I393 HydrophobicContact CB-CG2 3.66Å; S390-I393 PolarHBondContact O-N 2.95Å; S390-I393 VanDerWaalsContact O-N 3.11Å; S390-I393 WeakPolarHBondContact OG-CG1 3.47Å; S390-I393 PolarHBondContact OG-N 3.39Å; I393-M396 HydrophobicContact CG1-CE 4.05Å; I393-M396 PolarHBondContact O-N 2.88Å; I393-Q397 HydrophobicContact CG2-CG 4.49Å; I393-Q397 WeakPolarHBondContact O-CB 3.31Å; I393-Q397 VanDerWaalsContact O-CG 3.32Å; I393-Q397 WeakPolarHBondContact O-CG 3.42Å; I393-Q397 PolarHBondContact O-N 2.85Å
394	R	85.3	Confident	83.2	Confident	9 Å²	9	63.1 Å²	63.1	3%	0.034	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-41.6	173.7	-83.7	-67.8	-170.7	-121.8	-0.6	112.6	S385 P389 S390 K391 N392 Q397 A398 S459 Y460	S385-R394 PolarHBondContact OG-NH1 3.47Å; P389-R394 HydrophobicContact CG-CG 4.08Å; S390-R394 PolarHBondContact O-N 2.87Å; K391-R394 PolarHBondContact O-N 2.85Å; N392-R394 VanDerWaalsContact C-N 3.32Å; N392-R394 PolarHBondContact O-N 3.34Å; R394-Q397 PolarHBondContact O-N 3.16Å; R394-A398 WeakPolarHBondContact O-CB 3.36Å; R394-A398 PolarHBondContact O-N 3.15Å; R394-S459 PolarHBondContact NE-OG 2.85Å; R394-S459 PolarHBondContact NH2-OG 3.2Å; R394-Y460 HydrophobicContact CB-CD1 3.93Å; R394-Y460 HydrophobicContact CB-CD2 3.92Å; R394-Y460 HydrophobicContact CB-CE1 4.1Å; R394-Y460 HydrophobicContact CB-CE2 4.13Å; R394-Y460 HydrophobicContact CB-CG 3.83Å; R394-Y460 HydrophobicContact CG-CD2 4.36Å; R394-Y460 HydrophobicContact CG-CG 4.18Å
395	M	88.6	Confident	83.7	Confident	57 Å²	57	58.8 Å²	58.8	28%	0.281	29%	0.288	S	S	.	.	H	α-helix	trans	-63.5	-44.9	174.2	-179.6	54	87.7	0	0	111.7	T98 K391 N392 Q397 A398 Q399 A462 I464	T98-M395 HydrophobicContact CG2-CE 3.34Å; K391-M395 PolarHBondContact O-N 3.46Å; N392-M395 PolarHBondContact O-N 3.13Å; M395-Q397 VanDerWaalsContact C-N 3.32Å; M395-Q397 PolarHBondContact O-N 3.49Å; M395-A398 PolarHBondContact O-N 2.88Å; M395-Q399 PolarHBondContact O-N 3.13Å; M395-A462 HydrophobicContact CE-CB 4.18Å; M395-I464 HydrophobicContact SD-CD1 4.15Å
396	M	88.2	Confident	84.4	Confident	111 Å²	111	62.2 Å²	62.2	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-41.9	174.5	-69.8	-168.1	-69.3	0	0	112.3	N392 I393 Q399 E400	N392-M396 PolarHBondContact O-N 3.45Å; N392-M396 WeakPolarHBondContact OD1-CE 3.36Å; I393-M396 HydrophobicContact CG1-CE 4.05Å; I393-M396 PolarHBondContact O-N 2.88Å; M396-Q399 PolarHBondContact O-N 3.03Å; M396-E400 WeakPolarHBondContact O-CB 3.5Å; M396-E400 PolarHBondContact O-N 3.24Å
397	Q	89.4	Confident	85.3	Confident	19 Å²	19	66.3 Å²	66.3	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-63.9	-39.3	175	-76.3	175.4	-25.5	0	0	112.7	L383 L384 I393 R394 M395 A401 M471	L383-Q397 HydrophobicContact CD1-CB 4.07Å; L383-Q397 HydrophobicContact CD1-CG 3.86Å; L383-Q397 HydrophobicContact CD2-CB 3.83Å; L383-Q397 HydrophobicContact CD2-CG 4.34Å; L383-Q397 WeakPolarHBondContact CD2-O 3.29Å; L384-Q397 PolarHBondContact O-NE2 3.26Å; I393-Q397 HydrophobicContact CG2-CG 4.49Å; I393-Q397 WeakPolarHBondContact O-CB 3.31Å; I393-Q397 VanDerWaalsContact O-CG 3.32Å; I393-Q397 WeakPolarHBondContact O-CG 3.42Å; I393-Q397 PolarHBondContact O-N 2.85Å; R394-Q397 PolarHBondContact O-N 3.16Å; M395-Q397 VanDerWaalsContact C-N 3.32Å; M395-Q397 PolarHBondContact O-N 3.49Å; Q397-A401 WeakPolarHBondContact O-CB 3.33Å; Q397-A401 PolarHBondContact O-N 3.05Å; Q397-M471 HydrophobicContact CB-CE 3.79Å; Q397-M471 HydrophobicContact CB-SD 4.46Å
398	A	90.5	Very high	86.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65	-47.4	175.1	0	0	0	0	0	111.4	R394 M395 E400 A401 V402 Y460 I464 V469 M471	R394-A398 WeakPolarHBondContact O-CB 3.36Å; R394-A398 PolarHBondContact O-N 3.15Å; M395-A398 PolarHBondContact O-N 2.88Å; A398-E400 VanDerWaalsContact C-N 3.34Å; A398-E400 PolarHBondContact O-N 3.18Å; A398-A401 WeakPolarHBondContact O-CB 3.4Å; A398-A401 PolarHBondContact O-N 2.84Å; A398-A401 VanDerWaalsContact O-N 3.12Å; A398-V402 WeakPolarHBondContact O-CG2 3.25Å; A398-V402 PolarHBondContact O-N 2.92Å; A398-Y460 HydrophobicContact CB-CD1 4.4Å; A398-Y460 HydrophobicContact CB-CE1 4.1Å; A398-I464 HydrophobicContact CB-CD1 4.33Å; A398-V469 HydrophobicContact CB-CB 4.15Å; A398-V469 HydrophobicContact CB-CG1 3.81Å; A398-V469 HydrophobicContact CB-CG2 4.4Å; A398-M471 HydrophobicContact CB-SD 4.36Å
399	Q	92.7	Very high	87.8	Confident	89 Å²	89	59.4 Å²	59.4	42%	0.416	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-36.2	178.1	-173.4	65	-14.7	0	0	112.3	M395 M396 S403	M395-Q399 PolarHBondContact O-N 3.13Å; M396-Q399 PolarHBondContact O-N 3.03Å; Q399-S403 VanDerWaalsContact O-CB 3.24Å; Q399-S403 WeakPolarHBondContact O-CB 3.29Å; Q399-S403 PolarHBondContact O-N 2.91Å; Q399-S403 PolarHBondContact O-OG 3.25Å
400	E	93.6	Very high	88.4	Confident	79 Å²	79	65.5 Å²	65.5	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-43.7	171.1	-160.5	-158	173.2	0	0	111.3	M396 A398 S403 R404	M396-E400 WeakPolarHBondContact O-CB 3.5Å; M396-E400 PolarHBondContact O-N 3.24Å; A398-E400 VanDerWaalsContact C-N 3.34Å; A398-E400 PolarHBondContact O-N 3.18Å; E400-S403 CarbonylContact O-C 3.6Å; E400-S403 PolarHBondContact O-N 2.86Å; E400-R404 VanDerWaalsContact CD-NE 3.33Å; E400-R404 WeakPolarHBondContact O-CB 3.41Å; E400-R404 VanDerWaalsContact O-CG 3.29Å; E400-R404 WeakPolarHBondContact O-CG 3.47Å; E400-R404 PolarHBondContact O-N 3.46Å; E400-R404 IonicContact OE1-CZ 3.73Å; E400-R404 IonicContact OE1-NE 3.12Å; E400-R404 PolarHBondContact OE1-NE 3.15Å; E400-R404 IonicContact OE1-NH2 2.76Å; E400-R404 PolarHBondContact OE1-NH2 2.86Å; E400-R404 IonicContact OE2-NE 2.66Å; E400-R404 IonicContact OE2-NH2 4Å
401	A	92.8	Very high	88.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-47.5	178.2	0	0	0	0	0	112	T381 L383 Q397 A398 S403 R404 V405 C502	T381-A401 HydrophobicContact CG2-CB 3.66Å; L383-A401 HydrophobicContact CD2-CB 4.23Å; Q397-A401 WeakPolarHBondContact O-CB 3.33Å; Q397-A401 PolarHBondContact O-N 3.05Å; A398-A401 WeakPolarHBondContact O-CB 3.4Å; A398-A401 PolarHBondContact O-N 2.84Å; A398-A401 VanDerWaalsContact O-N 3.12Å; A401-S403 VanDerWaalsContact C-N 3.33Å; A401-S403 PolarHBondContact O-N 2.76Å; A401-R404 PolarHBondContact O-N 2.86Å; A401-V405 WeakPolarHBondContact O-CG2 3.49Å; A401-V405 PolarHBondContact O-N 2.98Å; A401-C502 HydrophobicContact CB-CB 3.72Å
402	V	93.8	Very high	89.2	Confident	8 Å²	8	63.6 Å²	63.6	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-44.7	173.6	176.3	0	0	0	0	110.7	A398 R404 V405 K406 I464 I467 V469 V504	A398-V402 WeakPolarHBondContact O-CG2 3.25Å; A398-V402 PolarHBondContact O-N 2.92Å; V402-R404 VanDerWaalsContact C-N 3.31Å; V402-R404 PolarHBondContact O-N 3.07Å; V402-V405 PolarHBondContact O-N 3.13Å; V402-K406 HydrophobicContact CG1-CD 3.86Å; V402-K406 HydrophobicContact CG1-CG 4.09Å; V402-K406 WeakPolarHBondContact O-CB 3.26Å; V402-K406 PolarHBondContact O-N 2.9Å; V402-I464 HydrophobicContact CG2-CD1 4.35Å; V402-I467 HydrophobicContact CG1-CG2 4.3Å; V402-I467 HydrophobicContact CG2-CG2 3.79Å; V402-V469 HydrophobicContact CG2-CG2 3.33Å; V402-V504 HydrophobicContact CG2-CG1 4Å; V402-V504 HydrophobicContact CG2-CG2 4.21Å
403	S	93.6	Very high	89.2	Confident	53 Å²	53	62.5 Å²	62.5	37%	0.371	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-29.5	179.6	-62	0	0	0	0	113.5	Q399 E400 A401 R407	Q399-S403 VanDerWaalsContact O-CB 3.24Å; Q399-S403 WeakPolarHBondContact O-CB 3.29Å; Q399-S403 PolarHBondContact O-N 2.91Å; Q399-S403 PolarHBondContact O-OG 3.25Å; E400-S403 CarbonylContact O-C 3.6Å; E400-S403 PolarHBondContact O-N 2.86Å; A401-S403 VanDerWaalsContact C-N 3.33Å; A401-S403 PolarHBondContact O-N 2.76Å; S403-R407 WeakPolarHBondContact O-CG 2.91Å; S403-R407 PolarHBondContact O-NE 2.95Å
404	R	93.1	Very high	89.1	Confident	83 Å²	83	65.5 Å²	65.5	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-72.2	-52.6	170.8	-72.2	166.9	173.4	-140	2.9	110.6	T381 Q382 E400 A401 V402 R407 M408	T381-R404 HydrophobicContact CG2-CB 4.49Å; Q382-R404 PolarHBondContact O-NH1 3.32Å; E400-R404 VanDerWaalsContact CD-NE 3.33Å; E400-R404 WeakPolarHBondContact O-CB 3.41Å; E400-R404 VanDerWaalsContact O-CG 3.29Å; E400-R404 WeakPolarHBondContact O-CG 3.47Å; E400-R404 PolarHBondContact O-N 3.46Å; E400-R404 IonicContact OE1-CZ 3.73Å; E400-R404 IonicContact OE1-NE 3.12Å; E400-R404 PolarHBondContact OE1-NE 3.15Å; E400-R404 IonicContact OE1-NH2 2.76Å; E400-R404 PolarHBondContact OE1-NH2 2.86Å; E400-R404 IonicContact OE2-NE 2.66Å; E400-R404 IonicContact OE2-NH2 4Å; A401-R404 PolarHBondContact O-N 2.86Å; V402-R404 VanDerWaalsContact C-N 3.31Å; V402-R404 PolarHBondContact O-N 3.07Å; R404-R407 PolarHBondContact O-N 3.5Å; R404-M408 WeakPolarHBondContact O-CG 3.24Å; R404-M408 PolarHBondContact O-N 2.85Å; R404-M408 VanDerWaalsContact O-N 3.07Å
405	V	92.8	Very high	88.7	Confident	4 Å²	4	72.6 Å²	72.6	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-46.8	-177.3	174.4	0	0	0	0	112	L378 T381 A401 V402 R407 M408 Q409 V504	L378-V405 HydrophobicContact CB-CG1 3.81Å; L378-V405 WeakPolarHBondContact O-CG1 3.5Å; T381-V405 HydrophobicContact CG2-CG2 4.33Å; A401-V405 WeakPolarHBondContact O-CG2 3.49Å; A401-V405 PolarHBondContact O-N 2.98Å; V402-V405 PolarHBondContact O-N 3.13Å; V405-R407 PolarHBondContact O-N 2.79Å; V405-M408 PolarHBondContact O-N 2.82Å; V405-M408 VanDerWaalsContact O-N 3.1Å; V405-Q409 PolarHBondContact O-N 2.97Å; V405-V504 HydrophobicContact CB-CB 4.41Å; V405-V504 HydrophobicContact CB-CG2 4.22Å; V405-V504 HydrophobicContact CG1-CB 4.24Å; V405-V504 HydrophobicContact CG2-CB 4.44Å; V405-V504 HydrophobicContact CG2-CG2 3.95Å
406	K	90.8	Very high	88	Confident	72 Å²	72	73 Å²	73	31%	0.313	35%	0.354	S	S	.	.	H	α-helix	trans	-62	-28.9	177.4	-72.2	-167.8	175.1	-170.8	0	112.6	L378 V402 K410 I467	L378-K406 HydrophobicContact CD1-CG 4.33Å; V402-K406 HydrophobicContact CG1-CD 3.86Å; V402-K406 HydrophobicContact CG1-CG 4.09Å; V402-K406 WeakPolarHBondContact O-CB 3.26Å; V402-K406 PolarHBondContact O-N 2.9Å; K406-K410 WeakPolarHBondContact O-CG 3.4Å; K406-K410 PolarHBondContact O-N 2.98Å; K406-K410 VanDerWaalsContact O-N 3.13Å; K406-I467 VanDerWaalsContact CE-CD1 3.44Å; K406-I467 VanDerWaalsContact NZ-CG1 3.26Å
407	R	91	Very high	87.1	Confident	160 Å²	160	77 Å²	77	60%	0.604	37%	0.368	S	S	*	.	H	α-helix	trans	-71.5	-45	170.4	-81.2	-177.3	-68.1	149.5	-6.4	112.6	S403 R404 V405 Q409 K410 A411	S403-R407 WeakPolarHBondContact O-CG 2.91Å; S403-R407 PolarHBondContact O-NE 2.95Å; R404-R407 PolarHBondContact O-N 3.5Å; V405-R407 PolarHBondContact O-N 2.79Å; R407-Q409 VanDerWaalsContact C-N 3.33Å; R407-Q409 PolarHBondContact O-N 3.21Å; R407-K410 PolarHBondContact O-N 3.21Å; R407-A411 PolarHBondContact O-N 2.88Å
408	M	88.6	Confident	86.2	Confident	123 Å²	123	80.1 Å²	80.1	61%	0.606	40%	0.397	S	S	*	.	H	α-helix	trans	-60.7	-42.9	176.4	-68.5	174	67.3	0	0	111.5	R404 V405 A411 A412	R404-M408 WeakPolarHBondContact O-CG 3.24Å; R404-M408 PolarHBondContact O-N 2.85Å; R404-M408 VanDerWaalsContact O-N 3.07Å; V405-M408 PolarHBondContact O-N 2.82Å; V405-M408 VanDerWaalsContact O-N 3.1Å; M408-A411 PolarHBondContact O-N 3.41Å; M408-A412 WeakPolarHBondContact O-CB 3.38Å; M408-A412 PolarHBondContact O-N 2.95Å
409	Q	86.2	Confident	84.9	Confident	34 Å²	34	83.3 Å²	83.3	16%	0.159	42%	0.42	C	S	.	.	H	α-helix	trans	-60.1	-45.7	173.3	-87.7	-72.6	-6.3	0	0	112.7	L378 V405 R407 A411 A412 K413 T426	L378-Q409 WeakPolarHBondContact O-CG 3.28Å; L378-Q409 PolarHBondContact O-NE2 2.94Å; V405-Q409 PolarHBondContact O-N 2.97Å; R407-Q409 VanDerWaalsContact C-N 3.33Å; R407-Q409 PolarHBondContact O-N 3.21Å; Q409-A411 PolarHBondContact O-N 2.79Å; Q409-A412 PolarHBondContact O-N 3.12Å; Q409-K413 WeakPolarHBondContact O-CG 3.32Å; Q409-K413 PolarHBondContact O-N 3.43Å; Q409-K413 VanDerWaalsContact OE1-CE 3.3Å; Q409-T426 PolarHBondContact NE2-O 3.38Å; Q409-T426 PolarHBondContact OE1-O 2.82Å
410	K	86.8	Confident	83.4	Confident	151 Å²	151	84.6 Å²	84.6	66%	0.657	44%	0.438	S	S	*	.	H	α-helix	trans	-59.1	-44.6	174.3	-76.5	176	179.7	-175.9	0	112	K406 R407 K413 I414	K406-K410 WeakPolarHBondContact O-CG 3.4Å; K406-K410 PolarHBondContact O-N 2.98Å; K406-K410 VanDerWaalsContact O-N 3.13Å; R407-K410 PolarHBondContact O-N 3.21Å; K410-K413 PolarHBondContact O-N 3.26Å; K410-I414 WeakPolarHBondContact O-CG1 3.26Å; K410-I414 PolarHBondContact O-N 2.66Å
411	A	85.4	Confident	81.5	Confident	59 Å²	59	90 Å²	90	49%	0.488	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-41	177	0	0	0	0	0	112.7	R407 M408 Q409 I414 K415	R407-A411 PolarHBondContact O-N 2.88Å; M408-A411 PolarHBondContact O-N 3.41Å; Q409-A411 PolarHBondContact O-N 2.79Å; A411-I414 PolarHBondContact O-N 3.07Å; A411-K415 WeakPolarHBondContact O-CB 3.5Å; A411-K415 PolarHBondContact O-N 3.41Å
412	A	83.2	Confident	79.5	Confident	53 Å²	53	92.9 Å²	92.9	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-44.6	175.6	0	0	0	0	0	112	M408 Q409 I414 K415 K416	M408-A412 WeakPolarHBondContact O-CB 3.38Å; M408-A412 PolarHBondContact O-N 2.95Å; Q409-A412 PolarHBondContact O-N 3.12Å; A412-I414 VanDerWaalsContact C-N 3.35Å; A412-I414 PolarHBondContact O-N 2.94Å; A412-K415 PolarHBondContact O-N 2.74Å; A412-K416 PolarHBondContact O-N 2.97Å
413	K	81.1	Confident	77.4	Confident	87 Å²	87	100 Å²	100	38%	0.378	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-38.6	176.4	-69.3	179.6	-172.7	-164.6	0	112.1	Q409 K410 K417 T426	Q409-K413 WeakPolarHBondContact O-CG 3.32Å; Q409-K413 PolarHBondContact O-N 3.43Å; Q409-K413 VanDerWaalsContact OE1-CE 3.3Å; K410-K413 PolarHBondContact O-N 3.26Å; K413-K417 WeakPolarHBondContact O-CB 3.43Å; K413-K417 PolarHBondContact O-N 3.44Å; K413-T426 VanDerWaalsContact CE-OG1 3.26Å; K413-T426 WeakPolarHBondContact CE-OG1 3.36Å; K413-T426 HydrophobicContact CG-CG2 4.29Å
414	I	82.8	Confident	75.5	Confident	124 Å²	124	101 Å²	101	64%	0.636	54%	0.543	S	S	*	.	H	α-helix	trans	-64.9	-47.1	172.8	-67	164	0	0	0	111	K410 A411 A412 K416 K417 A418	K410-I414 WeakPolarHBondContact O-CG1 3.26Å; K410-I414 PolarHBondContact O-N 2.66Å; A411-I414 PolarHBondContact O-N 3.07Å; A412-I414 VanDerWaalsContact C-N 3.35Å; A412-I414 PolarHBondContact O-N 2.94Å; I414-K416 PolarHBondContact O-N 2.81Å; I414-K417 PolarHBondContact O-N 3.36Å; I414-A418 PolarHBondContact O-N 2.9Å; I414-A418 VanDerWaalsContact O-N 3.11Å
415	K	78.9	Confident	73.6	Confident	158 Å²	158	103.7 Å²	103.7	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-63.2	-40.5	179	-171.1	178.8	178.9	-176.4	0	112.3	A411 A412 A418 S419	A411-K415 WeakPolarHBondContact O-CB 3.5Å; A411-K415 PolarHBondContact O-N 3.41Å; A412-K415 PolarHBondContact O-N 2.74Å; K415-A418 PolarHBondContact O-N 2.89Å; K415-S419 WeakPolarHBondContact O-CB 3.49Å; K415-S419 PolarHBondContact O-N 2.95Å; K415-S419 PolarHBondContact O-OG 3.1Å
416	K	72.1	Confident	72.1	Confident	65 Å²	65	106.2 Å²	106.2	28%	0.283	57%	0.574	S	S	.	*	H	α-helix	trans	-63.1	-44.2	173.7	-165.2	-168.2	178.5	-162.5	0	110.9	A412 I414 A418 S419 G422 D423 A424 T426	A412-K416 PolarHBondContact O-N 2.97Å; I414-K416 PolarHBondContact O-N 2.81Å; K416-A418 PolarHBondContact O-N 2.73Å; K416-S419 CarbonylContact O-C 3.53Å; K416-S419 PolarHBondContact O-N 3.31Å; K416-G422 WeakPolarHBondContact CE-O 3.33Å; K416-G422 PolarHBondContact NZ-O 3.13Å; K416-G422 VanDerWaalsContact NZ-O 3.11Å; K416-D423 IonicContact NZ-OD1 3.82Å; K416-D423 PolarHBondContact NZ-OD1 2.99Å; K416-A424 PolarHBondContact NZ-O 2.81Å; K416-T426 HydrophobicContact CD-CG2 3.68Å
417	K	70.7	Confident	71.1	Confident	196 Å²	196	104.7 Å²	104.7	85%	0.852	57%	0.569	S	S	*	*	H	α-helix	trans	-61.8	-24.6	176.8	-170.5	170.8	-179	176.1	0	113.7	K413 I414	K413-K417 WeakPolarHBondContact O-CB 3.43Å; K413-K417 PolarHBondContact O-N 3.44Å; I414-K417 PolarHBondContact O-N 3.36Å
418	A	70.8	Confident	70.9	Confident	85 Å²	85	99.7 Å²	99.7	70%	0.702	56%	0.556	S	S	*	*	H	α-helix	trans	-87	-11.4	172.1	0	0	0	0	0	114.2	I414 K415 K416	I414-A418 PolarHBondContact O-N 2.9Å; I414-A418 VanDerWaalsContact O-N 3.11Å; K415-A418 PolarHBondContact O-N 2.89Å; K416-A418 PolarHBondContact O-N 2.73Å
419	S	61.3	Low	71.2	Confident	67 Å²	67	98 Å²	98	47%	0.469	55%	0.547	S	S	.	.	S	Bend	trans	-116.2	80.3	-175.6	-53.4	0	0	0	0	109.9	K415 K416 E421	K415-S419 WeakPolarHBondContact O-CB 3.49Å; K415-S419 PolarHBondContact O-N 2.95Å; K415-S419 PolarHBondContact O-OG 3.1Å; K416-S419 CarbonylContact O-C 3.53Å; K416-S419 PolarHBondContact O-N 3.31Å; S419-E421 PolarHBondContact O-N 3.05Å
420	S	63.1	Low	71.6	Confident	116 Å²	116	96.5 Å²	96.5	81%	0.811	54%	0.54	S	S	*	.			trans	-75.3	82.3	-173.2	173.4	0	0	0	0	113.5
421	E	52.3	Low	72.1	Confident	193 Å²	193	90.9 Å²	90.9	90%	0.902	52%	0.517	S	S	*	.	S	Bend	trans	-169.5	130.5	148.7	-109.2	160.6	-163.9	0	0	110.6	S419	S419-E421 PolarHBondContact O-N 3.05Å
422	G	50.8	Low	72.6	Confident	60 Å²	60	88.1 Å²	88.1	62%	0.619	49%	0.494	S	S	*	.			trans	98.8	102.6	175.9	0	0	0	0	0	115.5	K416 A424	K416-G422 WeakPolarHBondContact CE-O 3.33Å; K416-G422 PolarHBondContact NZ-O 3.13Å; K416-G422 VanDerWaalsContact NZ-O 3.11Å; G422-A424 VanDerWaalsContact C-N 3.32Å; G422-A424 PolarHBondContact O-N 3.32Å
423	D	50.5	Low	73.2	Confident	158 Å²	158	87.5 Å²	87.5	85%	0.845	48%	0.482	S	S	*	.			trans	-91.2	40.7	-176	-151.8	17.5	0	0	0	115.4	K416	K416-D423 IonicContact NZ-OD1 3.82Å; K416-D423 PolarHBondContact NZ-OD1 2.99Å
424	A	52.8	Low	73.8	Confident	74 Å²	74	83.4 Å²	83.4	61%	0.612	46%	0.464	S	S	*	.			trans	-67.4	138.5	173.8	0	0	0	0	0	112	K416 G422 T426	K416-A424 PolarHBondContact NZ-O 2.81Å; G422-A424 VanDerWaalsContact C-N 3.32Å; G422-A424 PolarHBondContact O-N 3.32Å; A424-T426 PolarHBondContact O-N 3.43Å
425	Q	54.6	Low	74.3	Confident	139 Å²	139	77.6 Å²	77.6	65%	0.65	44%	0.435	S	S	*	.			trans	-41.6	132.3	175.9	-121	91.2	-36.4	0	0	112.1	L427 E429	Q425-L427 VanDerWaalsContact C-N 3.28Å; Q425-L427 WeakPolarHBondContact CB-O 3.4Å; Q425-E429 PolarHBondContact NE2-OE1 2.65Å
426	T	61.1	Low	74.6	Confident	57 Å²	57	70.8 Å²	70.8	35%	0.35	41%	0.406	S	S	.	.	S	Bend	trans	-86.9	-1.8	174	54.4	0	0	0	0	113.7	Q409 K413 K416 A424	Q409-T426 PolarHBondContact NE2-O 3.38Å; Q409-T426 PolarHBondContact OE1-O 2.82Å; K413-T426 VanDerWaalsContact CE-OG1 3.26Å; K413-T426 WeakPolarHBondContact CE-OG1 3.36Å; K413-T426 HydrophobicContact CG-CG2 4.29Å; K416-T426 HydrophobicContact CD-CG2 3.68Å; A424-T426 PolarHBondContact O-N 3.43Å
427	L	69.6	Low	75.1	Confident	40 Å²	40	73.2 Å²	73.2	21%	0.209	42%	0.418	C	S	.	.	S	Bend	trans	-122.6	124.4	178.1	-60.9	170.1	0	0	0	105.3	N376 L378 Q425 E429	N376-L427 HydrophobicContact CB-CB 4.35Å; N376-L427 WeakPolarHBondContact OD1-CB 3.5Å; L378-L427 HydrophobicContact CD2-CD2 3.45Å; L378-L427 VanDerWaalsContact CD2-CD2 3.45Å; Q425-L427 VanDerWaalsContact C-N 3.28Å; Q425-L427 WeakPolarHBondContact CB-O 3.4Å; L427-E429 PolarHBondContact O-N 3.3Å
428	T	86.9	Confident	76	Confident	54 Å²	54	68 Å²	68	33%	0.331	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.5	176	-53.9	0	0	0	0	107.8	Y377 V430 M450	Y377-T428 PolarHBondContact N-O 2.92Å; T428-V430 HydrophobicContact CG2-CG1 4.03Å; T428-M450 HydrophobicContact CG2-CE 4.06Å; T428-M450 HydrophobicContact CG2-SD 4.06Å
429	E	93.1	Very high	77	Confident	89 Å²	89	64 Å²	64	42%	0.416	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.7	172.2	-70.6	165.7	-124.9	0	0	108.8	Q425 L427 N443 A444	Q425-E429 PolarHBondContact NE2-OE1 2.65Å; L427-E429 PolarHBondContact O-N 3.3Å; E429-N443 PolarHBondContact O-ND2 3.35Å; E429-A444 HydrophobicContact CB-CB 4.31Å; E429-A444 PolarHBondContact O-N 2.94Å; E429-A444 VanDerWaalsContact O-N 3.13Å
430	V	96.1	Very high	78.6	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.2	-171.2	-66.8	0	0	0	0	111.9	A375 T428 V441 L442 M450 F505	A375-V430 HydrophobicContact CB-CG2 4.25Å; A375-V430 PolarHBondContact N-O 3Å; A375-V430 VanDerWaalsContact O-CG2 3.23Å; A375-V430 WeakPolarHBondContact O-CG2 3.15Å; A375-V430 PolarHBondContact O-N 3.36Å; T428-V430 HydrophobicContact CG2-CG1 4.03Å; V430-V441 HydrophobicContact CB-CG1 3.71Å; V430-V441 HydrophobicContact CG1-CG1 3.75Å; V430-V441 HydrophobicContact CG2-CG1 3.95Å; V430-L442 CarbonylContact C-O 3.57Å; V430-L442 WeakPolarHBondContact CA-O 3.3Å; V430-L442 WeakPolarHBondContact CB-O 3.26Å; V430-M450 HydrophobicContact CG1-SD 3.58Å; V430-M450 VanDerWaalsContact CG1-SD 3.58Å; V430-F505 HydrophobicContact CG2-CD1 4.18Å; V430-F505 HydrophobicContact CG2-CE1 4.46Å
431	D	96.5	Very high	80.2	Confident	33 Å²	33	57.9 Å²	57.9	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	115.9	168	-76.4	-37.9	0	0	0	109	I372 F433 L442 Q447	I372-D431 HydrophobicContact CG2-CB 3.59Å; D431-F433 PolarHBondContact O-N 3.31Å; D431-L442 HydrophobicContact CB-CB 4.33Å; D431-L442 PolarHBondContact N-O 3.28Å; D431-L442 PolarHBondContact O-N 3.02Å; D431-Q447 PolarHBondContact OD2-NE2 2.93Å
432	L	95.6	Very high	82.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	93.7	177	-174.2	68.4	0	0	0	109.2	I372 F373 I434 I439 V441 F505 I513	I372-L432 WeakPolarHBondContact CA-O 3.21Å; F373-L432 PolarHBondContact N-O 3.35Å; F373-L432 VanDerWaalsContact N-O 3.07Å; F373-L432 PolarHBondContact O-N 3.47Å; L432-I434 HydrophobicContact CD2-CD1 4.47Å; L432-I434 HydrophobicContact CG-CG1 4.38Å; L432-I439 HydrophobicContact CD1-CG2 3.64Å; L432-I439 HydrophobicContact CG-CG2 4.39Å; L432-V441 HydrophobicContact CD1-CG2 3.9Å; L432-F505 HydrophobicContact CD1-CZ 4.43Å; L432-I513 HydrophobicContact CD2-CD1 4.43Å; L432-I513 HydrophobicContact CD2-CG2 3.46Å; L432-I513 VanDerWaalsContact CD2-CG2 3.46Å
433	F	96.4	Very high	84.2	Confident	40 Å²	40	48.1 Å²	48.1	18%	0.175	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	130.5	176.3	170.6	-84.5	0	0	0	110.7	I371 I372 D431 R438 I439 K440 L442	I371-F433 CarbonylContact O-C 3.58Å; I371-F433 VanDerWaalsContact O-CA 3.26Å; I371-F433 WeakPolarHBondContact O-CA 3.42Å; I372-F433 HydrophobicContact CD1-CD2 4.47Å; I372-F433 HydrophobicContact CG1-CB 4.16Å; I372-F433 HydrophobicContact CG1-CD2 3.96Å; D431-F433 PolarHBondContact O-N 3.31Å; F433-R438 HydrophobicContact CD1-CG 4.45Å; F433-R438 HydrophobicContact CE1-CG 4.03Å; F433-I439 CarbonylContact O-C 3.51Å; F433-I439 VanDerWaalsContact O-CA 3.26Å; F433-I439 WeakPolarHBondContact O-CA 3.24Å; F433-K440 HydrophobicContact CB-CB 4.1Å; F433-K440 HydrophobicContact CD1-CB 4.14Å; F433-K440 HydrophobicContact CD1-CD 4.48Å; F433-K440 HydrophobicContact CD1-CG 4.47Å; F433-K440 PolarHBondContact N-O 2.89Å; F433-K440 PolarHBondContact O-N 3.39Å; F433-L442 HydrophobicContact CB-CD1 3.86Å
434	I	94.7	Very high	86.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.3	-177.6	-59	157.5	0	0	0	109.1	G370 I371 F373 L432 I439 I513 I517 A520	G370-I434 VanDerWaalsContact CA-O 3.29Å; G370-I434 WeakPolarHBondContact CA-O 3.39Å; I371-I434 HydrophobicContact CG1-CB 4.17Å; I371-I434 PolarHBondContact N-O 3.05Å; I371-I434 PolarHBondContact O-N 2.8Å; F373-I434 HydrophobicContact CD2-CD1 3.76Å; F373-I434 HydrophobicContact CE2-CD1 3.94Å; L432-I434 HydrophobicContact CD2-CD1 4.47Å; L432-I434 HydrophobicContact CG-CG1 4.38Å; I434-I439 HydrophobicContact CG1-CG1 4.45Å; I434-I439 HydrophobicContact CG1-CG2 4.47Å; I434-I439 HydrophobicContact CG2-CG1 4.48Å; I434-I513 HydrophobicContact CD1-CG2 4.42Å; I434-I517 HydrophobicContact CD1-CD1 4.23Å; I434-I517 HydrophobicContact CD1-CG1 3.71Å; I434-I517 HydrophobicContact CG1-CG1 4Å; I434-I517 HydrophobicContact CG2-CG1 4.08Å; I434-A520 HydrophobicContact CG2-CB 4.06Å
435	S	92.8	Very high	88	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.021	23%	0.232	C	C	.	.			trans	-143.3	172.3	167.5	81.4	0	0	0	0	113.1	L367 Q437 R438	L367-S435 CarbonylContact O-C 3.52Å; L367-S435 WeakPolarHBondContact O-CA 3.38Å; L367-S435 WeakPolarHBondContact O-CB 3.36Å; S435-Q437 PolarHBondContact O-N 2.91Å; S435-Q437 PolarHBondContact OG-N 2.83Å; S435-R438 PolarHBondContact N-O 2.94Å; S435-R438 PolarHBondContact O-N 2.9Å
436	T	85.2	Confident	89.8	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.092	23%	0.227	C	C	.	.	S	Bend	trans	-53.9	-19.5	173.8	57.6	0	0	0	0	113.8	L367 I368 L455 V523 A524	L367-T436 PolarHBondContact O-N 3.46Å; I368-T436 HydrophobicContact CG1-CG2 3.95Å; T436-L455 VanDerWaalsContact O-CD2 3.31Å; T436-L455 WeakPolarHBondContact O-CD2 3.15Å; T436-V523 HydrophobicContact CG2-CB 4.03Å; T436-V523 HydrophobicContact CG2-CG1 3.51Å; T436-A524 HydrophobicContact CG2-CB 4.15Å
437	Q	82.1	Confident	91.2	Very high	115 Å²	115	45 Å²	45	54%	0.537	23%	0.231	S	C	.	.	S	Bend	trans	-97.1	-38.6	-178.7	-57.7	-177.9	26.6	0	0	113.9	S435 A454 L455	S435-Q437 PolarHBondContact O-N 2.91Å; S435-Q437 PolarHBondContact OG-N 2.83Å; Q437-A454 WeakPolarHBondContact O-CA 3.29Å; Q437-L455 PolarHBondContact O-N 3.32Å
438	R	89.8	Confident	92.3	Very high	86 Å²	86	49.8 Å²	49.8	33%	0.325	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	161	-167.5	69.4	-174	78.2	-152.5	6.5	113.2	F433 S435 K440 D452 H453	F433-R438 HydrophobicContact CD1-CG 4.45Å; F433-R438 HydrophobicContact CE1-CG 4.03Å; S435-R438 PolarHBondContact N-O 2.94Å; S435-R438 PolarHBondContact O-N 2.9Å; R438-K440 HydrophobicContact CG-CG 4.43Å; R438-D452 IonicContact CZ-OD2 3.9Å; R438-D452 IonicContact NH1-OD1 3.61Å; R438-D452 IonicContact NH1-OD2 3.9Å; R438-D452 PolarHBondContact NH1-OD2 3.4Å; R438-H453 CarbonylContact C-O 3.6Å; R438-H453 VanDerWaalsContact CA-O 3.3Å; R438-H453 WeakPolarHBondContact CA-O 3.23Å; R438-H453 WeakPolarHBondContact CB-O 3.36Å
439	I	92.6	Very high	92.5	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.9	160.3	-58.5	-175.2	0	0	0	108	L432 F433 I434 H453 L455 I458 L470 I517	L432-I439 HydrophobicContact CD1-CG2 3.64Å; L432-I439 HydrophobicContact CG-CG2 4.39Å; F433-I439 CarbonylContact O-C 3.51Å; F433-I439 VanDerWaalsContact O-CA 3.26Å; F433-I439 WeakPolarHBondContact O-CA 3.24Å; I434-I439 HydrophobicContact CG1-CG1 4.45Å; I434-I439 HydrophobicContact CG1-CG2 4.47Å; I434-I439 HydrophobicContact CG2-CG1 4.48Å; I439-H453 PolarHBondContact N-O 3.3Å; I439-H453 PolarHBondContact O-N 3.18Å; I439-L455 HydrophobicContact CD1-CD1 4.31Å; I439-L455 HydrophobicContact CG1-CD1 4.02Å; I439-I458 HydrophobicContact CB-CD1 4.5Å; I439-I458 HydrophobicContact CD1-CD1 3.49Å; I439-I458 VanDerWaalsContact CD1-CD1 3.49Å; I439-I458 HydrophobicContact CG1-CD1 3.91Å; I439-L470 HydrophobicContact CD1-CD1 4.03Å; I439-L470 HydrophobicContact CD1-CD2 4.49Å; I439-L470 HydrophobicContact CG2-CD2 4.27Å; I439-I517 HydrophobicContact CD1-CB 4.42Å; I439-I517 HydrophobicContact CD1-CD1 3.68Å; I439-I517 HydrophobicContact CD1-CG1 3.67Å; I439-I517 HydrophobicContact CD1-CG2 3.91Å
440	K	94.4	Very high	92.4	Very high	55 Å²	55	49.8 Å²	49.8	24%	0.239	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.7	171.8	-78	179.6	168.5	-169.8	0	110.4	F433 R438 L442 T449 M451 D452	F433-K440 HydrophobicContact CB-CB 4.1Å; F433-K440 HydrophobicContact CD1-CB 4.14Å; F433-K440 HydrophobicContact CD1-CD 4.48Å; F433-K440 HydrophobicContact CD1-CG 4.47Å; F433-K440 PolarHBondContact N-O 2.89Å; F433-K440 PolarHBondContact O-N 3.39Å; R438-K440 HydrophobicContact CG-CG 4.43Å; K440-L442 HydrophobicContact CB-CD1 3.92Å; K440-T449 HydrophobicContact CD-CG2 4.31Å; K440-T449 HydrophobicContact CG-CG2 4.36Å; K440-M451 CarbonylContact C-O 3.52Å; K440-M451 VanDerWaalsContact CA-O 3.24Å; K440-M451 WeakPolarHBondContact CA-O 3.49Å; K440-D452 WeakPolarHBondContact CE-OD2 3.47Å; K440-D452 HydrophobicContact CG-CB 3.93Å; K440-D452 IonicContact NZ-OD2 3.23Å
441	V	95.4	Very high	92.1	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.8	166.3	-175.7	0	0	0	0	106.5	V430 L432 T449 M450 M451 F505	V430-V441 HydrophobicContact CB-CG1 3.71Å; V430-V441 HydrophobicContact CG1-CG1 3.75Å; V430-V441 HydrophobicContact CG2-CG1 3.95Å; L432-V441 HydrophobicContact CD1-CG2 3.9Å; V441-T449 CarbonylContact O-C 3.42Å; V441-M450 HydrophobicContact CB-CB 4.48Å; V441-M450 HydrophobicContact CG1-CB 4.33Å; V441-M450 PolarHBondContact O-N 3Å; V441-M451 HydrophobicContact CB-CB 3.92Å; V441-M451 HydrophobicContact CB-CG 4.03Å; V441-M451 HydrophobicContact CB-SD 4.38Å; V441-M451 HydrophobicContact CG2-CB 3.95Å; V441-M451 HydrophobicContact CG2-CG 4.1Å; V441-M451 HydrophobicContact CG2-SD 3.9Å; V441-M451 PolarHBondContact N-O 3.49Å; V441-M451 PolarHBondContact O-N 3.42Å; V441-M451 VanDerWaalsContact O-N 3.09Å; V441-F505 HydrophobicContact CG1-CE1 4.08Å; V441-F505 HydrophobicContact CG2-CE1 3.74Å; V441-F505 HydrophobicContact CG2-CZ 3.66Å
442	L	94.5	Very high	91.8	Very high	24 Å²	24	52.7 Å²	52.7	13%	0.126	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	146.2	174.1	-53.4	90.8	0	0	0	108.7	V430 D431 F433 K440 E448	V430-L442 CarbonylContact C-O 3.57Å; V430-L442 WeakPolarHBondContact CA-O 3.3Å; V430-L442 WeakPolarHBondContact CB-O 3.26Å; D431-L442 HydrophobicContact CB-CB 4.33Å; D431-L442 PolarHBondContact N-O 3.28Å; D431-L442 PolarHBondContact O-N 3.02Å; F433-L442 HydrophobicContact CB-CD1 3.86Å; K440-L442 HydrophobicContact CB-CD1 3.92Å; L442-E448 CarbonylContact C-O 3.42Å; L442-E448 VanDerWaalsContact CA-O 3.28Å; L442-E448 WeakPolarHBondContact CA-O 3.28Å
443	N	93.6	Very high	91.3	Very high	24 Å²	24	54 Å²	54	13%	0.128	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132.5	167.9	170.7	-106.9	0	0	0	109.4	E429 D445 T446 Q447 E448 M450	E429-N443 PolarHBondContact O-ND2 3.35Å; N443-D445 PolarHBondContact O-N 2.87Å; N443-D445 PolarHBondContact OD1-N 2.9Å; N443-T446 WeakPolarHBondContact OD1-CG2 3.35Å; N443-T446 PolarHBondContact OD1-N 3.44Å; N443-T446 PolarHBondContact OD1-OG1 2.91Å; N443-T446 VanDerWaalsContact OD1-OG1 3.08Å; N443-Q447 WeakPolarHBondContact O-CA 3.27Å; N443-Q447 PolarHBondContact O-N 3.34Å; N443-E448 PolarHBondContact N-O 3.38Å; N443-M450 HydrophobicContact CB-CG 4.26Å; N443-M450 HydrophobicContact CB-SD 3.91Å
444	A	92	Very high	90.7	Very high	35 Å²	35	53.2 Å²	53.2	29%	0.289	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-43.2	-173.3	0	0	0	0	0	112.8	E429 Q447	E429-A444 HydrophobicContact CB-CB 4.31Å; E429-A444 PolarHBondContact O-N 2.94Å; E429-A444 VanDerWaalsContact O-N 3.13Å; A444-Q447 PolarHBondContact O-NE2 2.97Å
445	D	91.5	Very high	90	Very high	144 Å²	144	53.5 Å²	53.5	77%	0.77	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-46.3	-178	-58.9	-70.5	0	0	0	113.5	N443	N443-D445 PolarHBondContact O-N 2.87Å; N443-D445 PolarHBondContact OD1-N 2.9Å
446	T	91.6	Very high	89.3	Confident	89 Å²	89	59.1 Å²	59.1	55%	0.546	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-15.2	-172.9	68.7	0	0	0	0	114.1	N443 E448	N443-T446 WeakPolarHBondContact OD1-CG2 3.35Å; N443-T446 PolarHBondContact OD1-N 3.44Å; N443-T446 PolarHBondContact OD1-OG1 2.91Å; N443-T446 VanDerWaalsContact OD1-OG1 3.08Å; T446-E448 PolarHBondContact O-N 3.17Å; T446-E448 VanDerWaalsContact O-N 3.12Å; T446-E448 VanDerWaalsContact OG1-CB 3.25Å; T446-E448 WeakPolarHBondContact OG1-CB 3.43Å; T446-E448 PolarHBondContact OG1-N 3.38Å
447	Q	91.2	Very high	89	Confident	95 Å²	95	60 Å²	60	44%	0.444	30%	0.303	S	S	.	.			trans	54.8	19.4	-168.5	-61.9	-67.4	-51.7	0	0	113.7	D431 N443 A444	D431-Q447 PolarHBondContact OD2-NE2 2.93Å; N443-Q447 WeakPolarHBondContact O-CA 3.27Å; N443-Q447 PolarHBondContact O-N 3.34Å; A444-Q447 PolarHBondContact O-NE2 2.97Å
448	E	92.3	Very high	89.1	Confident	140 Å²	140	54.6 Å²	54.6	65%	0.654	28%	0.279	S	S	*	.			trans	-71.7	131.4	175.1	-171.1	179	176.7	0	0	110.3	L442 N443 T446 M450	L442-E448 CarbonylContact C-O 3.42Å; L442-E448 VanDerWaalsContact CA-O 3.28Å; L442-E448 WeakPolarHBondContact CA-O 3.28Å; N443-E448 PolarHBondContact N-O 3.38Å; T446-E448 PolarHBondContact O-N 3.17Å; T446-E448 VanDerWaalsContact O-N 3.12Å; T446-E448 VanDerWaalsContact OG1-CB 3.25Å; T446-E448 WeakPolarHBondContact OG1-CB 3.43Å; T446-E448 PolarHBondContact OG1-N 3.38Å; E448-M450 PolarHBondContact O-N 3.28Å
449	T	91.1	Very high	88.6	Confident	65 Å²	65	51.1 Å²	51.1	40%	0.399	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	97	-179.7	-60.2	0	0	0	0	110.6	K440 V441 M451 D452	K440-T449 HydrophobicContact CD-CG2 4.31Å; K440-T449 HydrophobicContact CG-CG2 4.36Å; V441-T449 CarbonylContact O-C 3.42Å; T449-M451 VanDerWaalsContact C-N 3.33Å; T449-M451 WeakPolarHBondContact CG2-O 3.38Å; T449-D452 HydrophobicContact CG2-CB 4.26Å
450	M	90.1	Very high	88.2	Confident	77 Å²	77	51.4 Å²	51.4	38%	0.379	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-31.4	174.9	-60.3	179	68.5	0	0	112.5	Y377 T428 V430 V441 N443 E448	Y377-M450 HydrophobicContact CD1-CE 3.92Å; Y377-M450 HydrophobicContact CE1-CE 4.17Å; T428-M450 HydrophobicContact CG2-CE 4.06Å; T428-M450 HydrophobicContact CG2-SD 4.06Å; V430-M450 HydrophobicContact CG1-SD 3.58Å; V430-M450 VanDerWaalsContact CG1-SD 3.58Å; V441-M450 HydrophobicContact CB-CB 4.48Å; V441-M450 HydrophobicContact CG1-CB 4.33Å; V441-M450 PolarHBondContact O-N 3Å; N443-M450 HydrophobicContact CB-CG 4.26Å; N443-M450 HydrophobicContact CB-SD 3.91Å; E448-M450 PolarHBondContact O-N 3.28Å
451	M	90.5	Very high	87.9	Confident	27 Å²	27	48.8 Å²	48.8	13%	0.133	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	143.7	178.6	-49.5	-177.2	-171.8	0	0	111.5	Y377 K440 V441 T449 H503	Y377-M451 HydrophobicContact CD2-CE 4.19Å; Y377-M451 HydrophobicContact CE1-CE 4.26Å; Y377-M451 HydrophobicContact CE2-CE 3.46Å; Y377-M451 VanDerWaalsContact CE2-CE 3.46Å; Y377-M451 VanDerWaalsContact CZ-CE 3.49Å; K440-M451 CarbonylContact C-O 3.52Å; K440-M451 VanDerWaalsContact CA-O 3.24Å; K440-M451 WeakPolarHBondContact CA-O 3.49Å; V441-M451 HydrophobicContact CB-CB 3.92Å; V441-M451 HydrophobicContact CB-CG 4.03Å; V441-M451 HydrophobicContact CB-SD 4.38Å; V441-M451 HydrophobicContact CG2-CB 3.95Å; V441-M451 HydrophobicContact CG2-CG 4.1Å; V441-M451 HydrophobicContact CG2-SD 3.9Å; V441-M451 PolarHBondContact N-O 3.49Å; V441-M451 PolarHBondContact O-N 3.42Å; V441-M451 VanDerWaalsContact O-N 3.09Å; T449-M451 VanDerWaalsContact C-N 3.33Å; T449-M451 WeakPolarHBondContact CG2-O 3.38Å; M451-H503 WeakPolarHBondContact CE-ND1 3.46Å; M451-H503 HydrophobicContact SD-CB 4.46Å; M451-H503 PolarHBondContact SD-CE1 3.35Å; M451-H503 PolarHBondContact SD-ND1 3.37Å
452	D	91.2	Very high	87.6	Confident	68 Å²	68	48.8 Å²	48.8	36%	0.364	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	118.3	164.3	-171	-24.4	0	0	0	108.7	R438 K440 T449	R438-D452 IonicContact CZ-OD2 3.9Å; R438-D452 IonicContact NH1-OD1 3.61Å; R438-D452 IonicContact NH1-OD2 3.9Å; R438-D452 PolarHBondContact NH1-OD2 3.4Å; K440-D452 WeakPolarHBondContact CE-OD2 3.47Å; K440-D452 HydrophobicContact CG-CB 3.93Å; K440-D452 IonicContact NZ-OD2 3.23Å; T449-D452 HydrophobicContact CG2-CB 4.26Å
453	H	84.9	Confident	87.5	Confident	29 Å²	29	47.9 Å²	47.9	13%	0.134	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	111.9	174.1	-69.3	-76.6	0	0	0	109.5	R438 I439 L455 H503	R438-H453 CarbonylContact C-O 3.6Å; R438-H453 VanDerWaalsContact CA-O 3.3Å; R438-H453 WeakPolarHBondContact CA-O 3.23Å; R438-H453 WeakPolarHBondContact CB-O 3.36Å; I439-H453 PolarHBondContact N-O 3.3Å; I439-H453 PolarHBondContact O-N 3.18Å; H453-L455 PolarHBondContact O-N 3.18Å; H453-H503 AromaticContact CD2-NE2 4Å; H453-H503 AromaticContact CE1-NE2 3.5Å; H453-H503 PolarHBondContact CE1-NE2 2.84Å; H453-H503 AromaticContact NE2-CD2 3.56Å; H453-H503 AromaticContact NE2-CE1 3.76Å; H453-H503 AromaticContact NE2-NE2 2.9Å; H453-H503 PolarHBondContact NE2-NE2 3.09Å
454	A	82.3	Confident	87.4	Confident	25 Å²	25	48.8 Å²	48.8	21%	0.207	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	133.7	169	0	0	0	0	0	110.3	Q437 R456 T457	Q437-A454 WeakPolarHBondContact O-CA 3.29Å; A454-R456 HydrophobicContact CB-CG 4.28Å; A454-R456 PolarHBondContact O-N 3.26Å; A454-T457 HydrophobicContact CB-CG2 4.4Å; A454-T457 PolarHBondContact O-N 3.35Å; A454-T457 PolarHBondContact O-OG1 3.28Å
455	L	80.7	Confident	87.4	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-52.7	-37.7	-163.3	-168.5	71.3	0	0	0	112.3	T436 Q437 I439 H453 T457 I458 A520 F521 A524	T436-L455 VanDerWaalsContact O-CD2 3.31Å; T436-L455 WeakPolarHBondContact O-CD2 3.15Å; Q437-L455 PolarHBondContact O-N 3.32Å; I439-L455 HydrophobicContact CD1-CD1 4.31Å; I439-L455 HydrophobicContact CG1-CD1 4.02Å; H453-L455 PolarHBondContact O-N 3.18Å; L455-T457 VanDerWaalsContact C-N 3.31Å; L455-T457 PolarHBondContact O-N 3.3Å; L455-I458 HydrophobicContact CD1-CD1 4.04Å; L455-I458 WeakPolarHBondContact O-CB 3.4Å; L455-I458 PolarHBondContact O-N 2.99Å; L455-A520 HydrophobicContact CD2-CB 4.34Å; L455-F521 HydrophobicContact CD1-CD2 4.34Å; L455-F521 HydrophobicContact CD1-CE1 4.23Å; L455-F521 HydrophobicContact CD1-CE2 3.8Å; L455-F521 HydrophobicContact CD1-CZ 3.73Å; L455-F521 HydrophobicContact CD2-CD1 4.06Å; L455-F521 HydrophobicContact CD2-CE1 4.19Å; L455-F521 HydrophobicContact CD2-CG 4.29Å; L455-F521 HydrophobicContact CD2-CZ 4.47Å; L455-F521 HydrophobicContact CG-CD1 4Å; L455-F521 HydrophobicContact CG-CD2 4.48Å; L455-F521 HydrophobicContact CG-CE1 3.6Å; L455-F521 HydrophobicContact CG-CE2 4.09Å; L455-F521 HydrophobicContact CG-CG 4.41Å; L455-F521 HydrophobicContact CG-CZ 3.62Å; L455-F521 VanDerWaalsContact O-CE1 3.29Å; L455-F521 WeakPolarHBondContact O-CE1 3.34Å; L455-F521 VanDerWaalsContact O-CZ 3.23Å; L455-F521 WeakPolarHBondContact O-CZ 3.45Å; L455-A524 HydrophobicContact CD2-CB 4.09Å
456	R	77.3	Confident	87.5	Confident	121 Å²	121	46.9 Å²	46.9	46%	0.457	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-58.4	-23	175.1	61.5	175.8	-179.3	-79	1.4	117	E106 A454 R473	E106-R456 WeakPolarHBondContact OE2-CD 3.34Å; E106-R456 IonicContact OE2-NE 2.81Å; E106-R456 PolarHBondContact OE2-NE 3.41Å; A454-R456 HydrophobicContact CB-CG 4.28Å; A454-R456 PolarHBondContact O-N 3.26Å; R456-R473 PolarHBondContact O-NH2 2.85Å
457	T	79.6	Confident	87.7	Confident	33 Å²	33	42.8 Å²	42.8	20%	0.202	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-79.7	-26.4	-176.1	68	0	0	0	0	112.5	A454 L455 R473	A454-T457 HydrophobicContact CB-CG2 4.4Å; A454-T457 PolarHBondContact O-N 3.35Å; A454-T457 PolarHBondContact O-OG1 3.28Å; L455-T457 VanDerWaalsContact C-N 3.31Å; L455-T457 PolarHBondContact O-N 3.3Å; T457-R473 WeakPolarHBondContact O-CB 3.46Å; T457-R473 PolarHBondContact O-N 2.81Å; T457-R473 PolarHBondContact O-NE 3.06Å
458	I	83.8	Confident	87.8	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	141.7	175.5	-57.3	159.7	0	0	0	108.5	I101 I439 L455 L470 R473 F521	I101-I458 HydrophobicContact CD1-CG2 3.88Å; I439-I458 HydrophobicContact CB-CD1 4.5Å; I439-I458 HydrophobicContact CD1-CD1 3.49Å; I439-I458 VanDerWaalsContact CD1-CD1 3.49Å; I439-I458 HydrophobicContact CG1-CD1 3.91Å; L455-I458 HydrophobicContact CD1-CD1 4.04Å; L455-I458 WeakPolarHBondContact O-CB 3.4Å; L455-I458 PolarHBondContact O-N 2.99Å; I458-L470 HydrophobicContact CD1-CD1 3.9Å; I458-L470 HydrophobicContact CG1-CD1 3.95Å; I458-L470 HydrophobicContact CG2-CD1 3.75Å; I458-R473 PolarHBondContact O-NH2 3.45Å; I458-F521 HydrophobicContact CB-CZ 4.02Å; I458-F521 HydrophobicContact CD1-CE2 4.47Å; I458-F521 HydrophobicContact CD1-CZ 4.05Å; I458-F521 HydrophobicContact CG2-CZ 4.28Å
459	S	80.2	Confident	88	Confident	12 Å²	12	31.6 Å²	31.6	8%	0.084	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-20	177.9	178.4	0	0	0	0	112.8	Y103 R394 M471	Y103-S459 PolarHBondContact OH-OG 2.98Å; R394-S459 PolarHBondContact NE-OG 2.85Å; R394-S459 PolarHBondContact NH2-OG 3.2Å; S459-M471 PolarHBondContact N-O 2.87Å
460	Y	84.6	Confident	88.1	Confident	7 Å²	7	28.6 Å²	28.6	3%	0.027	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	147.2	179.3	-170.3	-118.5	0	0	0	110.4	R394 A398 A462 M471	R394-Y460 HydrophobicContact CB-CD1 3.93Å; R394-Y460 HydrophobicContact CB-CD2 3.92Å; R394-Y460 HydrophobicContact CB-CE1 4.1Å; R394-Y460 HydrophobicContact CB-CE2 4.13Å; R394-Y460 HydrophobicContact CB-CG 3.83Å; R394-Y460 HydrophobicContact CG-CD2 4.36Å; R394-Y460 HydrophobicContact CG-CG 4.18Å; A398-Y460 HydrophobicContact CB-CD1 4.4Å; A398-Y460 HydrophobicContact CB-CE1 4.1Å; Y460-A462 HydrophobicContact CD1-CB 4.49Å; Y460-A462 HydrophobicContact CE1-CB 3.7Å; Y460-M471 HydrophobicContact CD1-CG 4.3Å; Y460-M471 HydrophobicContact CD1-SD 3.63Å; Y460-M471 HydrophobicContact CG-SD 4.19Å; Y460-M471 PolarHBondContact N-O 3.07Å; Y460-M471 PolarHBondContact O-N 3.38Å
461	I	88.5	Confident	88.1	Confident	1 Å²	1	25 Å²	25	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.6	170.9	-173.6	58.2	0	0	0	106.9	I101 V468 V469 L470 A514 I517	I101-I461 HydrophobicContact CD1-CB 4.27Å; I101-I461 HydrophobicContact CD1-CG2 3.74Å; I101-I461 HydrophobicContact CG1-CG2 4.19Å; I461-V468 HydrophobicContact CD1-CG1 3.56Å; I461-V469 WeakPolarHBondContact CA-O 3.49Å; I461-L470 HydrophobicContact CD1-CB 4.31Å; I461-L470 HydrophobicContact CD1-CD1 3.98Å; I461-A514 HydrophobicContact CG1-CB 4.39Å; I461-I517 HydrophobicContact CB-CG2 4.25Å; I461-I517 HydrophobicContact CD1-CD1 3.75Å; I461-I517 HydrophobicContact CG1-CB 4.3Å; I461-I517 HydrophobicContact CG1-CD1 3.98Å; I461-I517 HydrophobicContact CG1-CG2 4.07Å; I461-I517 HydrophobicContact CG2-CG2 4.19Å
462	A	88.5	Confident	87.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	138.7	170.8	0	0	0	0	0	110.6	M395 Y460 V469	M395-A462 HydrophobicContact CE-CB 4.18Å; Y460-A462 HydrophobicContact CD1-CB 4.49Å; Y460-A462 HydrophobicContact CE1-CB 3.7Å; A462-V469 PolarHBondContact N-O 3.32Å; A462-V469 PolarHBondContact O-N 3.03Å
463	D	91.7	Very high	87.2	Confident	6 Å²	6	24.4 Å²	24.4	3%	0.032	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	142.2	154.2	51.2	-61.8	0	0	0	110.4	I467 A514	D463-I467 CarbonylContact C-O 3.47Å; D463-I467 WeakPolarHBondContact CA-O 3.44Å; D463-A514 HydrophobicContact CB-CB 3.96Å; D463-A514 WeakPolarHBondContact OD1-CB 3.36Å
464	I	91.4	Very high	86.2	Confident	43 Å²	43	28.6 Å²	28.6	22%	0.221	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	76.2	176.3	-52.9	-177.7	0	0	0	106.9	M395 A398 V402 I467 V469	M395-I464 HydrophobicContact SD-CD1 4.15Å; A398-I464 HydrophobicContact CB-CD1 4.33Å; V402-I464 HydrophobicContact CG2-CD1 4.35Å; I464-I467 HydrophobicContact CB-CB 4.49Å; I464-I467 PolarHBondContact N-O 3.43Å; I464-I467 WeakPolarHBondContact O-CB 3.32Å; I464-I467 PolarHBondContact O-N 2.85Å; I464-V469 HydrophobicContact CD1-CG2 3.88Å; I464-V469 HydrophobicContact CG1-CG2 4.37Å
465	G	92.1	Very high	84.7	Confident	62 Å²	62	32.7 Å²	32.7	64%	0.639	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	-132.8	-164.1	0	0	0	0	0	110.7	I467 A510	G465-I467 PolarHBondContact O-N 2.96Å; G465-A510 WeakPolarHBondContact O-CB 3.47Å
466	N	93.8	Very high	82.6	Confident	77 Å²	77	37.1 Å²	37.1	41%	0.412	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	13.9	178.1	78.4	-35.3	0	0	0	115.1	E506 S507	N466-E506 WeakPolarHBondContact ND2-CG 3.09Å; N466-E506 PolarHBondContact ND2-OE1 3.24Å; N466-E506 CarbonylContact O-C 3.53Å; N466-E506 VanDerWaalsContact O-CA 3.31Å; N466-E506 WeakPolarHBondContact O-CA 2.89Å; N466-S507 CarbonylContact C-O 3.49Å; N466-S507 WeakPolarHBondContact CA-O 3.17Å; N466-S507 PolarHBondContact O-N 2.66Å; N466-S507 VanDerWaalsContact O-O 3.07Å
467	I	95	Very high	80.5	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.1	-174.6	-59.5	-58.7	0	0	0	111.1	L378 V402 K406 D463 I464 G465 V469 V504 F505 E506	L378-I467 HydrophobicContact CD1-CD1 3.84Å; V402-I467 HydrophobicContact CG1-CG2 4.3Å; V402-I467 HydrophobicContact CG2-CG2 3.79Å; K406-I467 VanDerWaalsContact CE-CD1 3.44Å; K406-I467 VanDerWaalsContact NZ-CG1 3.26Å; D463-I467 CarbonylContact C-O 3.47Å; D463-I467 WeakPolarHBondContact CA-O 3.44Å; I464-I467 HydrophobicContact CB-CB 4.49Å; I464-I467 PolarHBondContact N-O 3.43Å; I464-I467 WeakPolarHBondContact O-CB 3.32Å; I464-I467 PolarHBondContact O-N 2.85Å; G465-I467 PolarHBondContact O-N 2.96Å; I467-V469 HydrophobicContact CG2-CG2 4.03Å; I467-V504 HydrophobicContact CG2-CG1 3.65Å; I467-F505 CarbonylContact C-O 3.57Å; I467-F505 VanDerWaalsContact CA-O 3.29Å; I467-F505 WeakPolarHBondContact CA-O 3.26Å; I467-F505 WeakPolarHBondContact CG2-O 3.46Å; I467-E506 HydrophobicContact CD1-CB 3.7Å; I467-E506 HydrophobicContact CD1-CG 3.85Å
468	V	95.1	Very high	78.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.6	170.6	-175.4	0	0	0	0	109.6	I461 F505 A510 I513	I461-V468 HydrophobicContact CD1-CG1 3.56Å; V468-F505 HydrophobicContact CB-CB 4.37Å; V468-F505 PolarHBondContact N-O 2.76Å; V468-F505 PolarHBondContact O-N 3.02Å; V468-A510 HydrophobicContact CG2-CB 3.61Å; V468-I513 HydrophobicContact CB-CG2 4.49Å; V468-I513 HydrophobicContact CG1-CG2 3.94Å; V468-I513 HydrophobicContact CG2-CB 4.08Å; V468-I513 HydrophobicContact CG2-CD1 4.27Å; V468-I513 HydrophobicContact CG2-CG2 3.91Å
469	V	94.9	Very high	75.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	105	178.6	-167.8	0	0	0	0	111	A398 V402 I461 A462 I464 I467 M471	A398-V469 HydrophobicContact CB-CB 4.15Å; A398-V469 HydrophobicContact CB-CG1 3.81Å; A398-V469 HydrophobicContact CB-CG2 4.4Å; V402-V469 HydrophobicContact CG2-CG2 3.33Å; I461-V469 WeakPolarHBondContact CA-O 3.49Å; A462-V469 PolarHBondContact N-O 3.32Å; A462-V469 PolarHBondContact O-N 3.03Å; I464-V469 HydrophobicContact CD1-CG2 3.88Å; I464-V469 HydrophobicContact CG1-CG2 4.37Å; I467-V469 HydrophobicContact CG2-CG2 4.03Å; V469-M471 HydrophobicContact CG1-CG 4.38Å
470	L	93.3	Very high	73.5	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	112.1	177.3	-175.3	69.7	0	0	0	110.3	I439 I458 I461 C502 H503 F505	I439-L470 HydrophobicContact CD1-CD1 4.03Å; I439-L470 HydrophobicContact CD1-CD2 4.49Å; I439-L470 HydrophobicContact CG2-CD2 4.27Å; I458-L470 HydrophobicContact CD1-CD1 3.9Å; I458-L470 HydrophobicContact CG1-CD1 3.95Å; I458-L470 HydrophobicContact CG2-CD1 3.75Å; I461-L470 HydrophobicContact CD1-CB 4.31Å; I461-L470 HydrophobicContact CD1-CD1 3.98Å; L470-C502 WeakPolarHBondContact O-CA 3.5Å; L470-H503 HydrophobicContact CB-CB 4.37Å; L470-H503 PolarHBondContact N-O 3.38Å; L470-H503 PolarHBondContact O-N 2.78Å; L470-F505 HydrophobicContact CB-CE2 4.1Å
471	M	90.2	Very high	71.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	106.9	177.3	-58.2	-175	67.7	0	0	111.1	L383 Q397 A398 S459 Y460 V469 M500 C502	L383-M471 HydrophobicContact CD1-CE 4.08Å; L383-M471 HydrophobicContact CD2-CE 4.25Å; Q397-M471 HydrophobicContact CB-CE 3.79Å; Q397-M471 HydrophobicContact CB-SD 4.46Å; A398-M471 HydrophobicContact CB-SD 4.36Å; S459-M471 PolarHBondContact N-O 2.87Å; Y460-M471 HydrophobicContact CD1-CG 4.3Å; Y460-M471 HydrophobicContact CD1-SD 3.63Å; Y460-M471 HydrophobicContact CG-SD 4.19Å; Y460-M471 PolarHBondContact N-O 3.07Å; Y460-M471 PolarHBondContact O-N 3.38Å; V469-M471 HydrophobicContact CG1-CG 4.38Å; M471-M500 HydrophobicContact CB-CE 3.97Å; M471-M500 HydrophobicContact CE-CB 4.48Å; M471-M500 HydrophobicContact CE-CG 4.49Å; M471-C502 HydrophobicContact CG-CB 4.46Å
472	A	84.9	Confident	68.6	Low	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.9	177.6	0	0	0	0	0	112.6	R474 M500 I501	A472-R474 PolarHBondContact O-N 3.39Å; A472-M500 VanDerWaalsContact C-CE 3.49Å; A472-M500 WeakPolarHBondContact O-CE 3.23Å; A472-I501 HydrophobicContact CB-CG2 4.03Å; A472-I501 PolarHBondContact N-O 3.38Å; A472-I501 WeakPolarHBondContact O-CG2 3.29Å; A472-I501 PolarHBondContact O-N 3.42Å
473	R	77.8	Confident	65.9	Low	83 Å²	83	70.2 Å²	70.2	31%	0.313	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	111.2	168.8	-75.1	167.4	-78.3	-170.2	-8.7	108.6	Y103 R456 T457 I458 R475 M500	Y103-R473 VanDerWaalsContact CE1-NH1 3.34Å; R456-R473 PolarHBondContact O-NH2 2.85Å; T457-R473 WeakPolarHBondContact O-CB 3.46Å; T457-R473 PolarHBondContact O-N 2.81Å; T457-R473 PolarHBondContact O-NE 3.06Å; I458-R473 PolarHBondContact O-NH2 3.45Å; R473-R475 PolarHBondContact O-N 3.08Å; R473-M500 HydrophobicContact CG-CE 4.07Å; R473-M500 HydrophobicContact CG-SD 3.7Å
474	R	65	Low	63.2	Low	118 Å²	118	74.5 Å²	74.5	45%	0.445	41%	0.405	S	S	.	.			trans	-76.4	113.8	177.2	-173.4	176.5	-173.2	-174.1	2.9	109.8	A472 M476 I501	A472-R474 PolarHBondContact O-N 3.39Å; R474-M476 PolarHBondContact O-N 3.02Å; R474-I501 HydrophobicContact CB-CB 4.37Å; R474-I501 HydrophobicContact CB-CG2 4.04Å
475	R	51.2	Low	60.9	Low	111 Å²	111	79.1 Å²	79.1	42%	0.419	43%	0.428	S	S	.	.			trans	-64.4	114.4	157.7	-74.8	-170.5	175.3	175.8	2.1	107.8	D108 L111 R473	D108-R475 IonicContact OD1-CZ 3.81Å; D108-R475 IonicContact OD1-NE 3.32Å; D108-R475 PolarHBondContact OD1-NE 2.71Å; D108-R475 IonicContact OD1-NH2 3.74Å; D108-R475 PolarHBondContact OD1-NH2 2.75Å; L111-R475 VanDerWaalsContact CB-NH1 3.27Å; L111-R475 VanDerWaalsContact CD1-NH1 3.31Å; R473-R475 PolarHBondContact O-N 3.08Å
476	M	35.9	Very low	58.2	Low	97 Å²	97	84.7 Å²	84.7	48%	0.478	44%	0.438	S	S	.	.			trans	-87.1	121.7	176.9	-164.3	76.9	137.8	0	0	108.2	R474 R478	R474-M476 PolarHBondContact O-N 3.02Å; M476-R478 PolarHBondContact O-N 2.83Å
477	P	33.6	Very low	55.3	Low	101 Å²	101	87.5 Å²	87.5	66%	0.656	46%	0.458	S	S	*	.			trans	-59.1	122.2	163.3	-17.2	30.7	0	0	0	107.6	S479	P477-S479 PolarHBondContact O-N 3.06Å
478	R	32.9	Very low	52.2	Low	227 Å²	227	93.1 Å²	93.1	86%	0.857	49%	0.492	S	S	*	.			trans	-72.6	95	179.2	-83	-170	170.5	100.4	-5.9	110	M476 A480	M476-R478 PolarHBondContact O-N 2.83Å; R478-A480 PolarHBondContact O-N 3.04Å
479	S	30	Very low	49.2	Very low	81 Å²	81	99.5 Å²	99.5	57%	0.566	53%	0.534	S	S	*	.			trans	-61.6	113.2	155.1	52.4	0	0	0	0	108.3	P477 S481	P477-S479 PolarHBondContact O-N 3.06Å; S479-S481 PolarHBondContact O-N 3.01Å
480	A	33.3	Very low	46.4	Very low	103 Å²	103	103.2 Å²	103.2	85%	0.851	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	35.6	-168.9	0	0	0	0	0	115	R478	R478-A480 PolarHBondContact O-N 3.04Å
481	S	35.6	Very low	43.4	Very low	79 Å²	79	107 Å²	107	55%	0.552	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	15.6	-167	65	0	0	0	0	114.2	S479	S479-S481 PolarHBondContact O-N 3.01Å
482	Q	34.1	Very low	40.6	Very low	134 Å²	134	115.9 Å²	115.9	63%	0.626	65%	0.645	S	S	*	*	S	Bend	trans	-123.9	0.2	-178.2	-153	64.6	64.9	0	0	114.4	C484	Q482-C484 PolarHBondContact O-N 3.15Å
483	D	32.7	Very low	38.5	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	69%	0.69	S	S	*	*	S	Bend	trans	-82.1	14.9	175.3	-67.5	-46.6	0	0	0	113.1
484	C	35.2	Very low	36.6	Very low	96 Å²	96	124.7 Å²	124.7	65%	0.649	71%	0.708	S	S	*	*	S	Bend	trans	-124.9	24.6	-167	63.3	0	0	0	0	115.8	Q482	Q482-C484 PolarHBondContact O-N 3.15Å
485	I	43.3	Very low	35.6	Very low	139 Å²	139	125.7 Å²	125.7	71%	0.713	72%	0.716	S	S	*	*	S	Bend	trans	-143.8	45.8	170.1	-23.4	172	0	0	0	114.9
486	E	34	Very low	35.5	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	73%	0.734	S	S	*	*			trans	-150.3	66.3	160.9	-158.3	161.9	-151.6	0	0	113.2
487	T	34.4	Very low	36.5	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	73%	0.734	S	S	*	*			trans	-128.1	63.6	173.9	58.4	0	0	0	0	112.1
488	T	29.4	Very low	38.1	Very low	120 Å²	120	130 Å²	130	74%	0.736	72%	0.724	S	S	*	*			trans	-105.7	110.1	163.7	-57.9	0	0	0	0	108.3	G490	T488-G490 PolarHBondContact O-N 3.34Å; T488-G490 VanDerWaalsContact O-N 3.12Å
489	P	32.5	Very low	40.2	Very low	136 Å²	136	124.9 Å²	124.9	88%	0.883	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	109.3	-178.9	28.2	-32.8	0	0	0	110.2
490	G	34.3	Very low	42.7	Very low	77 Å²	77	121.2 Å²	121.2	79%	0.794	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	148.4	-12.9	179.4	0	0	0	0	0	115.8	T488	T488-G490 PolarHBondContact O-N 3.34Å; T488-G490 VanDerWaalsContact O-N 3.12Å
491	A	30.9	Very low	45.4	Very low	82 Å²	82	117.5 Å²	117.5	68%	0.678	65%	0.647	S	S	*	*			trans	-66.3	142.7	169.4	0	0	0	0	0	111
492	Q	31.8	Very low	48.1	Very low	187 Å²	187	113.7 Å²	113.7	87%	0.874	62%	0.621	S	S	*	*			trans	-63	161	173.9	-69.4	-171.3	-40.1	0	0	111.4	G494	Q492-G494 PolarHBondContact O-N 2.82Å
493	E	40.6	Very low	51	Low	200 Å²	200	107.6 Å²	107.6	94%	0.935	59%	0.592	S	S	*	*			trans	-58.3	92.1	178.9	-78.2	-168.8	112	0	0	112.7	K495	E493-K495 PolarHBondContact O-N 3.24Å
494	G	37.8	Very low	53.9	Low	68 Å²	68	100.6 Å²	100.6	70%	0.701	56%	0.555	S	S	*	*			trans	-62.2	105.4	171	0	0	0	0	0	109.9	Q492 K496	Q492-G494 PolarHBondContact O-N 2.82Å; G494-K496 PolarHBondContact O-N 3.03Å; G494-K496 VanDerWaalsContact O-N 3.09Å
495	K	44.3	Very low	56.8	Low	139 Å²	139	96.1 Å²	96.1	60%	0.604	52%	0.524	S	S	*	.			trans	-44.5	118.1	174.5	-63.3	178.5	175.4	179.2	0	109.6	E386 E493 Q497	E386-K495 HydrophobicContact CG-CD 4.34Å; E386-K495 WeakPolarHBondContact OE1-CD 3.46Å; E386-K495 WeakPolarHBondContact OE1-CE 3.31Å; E386-K495 IonicContact OE1-NZ 2.75Å; E386-K495 PolarHBondContact OE1-NZ 2.77Å; E386-K495 IonicContact OE2-NZ 3.26Å; E493-K495 PolarHBondContact O-N 3.24Å; K495-Q497 WeakPolarHBondContact O-CG 3.4Å; K495-Q497 PolarHBondContact O-N 3.31Å
496	K	49.4	Very low	59.3	Low	183 Å²	183	91.8 Å²	91.8	80%	0.796	50%	0.501	S	S	*	.			trans	-57.5	101.3	-176.3	-70.1	-178.8	179.1	176.4	0	110.8	G494 Y498	G494-K496 PolarHBondContact O-N 3.03Å; G494-K496 VanDerWaalsContact O-N 3.09Å; K496-Y498 WeakPolarHBondContact O-CD2 3.47Å; K496-Y498 WeakPolarHBondContact O-CE2 2.94Å
497	Q	56.8	Low	62.2	Low	105 Å²	105	84 Å²	84	49%	0.491	47%	0.466	S	S	.	.			trans	-92	127.6	-174.2	-87.3	176.4	-10.7	0	0	112.1	L384 S385 K495	L384-Q497 HydrophobicContact CB-CB 4.17Å; L384-Q497 HydrophobicContact CB-CG 4.26Å; L384-Q497 HydrophobicContact CD2-CB 4.49Å; S385-Q497 CarbonylContact O-C 3.35Å; S385-Q497 VanDerWaalsContact O-CA 3.28Å; S385-Q497 WeakPolarHBondContact O-CA 3.45Å; K495-Q497 WeakPolarHBondContact O-CG 3.4Å; K495-Q497 PolarHBondContact O-N 3.31Å
498	Y	65.8	Low	65	Low	111 Å²	111	86.8 Å²	86.8	44%	0.435	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.6	177.3	-66.9	-103.5	0	0	0	109.7	S385 R387 K496 M500	S385-Y498 PolarHBondContact N-O 2.75Å; S385-Y498 PolarHBondContact O-N 3.16Å; R387-Y498 HydrophobicContact CB-CD2 4.15Å; R387-Y498 HydrophobicContact CB-CE2 3.56Å; R387-Y498 HydrophobicContact CG-CD2 4.49Å; R387-Y498 HydrophobicContact CG-CE2 3.65Å; K496-Y498 WeakPolarHBondContact O-CD2 3.47Å; K496-Y498 WeakPolarHBondContact O-CE2 2.94Å; Y498-M500 PolarHBondContact O-N 3.49Å
499	K	77.5	Confident	68.1	Low	119 Å²	119	84.5 Å²	84.5	52%	0.517	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	102.4	176.3	-69.7	177.2	-178.9	177.1	0	109.7	L384	L384-K499 HydrophobicContact CD2-CG 3.84Å
500	M	82.6	Confident	70.9	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.02	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	143.2	169.3	-65.6	-60.1	-61.4	0	0	109.5	Q382 L383 M471 A472 R473 Y498	Q382-M500 WeakPolarHBondContact CA-O 3.5Å; L383-M500 HydrophobicContact CD1-CB 3.84Å; L383-M500 HydrophobicContact CD1-CG 4.19Å; L383-M500 HydrophobicContact CG-CB 4.22Å; L383-M500 PolarHBondContact N-O 2.89Å; L383-M500 VanDerWaalsContact N-O 3.07Å; L383-M500 PolarHBondContact O-N 2.86Å; M471-M500 HydrophobicContact CB-CE 3.97Å; M471-M500 HydrophobicContact CE-CB 4.48Å; M471-M500 HydrophobicContact CE-CG 4.49Å; A472-M500 VanDerWaalsContact C-CE 3.49Å; A472-M500 WeakPolarHBondContact O-CE 3.23Å; R473-M500 HydrophobicContact CG-CE 4.07Å; R473-M500 HydrophobicContact CG-SD 3.7Å; Y498-M500 PolarHBondContact O-N 3.49Å
501	I	89.8	Confident	73.6	Confident	25 Å²	25	78 Å²	78	13%	0.128	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.2	163.3	-169.2	165.7	0	0	0	108.7	Q382 A472 R474	Q382-I501 HydrophobicContact CG-CG1 4.39Å; A472-I501 HydrophobicContact CB-CG2 4.03Å; A472-I501 PolarHBondContact N-O 3.38Å; A472-I501 WeakPolarHBondContact O-CG2 3.29Å; A472-I501 PolarHBondContact O-N 3.42Å; R474-I501 HydrophobicContact CB-CB 4.37Å; R474-I501 HydrophobicContact CB-CG2 4.04Å
502	C	92.8	Very high	76.5	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.6	-176.1	-55.9	0	0	0	0	108.1	S380 T381 L383 A401 L470 M471	S380-C502 CarbonylContact C-O 3.48Å; S380-C502 VanDerWaalsContact CA-O 3.29Å; S380-C502 WeakPolarHBondContact CA-O 3.48Å; T381-C502 HydrophobicContact CG2-CB 4.38Å; T381-C502 PolarHBondContact N-O 2.93Å; T381-C502 PolarHBondContact O-N 2.98Å; L383-C502 WeakPolarHBondContact CD2-SG 3.15Å; A401-C502 HydrophobicContact CB-CB 3.72Å; L470-C502 WeakPolarHBondContact O-CA 3.5Å; M471-C502 HydrophobicContact CG-CB 4.46Å
503	H	94.4	Very high	79.4	Confident	6 Å²	6	68.5 Å²	68.5	3%	0.028	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.7	178.4	-51.5	-73.3	0	0	0	108.4	S380 M451 H453 L470 F505	S380-H503 PolarHBondContact OG-ND1 3.21Å; M451-H503 WeakPolarHBondContact CE-ND1 3.46Å; M451-H503 HydrophobicContact SD-CB 4.46Å; M451-H503 PolarHBondContact SD-CE1 3.35Å; M451-H503 PolarHBondContact SD-ND1 3.37Å; H453-H503 AromaticContact CD2-NE2 4Å; H453-H503 AromaticContact CE1-NE2 3.5Å; H453-H503 PolarHBondContact CE1-NE2 2.84Å; H453-H503 AromaticContact NE2-CD2 3.56Å; H453-H503 AromaticContact NE2-CE1 3.76Å; H453-H503 AromaticContact NE2-NE2 2.9Å; H453-H503 PolarHBondContact NE2-NE2 3.09Å; L470-H503 HydrophobicContact CB-CB 4.37Å; L470-H503 PolarHBondContact N-O 3.38Å; L470-H503 PolarHBondContact O-N 2.78Å; H503-F505 HydrophobicContact CB-CE2 3.57Å; H503-F505 HydrophobicContact CB-CZ 3.7Å
504	V	95.3	Very high	81.7	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.5	-176.4	-176.3	0	0	0	0	108.9	L378 G379 V402 V405 I467	L378-V504 HydrophobicContact CB-CB 4.48Å; L378-V504 HydrophobicContact CB-CG1 4.29Å; L378-V504 WeakPolarHBondContact CB-O 3.45Å; L378-V504 HydrophobicContact CD1-CG1 4.13Å; L378-V504 PolarHBondContact N-O 2.89Å; G379-V504 PolarHBondContact N-O 3.28Å; G379-V504 PolarHBondContact O-N 2.95Å; V402-V504 HydrophobicContact CG2-CG1 4Å; V402-V504 HydrophobicContact CG2-CG2 4.21Å; V405-V504 HydrophobicContact CB-CB 4.41Å; V405-V504 HydrophobicContact CB-CG2 4.22Å; V405-V504 HydrophobicContact CG1-CB 4.24Å; V405-V504 HydrophobicContact CG2-CB 4.44Å; V405-V504 HydrophobicContact CG2-CG2 3.95Å; I467-V504 HydrophobicContact CG2-CG1 3.65Å
505	F	95.6	Very high	84	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	155.5	179.4	-48.4	-90.9	0	0	0	110.1	A375 N376 Y377 V430 L432 V441 I467 V468 L470 H503	A375-F505 HydrophobicContact CB-CB 4.21Å; N376-F505 CarbonylContact O-C 3.56Å; N376-F505 VanDerWaalsContact O-CA 3.28Å; N376-F505 WeakPolarHBondContact O-CA 3.1Å; Y377-F505 AromaticContact CD2-CD1 3.99Å; Y377-F505 HydrophobicContact CD2-CD1 3.99Å; Y377-F505 AromaticContact CD2-CE1 3.71Å; Y377-F505 HydrophobicContact CD2-CE1 3.71Å; Y377-F505 HydrophobicContact CD2-CZ 4.42Å; Y377-F505 HydrophobicContact CG-CE1 4.41Å; V430-F505 HydrophobicContact CG2-CD1 4.18Å; V430-F505 HydrophobicContact CG2-CE1 4.46Å; L432-F505 HydrophobicContact CD1-CZ 4.43Å; V441-F505 HydrophobicContact CG1-CE1 4.08Å; V441-F505 HydrophobicContact CG2-CE1 3.74Å; V441-F505 HydrophobicContact CG2-CZ 3.66Å; I467-F505 CarbonylContact C-O 3.57Å; I467-F505 VanDerWaalsContact CA-O 3.29Å; I467-F505 WeakPolarHBondContact CA-O 3.26Å; I467-F505 WeakPolarHBondContact CG2-O 3.46Å; V468-F505 HydrophobicContact CB-CB 4.37Å; V468-F505 PolarHBondContact N-O 2.76Å; V468-F505 PolarHBondContact O-N 3.02Å; L470-F505 HydrophobicContact CB-CE2 4.1Å; H503-F505 HydrophobicContact CB-CE2 3.57Å; H503-F505 HydrophobicContact CB-CZ 3.7Å
506	E	95.1	Very high	86.3	Confident	48 Å²	48	51.1 Å²	51.1	22%	0.224	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.8	177.7	-179.6	157.1	-116.8	0	0	109.1	N376 L378 N466 I467	N376-E506 HydrophobicContact CB-CB 4.19Å; N376-E506 WeakPolarHBondContact CB-O 3.49Å; N376-E506 PolarHBondContact N-O 2.92Å; N376-E506 PolarHBondContact O-N 3.12Å; L378-E506 HydrophobicContact CD1-CB 3.99Å; L378-E506 HydrophobicContact CD2-CB 3.84Å; L378-E506 HydrophobicContact CG-CB 3.86Å; N466-E506 WeakPolarHBondContact ND2-CG 3.09Å; N466-E506 PolarHBondContact ND2-OE1 3.24Å; N466-E506 CarbonylContact O-C 3.53Å; N466-E506 VanDerWaalsContact O-CA 3.31Å; N466-E506 WeakPolarHBondContact O-CA 2.89Å; I467-E506 HydrophobicContact CD1-CB 3.7Å; I467-E506 HydrophobicContact CD1-CG 3.85Å
507	S	95.3	Very high	88.1	Confident	16 Å²	16	42.5 Å²	42.5	11%	0.112	20%	0.2	C	C	.	.			trans	-152.6	152	-179.5	-171.8	0	0	0	0	110.1	A374 N466 D509 A510	A374-S507 PolarHBondContact O-OG 2.81Å; N466-S507 CarbonylContact C-O 3.49Å; N466-S507 WeakPolarHBondContact CA-O 3.17Å; N466-S507 PolarHBondContact O-N 2.66Å; N466-S507 VanDerWaalsContact O-O 3.07Å; S507-D509 VanDerWaalsContact C-N 3.32Å; S507-D509 PolarHBondContact OG-N 3.06Å; S507-A510 WeakPolarHBondContact O-CB 3.4Å; S507-A510 PolarHBondContact O-N 3.17Å
508	E	93.6	Very high	89.3	Confident	194 Å²	194	38.2 Å²	38.2	91%	0.907	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-35.4	173.9	-61.9	-177.7	-176.5	0	0	110	A510	E508-A510 PolarHBondContact O-N 3.27Å; E508-A510 VanDerWaalsContact O-N 3.15Å
509	D	94.3	Very high	90.1	Very high	73 Å²	73	33.2 Å²	33.2	39%	0.39	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	19.8	175.2	-66.7	-54.8	0	0	0	114	F373 S507 Q511 L512 I513	F373-D509 HydrophobicContact CD1-CB 4.15Å; F373-D509 HydrophobicContact CE1-CB 4.49Å; S507-D509 VanDerWaalsContact C-N 3.32Å; S507-D509 PolarHBondContact OG-N 3.06Å; D509-Q511 VanDerWaalsContact C-N 3.25Å; D509-Q511 PolarHBondContact O-N 3.26Å; D509-Q511 VanDerWaalsContact O-N 3.13Å; D509-L512 HydrophobicContact CB-CB 4.31Å; D509-L512 PolarHBondContact O-N 2.85Å; D509-I513 HydrophobicContact CB-CD1 4.47Å; D509-I513 WeakPolarHBondContact O-CG1 3.49Å; D509-I513 PolarHBondContact O-N 2.96Å
510	A	91.5	Very high	90.3	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-53.3	-39.3	-173.7	0	0	0	0	0	113.9	G465 V468 S507 E508 A514	G465-A510 WeakPolarHBondContact O-CB 3.47Å; V468-A510 HydrophobicContact CG2-CB 3.61Å; S507-A510 WeakPolarHBondContact O-CB 3.4Å; S507-A510 PolarHBondContact O-N 3.17Å; E508-A510 PolarHBondContact O-N 3.27Å; E508-A510 VanDerWaalsContact O-N 3.15Å; A510-A514 PolarHBondContact O-N 3.38Å
511	Q	90.8	Very high	90.1	Very high	75 Å²	75	28.9 Å²	28.9	35%	0.35	15%	0.145	S	C	.	.	H	α-helix	trans	-69.8	-41.2	176.6	-165.2	-172.1	71.1	0	0	112	D509 I513 A514 Q515	D509-Q511 VanDerWaalsContact C-N 3.25Å; D509-Q511 PolarHBondContact O-N 3.26Å; D509-Q511 VanDerWaalsContact O-N 3.13Å; Q511-I513 VanDerWaalsContact C-N 3.34Å; Q511-A514 PolarHBondContact O-N 2.7Å; Q511-Q515 WeakPolarHBondContact O-CB 3.48Å; Q511-Q515 VanDerWaalsContact O-CG 3.28Å; Q511-Q515 WeakPolarHBondContact O-CG 3.28Å; Q511-Q515 PolarHBondContact O-N 3.5Å
512	L	92.1	Very high	89.5	Confident	69 Å²	69	30 Å²	30	36%	0.361	16%	0.155	S	C	.	.	H	α-helix	trans	-64.7	-39.5	175.6	-81.9	71.6	0	0	0	110.9	F373 D509 Q515 S516	F373-L512 HydrophobicContact CE1-CB 4.06Å; F373-L512 HydrophobicContact CZ-CB 4.42Å; D509-L512 HydrophobicContact CB-CB 4.31Å; D509-L512 PolarHBondContact O-N 2.85Å; L512-Q515 PolarHBondContact O-N 2.83Å; L512-S516 VanDerWaalsContact O-CB 3.26Å; L512-S516 WeakPolarHBondContact O-CB 3.37Å; L512-S516 PolarHBondContact O-N 2.91Å; L512-S516 PolarHBondContact O-OG 3.47Å
513	I	92.1	Very high	88.8	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.5	-50.3	174.4	-69.5	165	0	0	0	110.4	F373 L432 I434 V468 D509 Q511 Q515 S516 I517	F373-I513 HydrophobicContact CB-CD1 3.84Å; F373-I513 HydrophobicContact CB-CG1 3.68Å; F373-I513 HydrophobicContact CD1-CD1 4.46Å; F373-I513 HydrophobicContact CD1-CG1 3.74Å; F373-I513 HydrophobicContact CD2-CG1 3.88Å; F373-I513 HydrophobicContact CE1-CG1 4.3Å; F373-I513 HydrophobicContact CE2-CG1 4.4Å; F373-I513 HydrophobicContact CG-CD1 4.2Å; F373-I513 HydrophobicContact CG-CG1 3.5Å; L432-I513 HydrophobicContact CD2-CD1 4.43Å; L432-I513 HydrophobicContact CD2-CG2 3.46Å; L432-I513 VanDerWaalsContact CD2-CG2 3.46Å; I434-I513 HydrophobicContact CD1-CG2 4.42Å; V468-I513 HydrophobicContact CB-CG2 4.49Å; V468-I513 HydrophobicContact CG1-CG2 3.94Å; V468-I513 HydrophobicContact CG2-CB 4.08Å; V468-I513 HydrophobicContact CG2-CD1 4.27Å; V468-I513 HydrophobicContact CG2-CG2 3.91Å; D509-I513 HydrophobicContact CB-CD1 4.47Å; D509-I513 WeakPolarHBondContact O-CG1 3.49Å; D509-I513 PolarHBondContact O-N 2.96Å; Q511-I513 VanDerWaalsContact C-N 3.34Å; I513-Q515 PolarHBondContact O-N 3.39Å; I513-S516 PolarHBondContact O-N 2.98Å; I513-I517 HydrophobicContact CG2-CD1 3.87Å; I513-I517 VanDerWaalsContact O-CG1 3.27Å; I513-I517 WeakPolarHBondContact O-CG1 3.39Å; I513-I517 PolarHBondContact O-N 3.2Å
514	A	89.1	Confident	87.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-41.6	179.6	0	0	0	0	0	112.3	Y99 I461 D463 A510 Q511 G518	Y99-A514 HydrophobicContact CD2-CB 4.08Å; Y99-A514 HydrophobicContact CE2-CB 4.4Å; I461-A514 HydrophobicContact CG1-CB 4.39Å; D463-A514 HydrophobicContact CB-CB 3.96Å; D463-A514 WeakPolarHBondContact OD1-CB 3.36Å; A510-A514 PolarHBondContact O-N 3.38Å; Q511-A514 PolarHBondContact O-N 2.7Å; A514-G518 PolarHBondContact O-N 3.49Å; A514-G518 VanDerWaalsContact O-N 3.07Å
515	Q	86.8	Confident	86.5	Confident	43 Å²	43	34.4 Å²	34.4	20%	0.201	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-51.2	172.1	-78.5	174.8	23.4	0	0	112.2	Y99 P361 Q511 L512 I513 I517 G518 Q519	Y99-Q515 HydrophobicContact CD2-CG 4.42Å; Y99-Q515 HydrophobicContact CE1-CG 3.8Å; Y99-Q515 HydrophobicContact CE2-CB 4.43Å; Y99-Q515 HydrophobicContact CE2-CG 3.53Å; Y99-Q515 WeakPolarHBondContact OH-CG 3.3Å; Y99-Q515 PolarHBondContact OH-NE2 3.09Å; Y99-Q515 VanDerWaalsContact OH-NE2 3.08Å; P361-Q515 HydrophobicContact CG-CB 3.83Å; Q511-Q515 WeakPolarHBondContact O-CB 3.48Å; Q511-Q515 VanDerWaalsContact O-CG 3.28Å; Q511-Q515 WeakPolarHBondContact O-CG 3.28Å; Q511-Q515 PolarHBondContact O-N 3.5Å; L512-Q515 PolarHBondContact O-N 2.83Å; I513-Q515 PolarHBondContact O-N 3.39Å; Q515-I517 VanDerWaalsContact C-N 3.31Å; Q515-I517 PolarHBondContact O-N 3.35Å; Q515-G518 CarbonylContact O-C 3.58Å; Q515-G518 WeakPolarHBondContact O-CA 3.42Å; Q515-G518 PolarHBondContact O-N 2.89Å; Q515-Q519 WeakPolarHBondContact O-CB 3.36Å; Q515-Q519 PolarHBondContact O-N 3.15Å
516	S	91.6	Very high	85.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-38.6	-176.6	-56.8	0	0	0	0	111.9	P361 C362 F373 L512 I513 Q519 A520	P361-S516 WeakPolarHBondContact CG-OG 3.17Å; C362-S516 PolarHBondContact SG-OG 2.9Å; C362-S516 VanDerWaalsContact SG-OG 3.38Å; F373-S516 WeakPolarHBondContact CZ-OG 3.31Å; L512-S516 VanDerWaalsContact O-CB 3.26Å; L512-S516 WeakPolarHBondContact O-CB 3.37Å; L512-S516 PolarHBondContact O-N 2.91Å; L512-S516 PolarHBondContact O-OG 3.47Å; I513-S516 PolarHBondContact O-N 2.98Å; S516-Q519 PolarHBondContact O-N 3.21Å; S516-A520 WeakPolarHBondContact O-CB 3.4Å; S516-A520 PolarHBondContact O-N 2.86Å
517	I	86.6	Confident	84.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-48.5	171.6	-67.8	168.5	0	0	0	110.2	I434 I439 I461 I513 Q515 Q519 A520 F521	I434-I517 HydrophobicContact CD1-CD1 4.23Å; I434-I517 HydrophobicContact CD1-CG1 3.71Å; I434-I517 HydrophobicContact CG1-CG1 4Å; I434-I517 HydrophobicContact CG2-CG1 4.08Å; I439-I517 HydrophobicContact CD1-CB 4.42Å; I439-I517 HydrophobicContact CD1-CD1 3.68Å; I439-I517 HydrophobicContact CD1-CG1 3.67Å; I439-I517 HydrophobicContact CD1-CG2 3.91Å; I461-I517 HydrophobicContact CB-CG2 4.25Å; I461-I517 HydrophobicContact CD1-CD1 3.75Å; I461-I517 HydrophobicContact CG1-CB 4.3Å; I461-I517 HydrophobicContact CG1-CD1 3.98Å; I461-I517 HydrophobicContact CG1-CG2 4.07Å; I461-I517 HydrophobicContact CG2-CG2 4.19Å; I513-I517 HydrophobicContact CG2-CD1 3.87Å; I513-I517 VanDerWaalsContact O-CG1 3.27Å; I513-I517 WeakPolarHBondContact O-CG1 3.39Å; I513-I517 PolarHBondContact O-N 3.2Å; Q515-I517 VanDerWaalsContact C-N 3.31Å; Q515-I517 PolarHBondContact O-N 3.35Å; I517-Q519 VanDerWaalsContact C-N 3.29Å; I517-Q519 PolarHBondContact O-N 2.89Å; I517-A520 WeakPolarHBondContact O-CB 3.26Å; I517-A520 PolarHBondContact O-N 3.18Å; I517-F521 HydrophobicContact CG2-CD2 4.15Å; I517-F521 HydrophobicContact CG2-CE2 3.72Å; I517-F521 WeakPolarHBondContact O-CD2 3.16Å; I517-F521 PolarHBondContact O-N 2.85Å
518	G	83	Confident	82.9	Confident	15 Å²	15	41.4 Å²	41.4	16%	0.155	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-35.8	176.3	0	0	0	0	0	113.8	A514 Q515 S522	A514-G518 PolarHBondContact O-N 3.49Å; A514-G518 VanDerWaalsContact O-N 3.07Å; Q515-G518 CarbonylContact O-C 3.58Å; Q515-G518 WeakPolarHBondContact O-CA 3.42Å; Q515-G518 PolarHBondContact O-N 2.89Å; G518-S522 PolarHBondContact O-N 2.77Å; G518-S522 PolarHBondContact O-OG 2.99Å; G518-S522 VanDerWaalsContact O-OG 3.09Å
519	Q	83.2	Confident	81.5	Confident	6 Å²	6	33 Å²	33	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-67.4	-46	173.7	-160.3	-175.5	5.8	0	0	110.3	V358 G360 C362 L367 Q515 S516 I517 F521 S522 V523	V358-Q519 HydrophobicContact CB-CG 4.33Å; V358-Q519 HydrophobicContact CG1-CG 3.76Å; V358-Q519 PolarHBondContact O-NE2 3.37Å; G360-Q519 VanDerWaalsContact CA-CD 3.49Å; C362-Q519 VanDerWaalsContact N-OE1 3.08Å; C362-Q519 PolarHBondContact O-NE2 2.82Å; C362-Q519 PolarHBondContact O-OE1 2.86Å; L367-Q519 HydrophobicContact CD1-CB 3.88Å; L367-Q519 HydrophobicContact CD1-CG 3.7Å; Q515-Q519 WeakPolarHBondContact O-CB 3.36Å; Q515-Q519 PolarHBondContact O-N 3.15Å; S516-Q519 PolarHBondContact O-N 3.21Å; I517-Q519 VanDerWaalsContact C-N 3.29Å; I517-Q519 PolarHBondContact O-N 2.89Å; Q519-F521 VanDerWaalsContact C-N 3.3Å; Q519-F521 PolarHBondContact O-N 2.89Å; Q519-S522 CarbonylContact O-C 3.57Å; Q519-S522 WeakPolarHBondContact O-CA 3.31Å; Q519-S522 WeakPolarHBondContact O-CB 3.44Å; Q519-S522 PolarHBondContact O-N 2.87Å; Q519-V523 HydrophobicContact CG-CG2 4.37Å; Q519-V523 WeakPolarHBondContact O-CG2 3.44Å; Q519-V523 PolarHBondContact O-N 3.11Å
520	A	81.4	Confident	80.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.6	-38.9	177.7	0	0	0	0	0	113	L367 I434 L455 S516 I517 S522 A524	L367-A520 HydrophobicContact CD2-CB 4.28Å; I434-A520 HydrophobicContact CG2-CB 4.06Å; L455-A520 HydrophobicContact CD2-CB 4.34Å; S516-A520 WeakPolarHBondContact O-CB 3.4Å; S516-A520 PolarHBondContact O-N 2.86Å; I517-A520 WeakPolarHBondContact O-CB 3.26Å; I517-A520 PolarHBondContact O-N 3.18Å; A520-S522 VanDerWaalsContact C-N 3.34Å; A520-S522 PolarHBondContact O-N 2.95Å; A520-A524 WeakPolarHBondContact O-CB 3.27Å; A520-A524 PolarHBondContact O-N 2.66Å
521	F	77.9	Confident	79	Confident	31 Å²	31	39.9 Å²	39.9	14%	0.136	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-39.8	171.8	-79.8	-77	0	0	0	113	I101 L455 I458 I517 Q519 Y525	I101-F521 HydrophobicContact CB-CD2 4.46Å; I101-F521 HydrophobicContact CD1-CD2 3.86Å; I101-F521 HydrophobicContact CD1-CE2 3.32Å; I101-F521 HydrophobicContact CD1-CZ 3.71Å; I101-F521 HydrophobicContact CG1-CD2 3.63Å; I101-F521 HydrophobicContact CG1-CE2 3.66Å; I101-F521 HydrophobicContact CG1-CG 4.19Å; I101-F521 HydrophobicContact CG1-CZ 4.19Å; I101-F521 HydrophobicContact CG2-CD1 3.56Å; I101-F521 HydrophobicContact CG2-CD2 4.05Å; I101-F521 HydrophobicContact CG2-CE1 3.56Å; I101-F521 HydrophobicContact CG2-CE2 4.1Å; I101-F521 HydrophobicContact CG2-CG 3.82Å; I101-F521 HydrophobicContact CG2-CZ 3.87Å; L455-F521 HydrophobicContact CD1-CD2 4.34Å; L455-F521 HydrophobicContact CD1-CE1 4.23Å; L455-F521 HydrophobicContact CD1-CE2 3.8Å; L455-F521 HydrophobicContact CD1-CZ 3.73Å; L455-F521 HydrophobicContact CD2-CD1 4.06Å; L455-F521 HydrophobicContact CD2-CE1 4.19Å; L455-F521 HydrophobicContact CD2-CG 4.29Å; L455-F521 HydrophobicContact CD2-CZ 4.47Å; L455-F521 HydrophobicContact CG-CD1 4Å; L455-F521 HydrophobicContact CG-CD2 4.48Å; L455-F521 HydrophobicContact CG-CE1 3.6Å; L455-F521 HydrophobicContact CG-CE2 4.09Å; L455-F521 HydrophobicContact CG-CG 4.41Å; L455-F521 HydrophobicContact CG-CZ 3.62Å; L455-F521 VanDerWaalsContact O-CE1 3.29Å; L455-F521 WeakPolarHBondContact O-CE1 3.34Å; L455-F521 VanDerWaalsContact O-CZ 3.23Å; L455-F521 WeakPolarHBondContact O-CZ 3.45Å; I458-F521 HydrophobicContact CB-CZ 4.02Å; I458-F521 HydrophobicContact CD1-CE2 4.47Å; I458-F521 HydrophobicContact CD1-CZ 4.05Å; I458-F521 HydrophobicContact CG2-CZ 4.28Å; I517-F521 HydrophobicContact CG2-CD2 4.15Å; I517-F521 HydrophobicContact CG2-CE2 3.72Å; I517-F521 WeakPolarHBondContact O-CD2 3.16Å; I517-F521 PolarHBondContact O-N 2.85Å; Q519-F521 VanDerWaalsContact C-N 3.3Å; Q519-F521 PolarHBondContact O-N 2.89Å; F521-Y525 VanDerWaalsContact O-CB 3.31Å; F521-Y525 WeakPolarHBondContact O-CB 3.15Å; F521-Y525 PolarHBondContact O-N 3.13Å
522	S	76.5	Confident	77.7	Confident	49 Å²	49	41 Å²	41	34%	0.343	22%	0.215	S	C	.	.	H	α-helix	trans	-73	-39.8	-178.3	-57.8	0	0	0	0	111.3	G518 Q519 A520 Y525 Q526	G518-S522 PolarHBondContact O-N 2.77Å; G518-S522 PolarHBondContact O-OG 2.99Å; G518-S522 VanDerWaalsContact O-OG 3.09Å; Q519-S522 CarbonylContact O-C 3.57Å; Q519-S522 WeakPolarHBondContact O-CA 3.31Å; Q519-S522 WeakPolarHBondContact O-CB 3.44Å; Q519-S522 PolarHBondContact O-N 2.87Å; A520-S522 VanDerWaalsContact C-N 3.34Å; A520-S522 PolarHBondContact O-N 2.95Å; S522-Y525 PolarHBondContact O-N 2.95Å; S522-Q526 PolarHBondContact O-N 3.25Å
523	V	79.6	Confident	76	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-51.9	170.9	176.9	0	0	0	0	110.1	F355 V358 P364 L367 I368 T436 Q519 Y525 Q526 E527	F355-V523 HydrophobicContact CE1-CG1 3.89Å; F355-V523 HydrophobicContact CZ-CG1 3.68Å; V358-V523 HydrophobicContact CB-CG2 4.15Å; V358-V523 HydrophobicContact CG1-CG2 4.28Å; V358-V523 HydrophobicContact CG2-CG2 3.96Å; P364-V523 HydrophobicContact CB-CG1 4.38Å; P364-V523 HydrophobicContact CB-CG2 4.07Å; L367-V523 HydrophobicContact CD1-CG2 4.04Å; I368-V523 HydrophobicContact CG1-CG1 4.28Å; T436-V523 HydrophobicContact CG2-CB 4.03Å; T436-V523 HydrophobicContact CG2-CG1 3.51Å; Q519-V523 HydrophobicContact CG-CG2 4.37Å; Q519-V523 WeakPolarHBondContact O-CG2 3.44Å; Q519-V523 PolarHBondContact O-N 3.11Å; V523-Y525 VanDerWaalsContact C-N 3.26Å; V523-Y525 PolarHBondContact O-N 3.25Å; V523-Q526 CarbonylContact O-C 3.59Å; V523-Q526 PolarHBondContact O-N 2.69Å; V523-E527 HydrophobicContact CG1-CG 4.38Å; V523-E527 VanDerWaalsContact O-CG 3.3Å; V523-E527 WeakPolarHBondContact O-CG 3.43Å; V523-E527 PolarHBondContact O-N 2.66Å
524	A	73.8	Confident	74.5	Confident	25 Å²	25	42.7 Å²	42.7	21%	0.207	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-35.1	177.7	0	0	0	0	0	113.1	T436 L455 A520 F528	T436-A524 HydrophobicContact CG2-CB 4.15Å; L455-A524 HydrophobicContact CD2-CB 4.09Å; A520-A524 WeakPolarHBondContact O-CB 3.27Å; A520-A524 PolarHBondContact O-N 2.66Å; A524-F528 WeakPolarHBondContact O-CB 3.44Å; A524-F528 PolarHBondContact O-N 3.29Å
525	Y	67.6	Low	72.9	Confident	74 Å²	74	46.3 Å²	46.3	29%	0.29	26%	0.256	S	S	.	.	H	α-helix	trans	-68.3	-43.5	173.3	179	-103.1	0	0	0	112.2	F521 S522 V523 E527 F528 L529 Q541	F521-Y525 VanDerWaalsContact O-CB 3.31Å; F521-Y525 WeakPolarHBondContact O-CB 3.15Å; F521-Y525 PolarHBondContact O-N 3.13Å; S522-Y525 PolarHBondContact O-N 2.95Å; V523-Y525 VanDerWaalsContact C-N 3.26Å; V523-Y525 PolarHBondContact O-N 3.25Å; Y525-E527 VanDerWaalsContact C-N 3.34Å; Y525-F528 PolarHBondContact O-N 3.11Å; Y525-L529 HydrophobicContact CD1-CD1 4.15Å; Y525-L529 HydrophobicContact CD1-CG 4.45Å; Y525-L529 HydrophobicContact CE1-CD1 3.55Å; Y525-L529 HydrophobicContact CE1-CG 4.07Å; Y525-L529 HydrophobicContact CE2-CD2 4.46Å; Y525-L529 WeakPolarHBondContact O-CG 3.03Å; Y525-L529 PolarHBondContact O-N 3.5Å; Y525-Q541 HydrophobicContact CE1-CG 4.17Å
526	Q	69.2	Low	71.2	Confident	51 Å²	51	46.7 Å²	46.7	24%	0.238	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-39.4	172.9	-73.6	-171.4	2.9	0	0	112.1	S522 V523 F528 L529 R530	S522-Q526 PolarHBondContact O-N 3.25Å; V523-Q526 CarbonylContact O-C 3.59Å; V523-Q526 PolarHBondContact O-N 2.69Å; Q526-F528 VanDerWaalsContact C-N 3.35Å; Q526-F528 PolarHBondContact O-N 2.8Å; Q526-L529 PolarHBondContact O-N 3.36Å; Q526-R530 VanDerWaalsContact O-CB 3.23Å; Q526-R530 WeakPolarHBondContact O-CB 3.28Å; Q526-R530 PolarHBondContact O-N 3.5Å
527	E	71.6	Confident	69.4	Low	36 Å²	36	54.2 Å²	54.2	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-44	173.2	-68.9	-129.5	90	0	0	111.8	F355 I368 V523 Y525 R530 A531	F355-E527 HydrophobicContact CZ-CG 4.38Å; I368-E527 HydrophobicContact CD1-CG 4.47Å; V523-E527 HydrophobicContact CG1-CG 4.38Å; V523-E527 VanDerWaalsContact O-CG 3.3Å; V523-E527 WeakPolarHBondContact O-CG 3.43Å; V523-E527 PolarHBondContact O-N 2.66Å; Y525-E527 VanDerWaalsContact C-N 3.34Å; E527-R530 PolarHBondContact O-N 2.83Å; E527-R530 IonicContact OE1-CZ 3.43Å; E527-R530 IonicContact OE1-NE 2.92Å; E527-R530 IonicContact OE1-NH2 3.7Å; E527-R530 PolarHBondContact OE1-NH2 2.95Å; E527-A531 VanDerWaalsContact O-CB 3.28Å; E527-A531 WeakPolarHBondContact O-CB 3.48Å; E527-A531 PolarHBondContact O-N 3.47Å
528	F	67.9	Low	67.9	Low	125 Å²	125	60.1 Å²	60.1	55%	0.548	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-45.2	174.4	176.4	-93.4	0	0	0	111.9	A524 Y525 Q526 A531 N532	A524-F528 WeakPolarHBondContact O-CB 3.44Å; A524-F528 PolarHBondContact O-N 3.29Å; Y525-F528 PolarHBondContact O-N 3.11Å; Q526-F528 VanDerWaalsContact C-N 3.35Å; Q526-F528 PolarHBondContact O-N 2.8Å; F528-A531 PolarHBondContact O-N 2.9Å; F528-N532 WeakPolarHBondContact CE2-ND2 3.23Å; F528-N532 WeakPolarHBondContact O-CB 3.12Å; F528-N532 PolarHBondContact O-N 2.95Å; F528-N532 VanDerWaalsContact O-N 3.11Å; F528-N532 PolarHBondContact O-ND2 3.3Å
529	L	65.4	Low	66.3	Low	17 Å²	17	61.3 Å²	61.3	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-45.8	174.9	-68.1	-175	0	0	0	111.6	Y525 Q526 N532 G533 I534	Y525-L529 HydrophobicContact CD1-CD1 4.15Å; Y525-L529 HydrophobicContact CD1-CG 4.45Å; Y525-L529 HydrophobicContact CE1-CD1 3.55Å; Y525-L529 HydrophobicContact CE1-CG 4.07Å; Y525-L529 HydrophobicContact CE2-CD2 4.46Å; Y525-L529 WeakPolarHBondContact O-CG 3.03Å; Y525-L529 PolarHBondContact O-N 3.5Å; Q526-L529 PolarHBondContact O-N 3.36Å; L529-N532 CarbonylContact O-C 3.49Å; L529-N532 PolarHBondContact O-N 3.42Å; L529-G533 PolarHBondContact O-N 2.92Å; L529-I534 HydrophobicContact CB-CB 4.18Å; L529-I534 HydrophobicContact CD2-CB 4.06Å; L529-I534 HydrophobicContact CD2-CD1 3.84Å; L529-I534 HydrophobicContact CD2-CG2 4.04Å; L529-I534 PolarHBondContact O-N 2.83Å
530	R	66.3	Low	64.7	Low	134 Å²	134	64.2 Å²	64.2	51%	0.506	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-46.4	178.1	-177.2	177.6	69.7	83.2	-5.4	112	Q526 E527 N532 G533	Q526-R530 VanDerWaalsContact O-CB 3.23Å; Q526-R530 WeakPolarHBondContact O-CB 3.28Å; Q526-R530 PolarHBondContact O-N 3.5Å; E527-R530 PolarHBondContact O-N 2.83Å; E527-R530 IonicContact OE1-CZ 3.43Å; E527-R530 IonicContact OE1-NE 2.92Å; E527-R530 IonicContact OE1-NH2 3.7Å; E527-R530 PolarHBondContact OE1-NH2 2.95Å; R530-N532 VanDerWaalsContact C-N 3.26Å; R530-N532 PolarHBondContact O-N 2.9Å; R530-G533 PolarHBondContact O-N 3.02Å; R530-G533 VanDerWaalsContact O-N 3.12Å
531	A	66.4	Low	63	Low	86 Å²	86	68.9 Å²	68.9	71%	0.711	37%	0.374	S	S	*	.	H	α-helix	trans	-65	-28.4	177.2	0	0	0	0	0	113	E527 F528	E527-A531 VanDerWaalsContact O-CB 3.28Å; E527-A531 WeakPolarHBondContact O-CB 3.48Å; E527-A531 PolarHBondContact O-N 3.47Å; F528-A531 PolarHBondContact O-N 2.9Å
532	N	63.8	Low	61.6	Low	98 Å²	98	74.5 Å²	74.5	52%	0.524	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4	174.8	-71.4	-86.7	0	0	0	113.7	F528 L529 R530 I534	F528-N532 WeakPolarHBondContact CE2-ND2 3.23Å; F528-N532 WeakPolarHBondContact O-CB 3.12Å; F528-N532 PolarHBondContact O-N 2.95Å; F528-N532 VanDerWaalsContact O-N 3.11Å; F528-N532 PolarHBondContact O-ND2 3.3Å; L529-N532 CarbonylContact O-C 3.49Å; L529-N532 PolarHBondContact O-N 3.42Å; R530-N532 VanDerWaalsContact C-N 3.26Å; R530-N532 PolarHBondContact O-N 2.9Å; N532-I534 HydrophobicContact CB-CD1 4.22Å; N532-I534 HydrophobicContact CB-CG1 4.41Å
533	G	57.4	Low	60.3	Low	52 Å²	52	76.5 Å²	76.5	54%	0.536	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	26.9	176.3	0	0	0	0	0	115.5	L529 R530	L529-G533 PolarHBondContact O-N 2.92Å; R530-G533 PolarHBondContact O-N 3.02Å; R530-G533 VanDerWaalsContact O-N 3.12Å
534	I	60.5	Low	58.7	Low	53 Å²	53	78.1 Å²	78.1	27%	0.272	41%	0.408	S	S	.	.			trans	-98.9	130	-178.5	-56.6	169.9	0	0	0	109.8	L529 N532 M685	L529-I534 HydrophobicContact CB-CB 4.18Å; L529-I534 HydrophobicContact CD2-CB 4.06Å; L529-I534 HydrophobicContact CD2-CD1 3.84Å; L529-I534 HydrophobicContact CD2-CG2 4.04Å; L529-I534 PolarHBondContact O-N 2.83Å; N532-I534 HydrophobicContact CB-CD1 4.22Å; N532-I534 HydrophobicContact CB-CG1 4.41Å; I534-M685 HydrophobicContact CD1-CE 4.1Å
535	N	54.6	Low	57.5	Low	76 Å²	76	77.7 Å²	77.7	41%	0.406	40%	0.404	S	S	.	.			trans	-73.6	143.7	176.5	-63.8	-32.8	0	0	0	111.7	D538	N535-D538 HydrophobicContact CB-CB 4.42Å; N535-D538 VanDerWaalsContact CB-OD2 3.28Å; N535-D538 WeakPolarHBondContact CB-OD2 3.27Å; N535-D538 PolarHBondContact ND2-OD2 3.33Å
536	P	51.4	Low	56.8	Low	50 Å²	50	77 Å²	77	33%	0.325	41%	0.405	S	S	.	.	S	Bend	trans	-74.4	-32.7	173.5	29.6	-33.7	0	0	0	113.3	V356 D538 L539	V356-P536 HydrophobicContact CG2-CG 4.34Å; P536-D538 PolarHBondContact O-N 3.13Å; P536-L539 PolarHBondContact O-N 2.83Å
537	E	54.1	Low	55.9	Low	159 Å²	159	76 Å²	76	74%	0.743	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.4	-175.5	-60.8	-62.7	132.7	0	0	113.8	L539	E537-L539 PolarHBondContact O-N 3.03Å
538	D	54.5	Low	54.9	Low	126 Å²	126	75.6 Å²	75.6	67%	0.674	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.3	-177.6	-71.9	-53.8	0	0	0	113.2	N535 P536	N535-D538 HydrophobicContact CB-CB 4.42Å; N535-D538 VanDerWaalsContact CB-OD2 3.28Å; N535-D538 WeakPolarHBondContact CB-OD2 3.27Å; N535-D538 PolarHBondContact ND2-OD2 3.33Å; P536-D538 PolarHBondContact O-N 3.13Å
539	L	48.9	Very low	54	Low	40 Å²	40	74.3 Å²	74.3	21%	0.209	40%	0.399	C	S	.	.			trans	-138.8	99.9	-168.5	-156.1	75.9	0	0	0	112.2	P536 E537 Q541 Y544	P536-L539 PolarHBondContact O-N 2.83Å; E537-L539 PolarHBondContact O-N 3.03Å; L539-Q541 VanDerWaalsContact C-N 3.31Å; L539-Q541 PolarHBondContact O-N 2.71Å; L539-Y544 HydrophobicContact CD1-CD1 3.86Å; L539-Y544 HydrophobicContact CD1-CD2 4.25Å; L539-Y544 HydrophobicContact CD1-CE1 4.43Å; L539-Y544 HydrophobicContact CD1-CG 3.72Å; L539-Y544 HydrophobicContact CD2-CD1 3.86Å; L539-Y544 HydrophobicContact CD2-CE1 4.46Å; L539-Y544 HydrophobicContact CD2-CG 4.44Å; L539-Y544 HydrophobicContact CG-CD1 4.23Å; L539-Y544 HydrophobicContact CG-CG 4.32Å
540	S	49.7	Very low	53.4	Low	67 Å²	67	79 Å²	79	47%	0.469	43%	0.429	S	S	.	.			trans	-64.2	95.2	164.8	56.4	0	0	0	0	108.9	K542 E543 Y544	S540-K542 CarbonylContact O-C 3.54Å; S540-K542 PolarHBondContact O-N 3.14Å; S540-E543 PolarHBondContact O-N 2.91Å; S540-E543 WeakPolarHBondContact OG-CB 3.43Å; S540-Y544 PolarHBondContact O-N 3.38Å
541	Q	46.9	Very low	52.6	Low	97 Å²	97	73.2 Å²	73.2	45%	0.453	41%	0.407	S	S	.	.	H	α-helix	trans	-55.3	-24.5	-167.5	-162.7	-172.9	17	0	0	113.3	Y525 L539 S545	Y525-Q541 HydrophobicContact CE1-CG 4.17Å; L539-Q541 VanDerWaalsContact C-N 3.31Å; L539-Q541 PolarHBondContact O-N 2.71Å; Q541-S545 WeakPolarHBondContact O-CB 3.37Å; Q541-S545 PolarHBondContact O-OG 3.48Å
542	K	48.4	Very low	51.9	Low	149 Å²	149	77.3 Å²	77.3	65%	0.648	41%	0.412	S	S	*	.	H	α-helix	trans	-66.6	-62.6	169.3	-172.8	172.4	-178.4	179.9	0	111.9	S540 Y544 S545 D546	S540-K542 CarbonylContact O-C 3.54Å; S540-K542 PolarHBondContact O-N 3.14Å; K542-Y544 PolarHBondContact O-N 3.31Å; K542-S545 PolarHBondContact O-N 3.34Å; K542-D546 WeakPolarHBondContact CG-OD2 3.47Å; K542-D546 WeakPolarHBondContact O-CB 3.43Å; K542-D546 PolarHBondContact O-N 3.04Å
543	E	47.9	Very low	51.4	Low	91 Å²	91	77.7 Å²	77.7	43%	0.425	41%	0.412	S	S	.	.	H	α-helix	trans	-63.7	-43.2	-170.1	-155.3	171.6	-87.6	0	0	112.5	S540 D546 I547 K669 Y670	S540-E543 PolarHBondContact O-N 2.91Å; S540-E543 WeakPolarHBondContact OG-CB 3.43Å; E543-D546 PolarHBondContact O-N 3.39Å; E543-I547 WeakPolarHBondContact O-CD1 3.26Å; E543-I547 VanDerWaalsContact O-CG1 3.25Å; E543-I547 WeakPolarHBondContact O-CG1 3.35Å; E543-I547 PolarHBondContact O-N 3.29Å; E543-K669 WeakPolarHBondContact OE2-CE 3.45Å; E543-K669 IonicContact OE2-NZ 3.73Å; E543-K669 PolarHBondContact OE2-NZ 3.32Å; E543-Y670 VanDerWaalsContact CG-OH 3.32Å; E543-Y670 WeakPolarHBondContact CG-OH 3.09Å; E543-Y670 PolarHBondContact OE2-OH 2.71Å
544	Y	46.2	Very low	51.3	Low	34 Å²	34	79 Å²	79	13%	0.133	40%	0.401	C	S	.	.	H	α-helix	trans	-65.7	-41.8	176	-172.6	-120.3	0	0	0	112.6	L539 S540 K542 D546 I547 I548 Y670 I689	L539-Y544 HydrophobicContact CD1-CD1 3.86Å; L539-Y544 HydrophobicContact CD1-CD2 4.25Å; L539-Y544 HydrophobicContact CD1-CE1 4.43Å; L539-Y544 HydrophobicContact CD1-CG 3.72Å; L539-Y544 HydrophobicContact CD2-CD1 3.86Å; L539-Y544 HydrophobicContact CD2-CE1 4.46Å; L539-Y544 HydrophobicContact CD2-CG 4.44Å; L539-Y544 HydrophobicContact CG-CD1 4.23Å; L539-Y544 HydrophobicContact CG-CG 4.32Å; S540-Y544 PolarHBondContact O-N 3.38Å; K542-Y544 PolarHBondContact O-N 3.31Å; Y544-D546 VanDerWaalsContact C-N 3.32Å; Y544-D546 PolarHBondContact O-N 2.86Å; Y544-I547 PolarHBondContact O-N 3.47Å; Y544-I548 HydrophobicContact CD1-CD1 3.75Å; Y544-I548 HydrophobicContact CE1-CD1 3.38Å; Y544-I548 HydrophobicContact CE1-CG1 4.49Å; Y544-I548 HydrophobicContact CE2-CD1 4.28Å; Y544-I548 HydrophobicContact CG-CD1 4.37Å; Y544-I548 WeakPolarHBondContact O-CB 3.42Å; Y544-I548 WeakPolarHBondContact O-CG1 3.16Å; Y544-I548 PolarHBondContact O-N 3.45Å; Y544-Y670 AromaticContact CD2-CD1 3.42Å; Y544-Y670 HydrophobicContact CD2-CD1 3.42Å; Y544-Y670 VanDerWaalsContact CD2-CD1 3.42Å; Y544-Y670 AromaticContact CD2-CE1 3.64Å; Y544-Y670 HydrophobicContact CD2-CE1 3.64Å; Y544-Y670 HydrophobicContact CD2-CG 4.41Å; Y544-Y670 AromaticContact CE2-CD1 3.96Å; Y544-Y670 HydrophobicContact CE2-CD1 3.96Å; Y544-Y670 HydrophobicContact CG-CD1 4.41Å; Y544-Y670 HydrophobicContact CG-CE1 4.26Å; Y544-I689 HydrophobicContact CE2-CD1 4.07Å; Y544-I689 HydrophobicContact CE2-CG1 4.17Å
545	S	48.4	Very low	51.2	Low	17 Å²	17	78.8 Å²	78.8	12%	0.119	40%	0.4	C	S	.	.	H	α-helix	trans	-65	-37.9	175.6	-64.6	0	0	0	0	111.7	Q541 K542 I548 N549	Q541-S545 WeakPolarHBondContact O-CB 3.37Å; Q541-S545 PolarHBondContact O-OG 3.48Å; K542-S545 PolarHBondContact O-N 3.34Å; S545-I548 CarbonylContact O-C 3.53Å; S545-I548 PolarHBondContact O-N 2.95Å; S545-N549 VanDerWaalsContact O-CB 3.3Å; S545-N549 WeakPolarHBondContact O-CB 3.41Å; S545-N549 PolarHBondContact O-N 3.33Å; S545-N549 PolarHBondContact O-ND2 3.48Å; S545-N549 VanDerWaalsContact O-ND2 3.1Å
546	D	53.1	Low	51.5	Low	58 Å²	58	77.1 Å²	77.1	31%	0.31	39%	0.391	S	S	.	.	H	α-helix	trans	-73.4	-32	-177.3	-61.8	-11.3	0	0	0	110.5	R102 K542 E543 Y544 N549 T550	R102-D546 IonicContact CZ-OD1 3.79Å; R102-D546 IonicContact NH1-OD1 3.96Å; R102-D546 PolarHBondContact NH1-OD1 3.24Å; R102-D546 IonicContact NH2-OD1 2.7Å; K542-D546 WeakPolarHBondContact CG-OD2 3.47Å; K542-D546 WeakPolarHBondContact O-CB 3.43Å; K542-D546 PolarHBondContact O-N 3.04Å; E543-D546 PolarHBondContact O-N 3.39Å; Y544-D546 VanDerWaalsContact C-N 3.32Å; Y544-D546 PolarHBondContact O-N 2.86Å; D546-N549 PolarHBondContact O-N 3.27Å; D546-T550 VanDerWaalsContact O-CB 3.29Å; D546-T550 WeakPolarHBondContact O-CB 3.42Å; D546-T550 PolarHBondContact O-N 3.24Å; D546-T550 PolarHBondContact O-OG1 3.49Å
547	I	51.3	Low	52	Low	31 Å²	31	75.5 Å²	75.5	16%	0.159	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-47.6	165.6	-66.4	158	0	0	0	111.1	E543 Y544 N549 T550 Q551 P666 Y670	E543-I547 WeakPolarHBondContact O-CD1 3.26Å; E543-I547 VanDerWaalsContact O-CG1 3.25Å; E543-I547 WeakPolarHBondContact O-CG1 3.35Å; E543-I547 PolarHBondContact O-N 3.29Å; Y544-I547 PolarHBondContact O-N 3.47Å; I547-N549 VanDerWaalsContact C-N 3.28Å; I547-N549 PolarHBondContact O-N 3.42Å; I547-T550 PolarHBondContact O-N 3.07Å; I547-Q551 WeakPolarHBondContact O-CB 3.33Å; I547-Q551 PolarHBondContact O-N 2.86Å; I547-P666 HydrophobicContact CD1-CG 3.49Å; I547-P666 VanDerWaalsContact CD1-CG 3.49Å; I547-P666 HydrophobicContact CG1-CG 3.94Å; I547-P666 HydrophobicContact CG2-CG 4.23Å; I547-Y670 HydrophobicContact CD1-CD2 3.92Å; I547-Y670 HydrophobicContact CD1-CE1 4.06Å; I547-Y670 HydrophobicContact CD1-CE2 3.26Å
548	I	50.8	Low	52.4	Low	28 Å²	28	72.1 Å²	72.1	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-35.4	176.8	-84.1	177.2	0	0	0	112.2	Y544 S545 R692	Y544-I548 HydrophobicContact CD1-CD1 3.75Å; Y544-I548 HydrophobicContact CE1-CD1 3.38Å; Y544-I548 HydrophobicContact CE1-CG1 4.49Å; Y544-I548 HydrophobicContact CE2-CD1 4.28Å; Y544-I548 HydrophobicContact CG-CD1 4.37Å; Y544-I548 WeakPolarHBondContact O-CB 3.42Å; Y544-I548 WeakPolarHBondContact O-CG1 3.16Å; Y544-I548 PolarHBondContact O-N 3.45Å; S545-I548 CarbonylContact O-C 3.53Å; S545-I548 PolarHBondContact O-N 2.95Å; I548-R692 PolarHBondContact O-NH1 3.29Å
549	N	47.7	Very low	53	Low	97 Å²	97	71.3 Å²	71.3	52%	0.519	36%	0.361	S	S	.	.	H	α-helix	trans	-77.3	-34.6	177.6	-70.3	-28.5	0	0	0	112.4	S545 D546 I547 Q551	S545-N549 VanDerWaalsContact O-CB 3.3Å; S545-N549 WeakPolarHBondContact O-CB 3.41Å; S545-N549 PolarHBondContact O-N 3.33Å; S545-N549 PolarHBondContact O-ND2 3.48Å; S545-N549 VanDerWaalsContact O-ND2 3.1Å; D546-N549 PolarHBondContact O-N 3.27Å; I547-N549 VanDerWaalsContact C-N 3.28Å; I547-N549 PolarHBondContact O-N 3.42Å; N549-Q551 VanDerWaalsContact C-N 3.34Å
550	T	53.6	Low	53.8	Low	117 Å²	117	71.3 Å²	71.3	72%	0.718	36%	0.36	S	S	*	.	H	α-helix	trans	-76.7	-24.1	174.9	-52.1	0	0	0	0	111.7	D546 I547 E552	D546-T550 VanDerWaalsContact O-CB 3.29Å; D546-T550 WeakPolarHBondContact O-CB 3.42Å; D546-T550 PolarHBondContact O-N 3.24Å; D546-T550 PolarHBondContact O-OG1 3.49Å; I547-T550 PolarHBondContact O-N 3.07Å; T550-E552 VanDerWaalsContact C-N 3.34Å; T550-E552 PolarHBondContact O-N 2.94Å
551	Q	49.5	Very low	54.5	Low	12 Å²	12	69.7 Å²	69.7	6%	0.056	34%	0.344	C	S	.	.			trans	-77.8	86.6	172	-165.8	-177.4	6.8	0	0	110.7	I547 N549 I689 R692	I547-Q551 WeakPolarHBondContact O-CB 3.33Å; I547-Q551 PolarHBondContact O-N 2.86Å; N549-Q551 VanDerWaalsContact C-N 3.34Å; Q551-I689 PolarHBondContact NE2-O 3.37Å; Q551-I689 VanDerWaalsContact OE1-CA 3.32Å; Q551-I689 VanDerWaalsContact OE1-CG2 3.23Å; Q551-R692 VanDerWaalsContact CD-CB 3.46Å; Q551-R692 HydrophobicContact CG-CB 3.97Å; Q551-R692 PolarHBondContact O-NH1 3.15Å
552	E	51.9	Low	55.4	Low	172 Å²	172	69.2 Å²	69.2	80%	0.804	35%	0.352	S	S	*	.			trans	-47	138.7	157.9	-60.9	-175.3	155.2	0	0	110.1	T550 Y554	T550-E552 VanDerWaalsContact C-N 3.34Å; T550-E552 PolarHBondContact O-N 2.94Å; E552-Y554 PolarHBondContact O-N 2.74Å
553	M	52	Low	56.5	Low	106 Å²	106	64.7 Å²	64.7	52%	0.522	34%	0.335	S	S	.	.			trans	-67.4	118.7	175.3	-72	179	71.7	0	0	109.6	N555 R692	M553-N555 VanDerWaalsContact C-N 3.29Å; M553-N555 WeakPolarHBondContact CB-ND2 3.45Å; M553-N555 PolarHBondContact O-N 3.14Å; M553-N555 PolarHBondContact O-ND2 3.38Å; M553-R692 WeakPolarHBondContact CA-O 3.18Å; M553-R692 HydrophobicContact CG-CG 4.47Å
554	Y	56	Low	57.4	Low	79 Å²	79	64.8 Å²	64.8	31%	0.31	35%	0.346	S	S	.	.			trans	-74.4	83.5	177.9	-175.4	-104.6	0	0	0	110.4	E552 D556 T660 L662 R692	E552-Y554 PolarHBondContact O-N 2.74Å; Y554-D556 HydrophobicContact CE1-CB 4.07Å; Y554-D556 PolarHBondContact O-N 2.86Å; Y554-T660 HydrophobicContact CE1-CG2 4.11Å; Y554-L662 HydrophobicContact CD1-CB 3.92Å; Y554-L662 HydrophobicContact CD2-CB 4.06Å; Y554-L662 HydrophobicContact CD2-CD2 4Å; Y554-L662 HydrophobicContact CE1-CB 4.24Å; Y554-L662 HydrophobicContact CE2-CB 4.38Å; Y554-L662 HydrophobicContact CE2-CD2 4.19Å; Y554-L662 HydrophobicContact CG-CB 3.82Å; Y554-R692 PolarHBondContact N-O 2.95Å
555	N	59.2	Low	58.7	Low	49 Å²	49	70.5 Å²	70.5	26%	0.262	37%	0.374	S	S	.	.			trans	-97	63.6	-171.1	-72.9	-44.1	0	0	0	112.1	M553 D557 L558 I592	M553-N555 VanDerWaalsContact C-N 3.29Å; M553-N555 WeakPolarHBondContact CB-ND2 3.45Å; M553-N555 PolarHBondContact O-N 3.14Å; M553-N555 PolarHBondContact O-ND2 3.38Å; N555-D557 PolarHBondContact O-N 2.73Å; N555-L558 HydrophobicContact CB-CB 3.76Å; N555-L558 HydrophobicContact CB-CD2 4.49Å; N555-L558 WeakPolarHBondContact O-CB 3.41Å; N555-L558 PolarHBondContact O-N 2.95Å; N555-I592 HydrophobicContact CB-CD1 3.73Å; N555-I592 VanDerWaalsContact OD1-CD1 3.3Å; N555-I592 WeakPolarHBondContact OD1-CD1 3.48Å
556	D	60.8	Low	60	Low	40 Å²	40	71.6 Å²	71.6	21%	0.214	38%	0.378	C	S	.	.	H	α-helix	trans	-54.2	-39	172.7	-148.4	20.7	0	0	0	110.6	Y554 L558 I559 H560 T660	Y554-D556 HydrophobicContact CE1-CB 4.07Å; Y554-D556 PolarHBondContact O-N 2.86Å; D556-L558 VanDerWaalsContact C-N 3.29Å; D556-L558 PolarHBondContact O-N 2.85Å; D556-I559 WeakPolarHBondContact O-CB 3.48Å; D556-I559 PolarHBondContact O-N 2.83Å; D556-I559 VanDerWaalsContact O-N 3.12Å; D556-H560 PolarHBondContact O-CD2 2.99Å; D556-H560 PolarHBondContact O-N 3.37Å; D556-T660 WeakPolarHBondContact OD2-CB 3.48Å; D556-T660 PolarHBondContact OD2-OG1 3.06Å
557	D	61.3	Low	61.4	Low	17 Å²	17	71.8 Å²	71.8	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-47.1	-45.1	167.7	-92	17.9	0	0	0	113.2	N555 I559 H560 F561 S591 I592 R696	N555-D557 PolarHBondContact O-N 2.73Å; D557-I559 VanDerWaalsContact C-N 3.29Å; D557-I559 PolarHBondContact O-N 2.9Å; D557-H560 WeakPolarHBondContact O-CB 3.32Å; D557-H560 PolarHBondContact O-N 3.33Å; D557-F561 HydrophobicContact CB-CD2 4.18Å; D557-F561 HydrophobicContact CB-CE2 3.8Å; D557-F561 WeakPolarHBondContact O-CD2 3.44Å; D557-F561 VanDerWaalsContact O-CG 3.31Å; D557-F561 WeakPolarHBondContact O-CG 3.26Å; D557-F561 PolarHBondContact O-N 2.85Å; D557-S591 PolarHBondContact OD2-OG 2.8Å; D557-I592 HydrophobicContact CB-CD1 3.67Å; D557-I592 HydrophobicContact CB-CG1 4.1Å; D557-R696 IonicContact OD1-CZ 3.64Å; D557-R696 IonicContact OD1-NH1 2.69Å; D557-R696 IonicContact OD1-NH2 3.76Å; D557-R696 PolarHBondContact OD1-NH2 3.14Å; D557-R696 IonicContact OD2-CZ 2.66Å; D557-R696 IonicContact OD2-NH1 2.66Å; D557-R696 IonicContact OD2-NH2 2.71Å; D557-R696 PolarHBondContact OD2-NH2 2.84Å
558	L	63.3	Low	63.1	Low	88 Å²	88	74 Å²	74	46%	0.461	39%	0.391	S	S	.	.	H	α-helix	trans	-72.4	-24.3	-174.9	-169.5	64.2	0	0	0	112.2	N555 D556 S562 I592	N555-L558 HydrophobicContact CB-CB 3.76Å; N555-L558 HydrophobicContact CB-CD2 4.49Å; N555-L558 WeakPolarHBondContact O-CB 3.41Å; N555-L558 PolarHBondContact O-N 2.95Å; D556-L558 VanDerWaalsContact C-N 3.29Å; D556-L558 PolarHBondContact O-N 2.85Å; L558-S562 WeakPolarHBondContact O-CB 3.06Å; L558-S562 PolarHBondContact O-N 3.19Å; L558-S562 PolarHBondContact O-OG 2.81Å; L558-I592 HydrophobicContact CB-CD1 3.76Å
559	I	65.4	Low	65	Low	109 Å²	109	77.8 Å²	77.8	56%	0.559	41%	0.409	S	S	*	.	H	α-helix	trans	-71.1	-41.4	171.8	-53.7	176.3	0	0	0	109.1	D556 D557 S562 N563	D556-I559 WeakPolarHBondContact O-CB 3.48Å; D556-I559 PolarHBondContact O-N 2.83Å; D556-I559 VanDerWaalsContact O-N 3.12Å; D557-I559 VanDerWaalsContact C-N 3.29Å; D557-I559 PolarHBondContact O-N 2.9Å; I559-S562 PolarHBondContact O-N 2.89Å; I559-S562 PolarHBondContact O-OG 3.1Å; I559-N563 PolarHBondContact O-N 3.12Å; I559-N563 VanDerWaalsContact O-N 3.14Å
560	H	65.4	Low	67	Low	39 Å²	39	73.5 Å²	73.5	18%	0.181	39%	0.386	C	S	.	.	H	α-helix	trans	-65.3	-37	173.4	-74.8	-67.9	0	0	0	113.3	D556 D557 V653 C655 P656	D556-H560 PolarHBondContact O-CD2 2.99Å; D556-H560 PolarHBondContact O-N 3.37Å; D557-H560 WeakPolarHBondContact O-CB 3.32Å; D557-H560 PolarHBondContact O-N 3.33Å; H560-V653 HydrophobicContact CB-CG1 4.27Å; H560-C655 HydrophobicContact CB-CB 4.41Å; H560-P656 VanDerWaalsContact CE1-CD 3.48Å; H560-P656 WeakPolarHBondContact CE1-CD 3.43Å; H560-P656 WeakPolarHBondContact NE2-CD 3.25Å
561	F	65.8	Low	68.8	Low	33 Å²	33	72.8 Å²	72.8	15%	0.145	37%	0.374	C	S	.	.	H	α-helix	trans	-79.7	-23.3	177.3	-62.3	-47.4	0	0	0	114.6	D557 I592 L593 M620 V653	D557-F561 HydrophobicContact CB-CD2 4.18Å; D557-F561 HydrophobicContact CB-CE2 3.8Å; D557-F561 WeakPolarHBondContact O-CD2 3.44Å; D557-F561 VanDerWaalsContact O-CG 3.31Å; D557-F561 WeakPolarHBondContact O-CG 3.26Å; D557-F561 PolarHBondContact O-N 2.85Å; F561-I592 HydrophobicContact CE2-CB 4.49Å; F561-L593 HydrophobicContact CD1-CD1 3.83Å; F561-L593 HydrophobicContact CD2-CD1 3.76Å; F561-L593 HydrophobicContact CD2-CG 4.1Å; F561-L593 HydrophobicContact CE1-CD1 3.86Å; F561-L593 HydrophobicContact CE2-CB 3.96Å; F561-L593 HydrophobicContact CE2-CD1 3.78Å; F561-L593 HydrophobicContact CE2-CG 3.8Å; F561-L593 HydrophobicContact CG-CD1 3.8Å; F561-L593 HydrophobicContact CZ-CB 3.86Å; F561-L593 HydrophobicContact CZ-CD1 3.83Å; F561-L593 HydrophobicContact CZ-CG 4.08Å; F561-M620 HydrophobicContact CE1-CE 4.24Å; F561-M620 HydrophobicContact CE1-SD 4.18Å; F561-V653 HydrophobicContact CD1-CB 4.22Å; F561-V653 HydrophobicContact CD1-CG1 3.84Å; F561-V653 HydrophobicContact CD1-CG2 3.92Å; F561-V653 HydrophobicContact CE1-CB 4.21Å; F561-V653 HydrophobicContact CE1-CG1 4.05Å; F561-V653 HydrophobicContact CE1-CG2 4.22Å
562	S	66	Low	70.8	Confident	87 Å²	87	72.4 Å²	72.4	61%	0.608	37%	0.373	S	S	*	.	H	α-helix	trans	-88.9	-31.6	179.9	59.5	0	0	0	0	113.3	L558 I559 S564	L558-S562 WeakPolarHBondContact O-CB 3.06Å; L558-S562 PolarHBondContact O-N 3.19Å; L558-S562 PolarHBondContact O-OG 2.81Å; I559-S562 PolarHBondContact O-N 2.89Å; I559-S562 PolarHBondContact O-OG 3.1Å; S562-S564 PolarHBondContact O-N 3.24Å
563	N	71.1	Confident	72.6	Confident	54 Å²	54	71.6 Å²	71.6	29%	0.289	37%	0.369	S	S	.	.			trans	-74.5	110.9	173.5	-172.7	-1	0	0	0	111.1	I559 E565 N566	I559-N563 PolarHBondContact O-N 3.12Å; I559-N563 VanDerWaalsContact O-N 3.14Å; N563-E565 PolarHBondContact ND2-OE2 2.73Å; N563-E565 PolarHBondContact O-N 3.05Å; N563-E565 VanDerWaalsContact OD1-CB 3.31Å; N563-E565 WeakPolarHBondContact OD1-CB 3.24Å; N563-E565 VanDerWaalsContact OD1-CG 3.27Å; N563-E565 WeakPolarHBondContact OD1-CG 3.44Å; N563-E565 PolarHBondContact OD1-N 3.45Å; N563-E565 PolarHBondContact OD1-OE2 3.26Å; N563-N566 PolarHBondContact O-N 3.22Å; N563-N566 VanDerWaalsContact O-N 3.09Å
564	S	65.7	Low	74.5	Confident	94 Å²	94	67 Å²	67	66%	0.657	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.1	-22.4	176.2	51.8	0	0	0	0	114	S562 N566 C567	S562-S564 PolarHBondContact O-N 3.24Å; S564-N566 VanDerWaalsContact C-N 3.27Å; S564-N566 PolarHBondContact O-N 3.28Å; S564-C567 WeakPolarHBondContact O-CB 3.44Å; S564-C567 PolarHBondContact O-N 3.26Å
565	E	73.4	Confident	76.1	Confident	154 Å²	154	69.5 Å²	69.5	72%	0.72	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-66.9	-26.8	174.9	-58	172.5	144	0	0	112.9	N563 C567	N563-E565 PolarHBondContact ND2-OE2 2.73Å; N563-E565 PolarHBondContact O-N 3.05Å; N563-E565 VanDerWaalsContact OD1-CB 3.31Å; N563-E565 WeakPolarHBondContact OD1-CB 3.24Å; N563-E565 VanDerWaalsContact OD1-CG 3.27Å; N563-E565 WeakPolarHBondContact OD1-CG 3.44Å; N563-E565 PolarHBondContact OD1-N 3.45Å; N563-E565 PolarHBondContact OD1-OE2 3.26Å; E565-C567 VanDerWaalsContact C-N 3.35Å
566	N	77.6	Confident	77.5	Confident	40 Å²	40	75.2 Å²	75.2	21%	0.214	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-79.8	-19.7	175.7	-70.2	-37.1	0	0	0	112.5	N563 S564 K568 V653 S654	N563-N566 PolarHBondContact O-N 3.22Å; N563-N566 VanDerWaalsContact O-N 3.09Å; S564-N566 VanDerWaalsContact C-N 3.27Å; S564-N566 PolarHBondContact O-N 3.28Å; N566-K568 PolarHBondContact O-N 3.16Å; N566-V653 HydrophobicContact CB-CG1 4.5Å; N566-S654 PolarHBondContact O-N 2.66Å
567	C	82.1	Confident	78.5	Confident	62 Å²	62	75 Å²	75	42%	0.419	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	108.4	179.6	-66.9	0	0	0	0	110.2	S564 E565 I652	S564-C567 WeakPolarHBondContact O-CB 3.44Å; S564-C567 PolarHBondContact O-N 3.26Å; E565-C567 VanDerWaalsContact C-N 3.35Å; C567-I652 CarbonylContact C-O 3.41Å; C567-I652 WeakPolarHBondContact CA-O 3.23Å
568	K	87.4	Confident	79.9	Confident	76 Å²	76	76.3 Å²	76.3	33%	0.33	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115.5	-177.5	-56.6	163.7	-177.1	170.4	0	110	N566 L570 I652 S654	N566-K568 PolarHBondContact O-N 3.16Å; K568-L570 HydrophobicContact CB-CD2 3.98Å; K568-L570 HydrophobicContact CB-CG 4.42Å; K568-I652 HydrophobicContact CB-CD1 4.14Å; K568-I652 HydrophobicContact CB-CG1 3.79Å; K568-I652 HydrophobicContact CD-CD1 4.08Å; K568-I652 PolarHBondContact N-O 3.26Å; K568-I652 WeakPolarHBondContact O-CG1 3.42Å; K568-I652 PolarHBondContact O-N 3.12Å; K568-S654 VanDerWaalsContact NZ-CB 3.27Å; K568-S654 PolarHBondContact NZ-OG 3.28Å
569	E	89.3	Confident	81.3	Confident	108 Å²	108	74.6 Å²	74.6	51%	0.505	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	119.4	164.5	-176.2	174.5	-75.1	0	0	109	K649 N651	E569-K649 HydrophobicContact CG-CG 4.47Å; E569-K649 WeakPolarHBondContact OE1-CE 3.29Å; E569-K649 IonicContact OE1-NZ 2.71Å; E569-K649 PolarHBondContact OE1-NZ 3.19Å; E569-K649 VanDerWaalsContact OE2-CE 3.27Å; E569-K649 WeakPolarHBondContact OE2-CE 3.44Å; E569-K649 IonicContact OE2-NZ 3.12Å; E569-K649 PolarHBondContact OE2-NZ 2.68Å; E569-N651 WeakPolarHBondContact CB-OD1 3.48Å; E569-N651 WeakPolarHBondContact CG-OD1 3.42Å
570	L	90.9	Very high	82.4	Confident	8 Å²	8	69.5 Å²	69.5	4%	0.042	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.3	-177.8	-54.6	-174.3	0	0	0	110.7	K568 K612 L613 K649 L650 I652	K568-L570 HydrophobicContact CB-CD2 3.98Å; K568-L570 HydrophobicContact CB-CG 4.42Å; L570-K612 HydrophobicContact CD1-CB 4.06Å; L570-K612 HydrophobicContact CD2-CB 3.71Å; L570-K612 HydrophobicContact CD2-CD 4.01Å; L570-K612 HydrophobicContact CD2-CG 4.38Å; L570-K612 HydrophobicContact CG-CB 4.49Å; L570-L613 HydrophobicContact CD1-CD2 3.63Å; L570-L613 HydrophobicContact CD1-CG 3.79Å; L570-K649 CarbonylContact O-C 3.53Å; L570-K649 WeakPolarHBondContact O-CA 3.43Å; L570-L650 HydrophobicContact CB-CB 4.34Å; L570-L650 PolarHBondContact N-O 3.16Å; L570-L650 PolarHBondContact O-N 3.36Å; L570-I652 HydrophobicContact CD1-CD1 3.84Å; L570-I652 HydrophobicContact CD1-CG1 4.01Å; L570-I652 HydrophobicContact CG-CD1 4.47Å; L570-I652 HydrophobicContact CG-CG1 4.24Å
571	Q	91.2	Very high	83.6	Confident	101 Å²	101	67.7 Å²	67.7	47%	0.472	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.2	164.8	-61.6	-177.2	15.4	0	0	108.6	V648	Q571-V648 WeakPolarHBondContact CA-O 3.5Å
572	L	91.1	Very high	84.9	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.5	-174.9	-53.8	178.9	0	0	0	110.1	L580 S610 L613 Q647 V648 L650	L572-L580 HydrophobicContact CD1-CD1 3.78Å; L572-S610 WeakPolarHBondContact CD2-OG 3.42Å; L572-L613 HydrophobicContact CD1-CD1 3.95Å; L572-Q647 CarbonylContact O-C 3.54Å; L572-Q647 WeakPolarHBondContact O-CA 3.43Å; L572-V648 HydrophobicContact CB-CB 4.42Å; L572-V648 PolarHBondContact N-O 3.12Å; L572-V648 PolarHBondContact O-N 2.83Å; L572-L650 HydrophobicContact CD1-CD1 3.49Å; L572-L650 VanDerWaalsContact CD1-CD1 3.49Å; L572-L650 HydrophobicContact CD1-CG 4.05Å; L572-L650 HydrophobicContact CG-CD1 4.45Å
573	E	90.2	Very high	86.2	Confident	155 Å²	155	62.6 Å²	62.6	72%	0.724	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.6	-179	-66.1	177.2	-176.1	0	0	111.4	R609	E573-R609 PolarHBondContact O-NH2 3.2Å
574	K	91.6	Very high	87.2	Confident	11 Å²	11	60.3 Å²	60.3	5%	0.048	31%	0.308	C	S	.	.			trans	-144.6	162.2	178.2	79.4	179.7	-168.5	-58.9	0	112.9	E578 P606 L642 Q645 T646 V648	K574-E578 WeakPolarHBondContact CA-OE2 3.22Å; K574-E578 HydrophobicContact CB-CB 4.24Å; K574-E578 WeakPolarHBondContact CB-OE2 3.41Å; K574-E578 HydrophobicContact CD-CB 4.45Å; K574-E578 WeakPolarHBondContact CD-O 3.47Å; K574-E578 WeakPolarHBondContact CE-O 3.48Å; K574-E578 HydrophobicContact CG-CB 4.47Å; K574-P606 HydrophobicContact CB-CB 3.82Å; K574-P606 HydrophobicContact CB-CG 3.5Å; K574-P606 HydrophobicContact CD-CG 4.18Å; K574-L642 WeakPolarHBondContact CE-O 3.25Å; K574-L642 PolarHBondContact NZ-O 2.91Å; K574-Q645 WeakPolarHBondContact CE-O 3.33Å; K574-Q645 WeakPolarHBondContact CG-O 3.31Å; K574-Q645 PolarHBondContact NZ-O 2.72Å; K574-T646 PolarHBondContact N-O 3.1Å; K574-T646 CarbonylContact O-C 3.51Å; K574-T646 VanDerWaalsContact O-CA 3.24Å; K574-T646 WeakPolarHBondContact O-CA 3.4Å; K574-V648 VanDerWaalsContact NZ-CG2 3.27Å
575	H	89.6	Confident	88.4	Confident	131 Å²	131	56.5 Å²	56.5	61%	0.606	28%	0.28	S	S	*	.			trans	-82.2	152.2	178.4	-52.6	82.9	0	0	0	110.4	G577 E578	H575-G577 PolarHBondContact O-N 2.78Å; H575-E578 HydrophobicContact CB-CB 4.23Å; H575-E578 IonicContact CE1-OE2 2.72Å; H575-E578 IonicContact CG-OE2 3.15Å; H575-E578 PolarHBondContact N-OE2 3.01Å; H575-E578 IonicContact ND1-OE2 3.32Å; H575-E578 PolarHBondContact ND1-OE2 2.74Å; H575-E578 WeakPolarHBondContact O-CB 3.48Å; H575-E578 PolarHBondContact O-N 2.98Å
576	K	87.6	Confident	89	Confident	169 Å²	169	54.6 Å²	54.6	74%	0.735	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	124.1	173.9	-62.6	-172.5	178.1	179.9	0	109.3	T646	K576-T646 HydrophobicContact CD-CG2 4.35Å; K576-T646 HydrophobicContact CG-CG2 3.6Å
577	G	83.4	Confident	89	Confident	36 Å²	36	52.9 Å²	52.9	37%	0.371	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-12	-174.2	0	0	0	0	0	114.5	H575 K643	H575-G577 PolarHBondContact O-N 2.78Å; G577-K643 WeakPolarHBondContact CA-O 3.44Å; G577-K643 PolarHBondContact N-O 2.76Å; G577-K643 WeakPolarHBondContact O-CE 3.43Å
578	E	90.6	Very high	88.5	Confident	43 Å²	43	50.8 Å²	50.8	20%	0.201	25%	0.252	C	S	.	.			trans	-75.8	130.8	175.2	-159.1	176.2	-172.9	0	0	109.8	K574 H575 P606 R609	K574-E578 WeakPolarHBondContact CA-OE2 3.22Å; K574-E578 HydrophobicContact CB-CB 4.24Å; K574-E578 WeakPolarHBondContact CB-OE2 3.41Å; K574-E578 HydrophobicContact CD-CB 4.45Å; K574-E578 WeakPolarHBondContact CD-O 3.47Å; K574-E578 WeakPolarHBondContact CE-O 3.48Å; K574-E578 HydrophobicContact CG-CB 4.47Å; H575-E578 HydrophobicContact CB-CB 4.23Å; H575-E578 IonicContact CE1-OE2 2.72Å; H575-E578 IonicContact CG-OE2 3.15Å; H575-E578 PolarHBondContact N-OE2 3.01Å; H575-E578 IonicContact ND1-OE2 3.32Å; H575-E578 PolarHBondContact ND1-OE2 2.74Å; H575-E578 WeakPolarHBondContact O-CB 3.48Å; H575-E578 PolarHBondContact O-N 2.98Å; E578-P606 HydrophobicContact CG-CG 3.74Å; E578-P606 WeakPolarHBondContact OE1-CD 3.33Å; E578-P606 WeakPolarHBondContact OE1-CG 3.02Å; E578-R609 IonicContact OE1-CZ 3.63Å; E578-R609 IonicContact OE1-NH1 3.85Å; E578-R609 PolarHBondContact OE1-NH1 3.37Å; E578-R609 IonicContact OE1-NH2 2.66Å; E578-R609 PolarHBondContact OE1-NH2 3.31Å; E578-R609 IonicContact OE2-CZ 2.73Å; E578-R609 IonicContact OE2-NH1 2.69Å; E578-R609 IonicContact OE2-NH2 2.71Å; E578-R609 PolarHBondContact OE2-NH2 2.93Å
579	I	90.9	Very high	87.2	Confident	53 Å²	53	55.1 Å²	55.1	27%	0.272	27%	0.266	S	S	.	.			trans	-73.7	161.4	171.1	59.7	165.7	0	0	0	110.4	G581 M602 P606 K643 I750	I579-G581 PolarHBondContact O-N 2.82Å; I579-M602 HydrophobicContact CD1-CE 4.12Å; I579-M602 HydrophobicContact CD1-SD 4.24Å; I579-M602 HydrophobicContact CG1-CE 4.1Å; I579-P606 VanDerWaalsContact O-CD 3.29Å; I579-P606 WeakPolarHBondContact O-CD 3.39Å; I579-P606 WeakPolarHBondContact O-CG 3.47Å; I579-K643 HydrophobicContact CG2-CD 4.48Å; I579-I750 WeakPolarHBondContact CB-OXT 3.03Å
580	L	90.1	Very high	85.7	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.26	C	S	.	.			trans	-68.3	-29.6	-178.2	-174.7	58.2	0	0	0	111.8	L572 V582 P606 A607 I639 L642 I750	L572-L580 HydrophobicContact CD1-CD1 3.78Å; L580-V582 HydrophobicContact CB-CG2 4.27Å; L580-V582 HydrophobicContact CD2-CG1 4.27Å; L580-V582 HydrophobicContact CD2-CG2 3.92Å; L580-V582 HydrophobicContact CG-CG1 4.06Å; L580-V582 HydrophobicContact CG-CG2 4.15Å; L580-P606 HydrophobicContact CD1-CB 4.48Å; L580-P606 WeakPolarHBondContact O-CD 3.5Å; L580-A607 WeakPolarHBondContact O-CB 3.3Å; L580-A607 PolarHBondContact O-N 3.08Å; L580-A607 VanDerWaalsContact O-N 3.07Å; L580-I639 HydrophobicContact CB-CG2 4.22Å; L580-I639 HydrophobicContact CD2-CG2 4.05Å; L580-L642 HydrophobicContact CD2-CD1 4.25Å; L580-I750 CarbonylContact C-O 3.57Å; L580-I750 PolarHBondContact N-O 2.69Å; L580-I750 PolarHBondContact N-OXT 3.16Å
581	G	91	Very high	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.			trans	83.6	38	178.2	0	0	0	0	0	112.3	I579 M601 M602 I750	I579-G581 PolarHBondContact O-N 2.82Å; G581-M601 CarbonylContact O-C 3.53Å; G581-M601 WeakPolarHBondContact O-CA 3.15Å; G581-M602 WeakPolarHBondContact O-CB 3.21Å; G581-M602 PolarHBondContact O-N 3.11Å; G581-I750 PolarHBondContact N-O 3.39Å
582	V	92.9	Very high	83.5	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	155.5	-178	-64.9	0	0	0	0	112.1	L580 V584 L598 A607 I639 Y749 I750	L580-V582 HydrophobicContact CB-CG2 4.27Å; L580-V582 HydrophobicContact CD2-CG1 4.27Å; L580-V582 HydrophobicContact CD2-CG2 3.92Å; L580-V582 HydrophobicContact CG-CG1 4.06Å; L580-V582 HydrophobicContact CG-CG2 4.15Å; V582-V584 HydrophobicContact CG2-CG1 4.25Å; V582-L598 HydrophobicContact CB-CD1 3.67Å; V582-L598 HydrophobicContact CG1-CD1 3.69Å; V582-A607 HydrophobicContact CG1-CB 3.47Å; V582-A607 VanDerWaalsContact CG1-CB 3.47Å; V582-I639 HydrophobicContact CG2-CG2 4.05Å; V582-Y749 WeakPolarHBondContact O-CA 3.37Å; V582-I750 HydrophobicContact CG2-CG1 4.05Å; V582-I750 PolarHBondContact N-O 2.78Å; V582-I750 WeakPolarHBondContact O-CG1 3.15Å; V582-I750 PolarHBondContact O-N 2.87Å
583	V	92.4	Very high	82.7	Confident	13 Å²	13	52.8 Å²	52.8	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.1	162.9	-171.9	0	0	0	0	107.7	A599 N600 L740 P747 Y749	V583-A599 PolarHBondContact O-N 3.23Å; V583-N600 HydrophobicContact CB-CB 3.97Å; V583-N600 HydrophobicContact CG2-CB 3.95Å; V583-N600 PolarHBondContact N-O 3.23Å; V583-N600 PolarHBondContact O-N 3.4Å; V583-L740 HydrophobicContact CG1-CD1 3.83Å; V583-P747 HydrophobicContact CG2-CB 3.69Å; V583-Y749 HydrophobicContact CG2-CD1 3.48Å; V583-Y749 VanDerWaalsContact CG2-CD1 3.48Å; V583-Y749 HydrophobicContact CG2-CE1 3.67Å; V583-Y749 HydrophobicContact CG2-CG 4.29Å
584	V	92.2	Very high	82	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.03	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	143	-177.8	-64.3	0	0	0	0	111.6	V582 V596 I597 I619 L632 Q636 I639 I750	V582-V584 HydrophobicContact CG2-CG1 4.25Å; V584-V596 HydrophobicContact CB-CB 4.1Å; V584-V596 HydrophobicContact CB-CG2 4.36Å; V584-V596 HydrophobicContact CG1-CG2 4.37Å; V584-I597 WeakPolarHBondContact CA-O 3.17Å; V584-I619 HydrophobicContact CG1-CD1 4.19Å; V584-L632 HydrophobicContact CG2-CD1 4.14Å; V584-Q636 HydrophobicContact CG2-CG 3.78Å; V584-I639 HydrophobicContact CG1-CD1 3.92Å; V584-I639 HydrophobicContact CG2-CD1 3.95Å; V584-I750 HydrophobicContact CG2-CD1 3.99Å
585	V	90	Very high	81.6	Confident	14 Å²	14	48.6 Å²	48.6	9%	0.085	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.3	177.4	-59.2	0	0	0	0	110	V596 I597 A599 P734 A736 L740	V585-V596 CarbonylContact O-C 3.42Å; V585-V596 VanDerWaalsContact O-CA 3.28Å; V585-V596 WeakPolarHBondContact O-CA 3.29Å; V585-I597 HydrophobicContact CG2-CB 4.11Å; V585-I597 PolarHBondContact N-O 3.45Å; V585-I597 PolarHBondContact O-N 2.89Å; V585-A599 HydrophobicContact CB-CB 4.39Å; V585-A599 HydrophobicContact CG1-CB 3.66Å; V585-A599 HydrophobicContact CG2-CB 3.92Å; V585-P734 HydrophobicContact CG2-CB 4.3Å; V585-A736 HydrophobicContact CB-CB 4.48Å; V585-A736 HydrophobicContact CG1-CB 3.82Å; V585-L740 HydrophobicContact CG1-CD1 4.48Å
586	E	85.9	Confident	81.6	Confident	115 Å²	115	42.4 Å²	42.4	54%	0.537	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	149.2	175.4	-68	165.8	164	0	0	111.9	G588 L632	E586-G588 PolarHBondContact O-N 2.87Å; E586-G588 VanDerWaalsContact O-N 3.15Å; E586-L632 HydrophobicContact CG-CB 3.67Å; E586-L632 HydrophobicContact CG-CD1 4.27Å; E586-L632 HydrophobicContact CG-CD2 4.1Å; E586-L632 HydrophobicContact CG-CG 4.21Å; E586-L632 VanDerWaalsContact OE1-CB 3.22Å; E586-L632 WeakPolarHBondContact OE1-CB 3.42Å
587	S	78.8	Confident	81.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.021	20%	0.196	C	C	.	.			trans	-72.5	3.9	177.5	64.3	0	0	0	0	115.8	S591 L593 T595 R696	S587-S591 WeakPolarHBondContact OG-CB 3.37Å; S587-L593 PolarHBondContact OG-O 2.91Å; S587-T595 PolarHBondContact N-O 3.17Å; S587-T595 PolarHBondContact OG-N 3.26Å; S587-T595 VanDerWaalsContact OG-N 3.11Å; S587-T595 PolarHBondContact OG-O 3.4Å; S587-R696 WeakPolarHBondContact O-CD 3.34Å; S587-R696 PolarHBondContact O-NH1 3.04Å
588	G	70.6	Confident	82.1	Confident	18 Å²	18	33.2 Å²	33.2	19%	0.186	18%	0.178	C	C	.	.			trans	82.5	144.8	-179	0	0	0	0	0	113.2	E586 G590 S591	E586-G588 PolarHBondContact O-N 2.87Å; E586-G588 VanDerWaalsContact O-N 3.15Å; G588-G590 PolarHBondContact O-N 3.48Å; G588-S591 PolarHBondContact O-N 3.38Å
589	W	60.1	Low	82.1	Confident	168 Å²	168	31.1 Å²	31.1	64%	0.636	17%	0.168	S	C	*	.	B	Isolated β-bridge	trans	-68.4	120.8	174.5	-141.1	82.6	0	0	0	108.7	R696 V697	W589-R696 CarbonylContact O-C 3.53Å; W589-R696 WeakPolarHBondContact O-CA 3.35Å; W589-R696 VanDerWaalsContact O-CB 3.32Å; W589-R696 WeakPolarHBondContact O-CB 3.37Å; W589-V697 HydrophobicContact CB-CB 3.99Å; W589-V697 HydrophobicContact CB-CG2 4.38Å; W589-V697 PolarHBondContact O-N 2.99Å
590	G	58	Low	82.1	Confident	36 Å²	36	30 Å²	30	37%	0.371	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.4	7	-168.7	0	0	0	0	0	115.4	G588	G588-G590 PolarHBondContact O-N 3.48Å
591	S	69	Low	82.2	Confident	17 Å²	17	31.6 Å²	31.6	12%	0.119	17%	0.171	C	C	.	.			trans	-81	144.6	162.6	-174.3	0	0	0	0	110.9	D557 S587 G588 L593 R696	D557-S591 PolarHBondContact OD2-OG 2.8Å; S587-S591 WeakPolarHBondContact OG-CB 3.37Å; G588-S591 PolarHBondContact O-N 3.38Å; S591-L593 VanDerWaalsContact C-N 3.27Å; S591-L593 PolarHBondContact O-N 2.99Å; S591-L593 PolarHBondContact OG-O 2.86Å; S591-R696 PolarHBondContact OG-NH1 2.84Å
592	I	67.7	Low	82.2	Confident	66 Å²	66	34.1 Å²	34.1	34%	0.338	18%	0.183	S	C	.	.	S	Bend	trans	-63.1	-37.5	179.6	-50.5	174.8	0	0	0	111	N555 D557 L558 F561	N555-I592 HydrophobicContact CB-CD1 3.73Å; N555-I592 VanDerWaalsContact OD1-CD1 3.3Å; N555-I592 WeakPolarHBondContact OD1-CD1 3.48Å; D557-I592 HydrophobicContact CB-CD1 3.67Å; D557-I592 HydrophobicContact CB-CG1 4.1Å; L558-I592 HydrophobicContact CB-CD1 3.76Å; F561-I592 HydrophobicContact CE2-CB 4.49Å
593	L	73.6	Confident	82	Confident	53 Å²	53	41.9 Å²	41.9	28%	0.277	23%	0.225	S	C	.	.	S	Bend	trans	-118	105.5	175.3	-60.8	-178.7	0	0	0	107.7	F561 S587 S591 T595 M620 V628	F561-L593 HydrophobicContact CD1-CD1 3.83Å; F561-L593 HydrophobicContact CD2-CD1 3.76Å; F561-L593 HydrophobicContact CD2-CG 4.1Å; F561-L593 HydrophobicContact CE1-CD1 3.86Å; F561-L593 HydrophobicContact CE2-CB 3.96Å; F561-L593 HydrophobicContact CE2-CD1 3.78Å; F561-L593 HydrophobicContact CE2-CG 3.8Å; F561-L593 HydrophobicContact CG-CD1 3.8Å; F561-L593 HydrophobicContact CZ-CB 3.86Å; F561-L593 HydrophobicContact CZ-CD1 3.83Å; F561-L593 HydrophobicContact CZ-CG 4.08Å; S587-L593 PolarHBondContact OG-O 2.91Å; S591-L593 VanDerWaalsContact C-N 3.27Å; S591-L593 PolarHBondContact O-N 2.99Å; S591-L593 PolarHBondContact OG-O 2.86Å; L593-T595 HydrophobicContact CB-CG2 3.99Å; L593-T595 PolarHBondContact O-N 2.88Å; L593-T595 VanDerWaalsContact O-N 3.08Å; L593-M620 HydrophobicContact CB-CE 4.46Å; L593-M620 HydrophobicContact CD1-CE 3.55Å; L593-V628 HydrophobicContact CB-CG1 4.31Å; L593-V628 HydrophobicContact CD2-CG1 4.23Å
594	P	76.7	Confident	81.7	Confident	72 Å²	72	43.7 Å²	43.7	47%	0.468	25%	0.245	S	C	.	.			trans	-66.2	109.8	171.8	25.4	-32	0	0	0	108.7	V628 G629	P594-V628 WeakPolarHBondContact O-CA 3.28Å; P594-G629 PolarHBondContact O-N 3.03Å
595	T	83	Confident	81.5	Confident	6 Å²	6	43.5 Å²	43.5	4%	0.037	25%	0.245	C	C	.	.			trans	-141.4	-176.4	-175.6	69.3	0	0	0	0	110.1	S587 L593 Q618 M620 V628	S587-T595 PolarHBondContact N-O 3.17Å; S587-T595 PolarHBondContact OG-N 3.26Å; S587-T595 VanDerWaalsContact OG-N 3.11Å; S587-T595 PolarHBondContact OG-O 3.4Å; L593-T595 HydrophobicContact CB-CG2 3.99Å; L593-T595 PolarHBondContact O-N 2.88Å; L593-T595 VanDerWaalsContact O-N 3.08Å; T595-Q618 PolarHBondContact OG1-OE1 2.9Å; T595-M620 HydrophobicContact CG2-CE 3.97Å; T595-M620 HydrophobicContact CG2-SD 3.97Å; T595-V628 HydrophobicContact CG2-CB 4.44Å; T595-V628 HydrophobicContact CG2-CG1 4.35Å; T595-V628 HydrophobicContact CG2-CG2 4.02Å
596	V	89.1	Confident	81.6	Confident	1 Å²	1	43 Å²	43	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.2	171.6	-60.7	0	0	0	0	111.9	V584 V585 I619 L627 L632 C635	V584-V596 HydrophobicContact CB-CB 4.1Å; V584-V596 HydrophobicContact CB-CG2 4.36Å; V584-V596 HydrophobicContact CG1-CG2 4.37Å; V585-V596 CarbonylContact O-C 3.42Å; V585-V596 VanDerWaalsContact O-CA 3.28Å; V585-V596 WeakPolarHBondContact O-CA 3.29Å; V596-I619 HydrophobicContact CG2-CB 4Å; V596-I619 HydrophobicContact CG2-CD1 4.39Å; V596-I619 HydrophobicContact CG2-CG1 4.42Å; V596-I619 PolarHBondContact O-N 3.28Å; V596-L627 HydrophobicContact CG2-CD1 3.66Å; V596-L632 HydrophobicContact CG1-CD1 3.82Å; V596-C635 HydrophobicContact CG1-CB 3.56Å
597	I	90.3	Very high	81.8	Confident	11 Å²	11	37.5 Å²	37.5	6%	0.056	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.7	174.4	-54.4	177.1	0	0	0	109.4	V584 V585 A599 G616 Q618 P734 M737	V584-I597 WeakPolarHBondContact CA-O 3.17Å; V585-I597 HydrophobicContact CG2-CB 4.11Å; V585-I597 PolarHBondContact N-O 3.45Å; V585-I597 PolarHBondContact O-N 2.89Å; I597-A599 PolarHBondContact O-N 2.9Å; I597-A599 VanDerWaalsContact O-N 3.17Å; I597-G616 WeakPolarHBondContact CG2-O 3.22Å; I597-Q618 HydrophobicContact CG1-CG 3.76Å; I597-P734 HydrophobicContact CD1-CG 3.96Å; I597-M737 HydrophobicContact CB-CE 4.43Å; I597-M737 HydrophobicContact CG2-CE 3.42Å; I597-M737 VanDerWaalsContact CG2-CE 3.42Å
598	L	91.9	Very high	82.3	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	101.2	172	-178.6	53.1	0	0	0	110.8	V582 N600 M601 L613 G616 D617	V582-L598 HydrophobicContact CB-CD1 3.67Å; V582-L598 HydrophobicContact CG1-CD1 3.69Å; L598-N600 VanDerWaalsContact CD1-O 3.31Å; L598-N600 WeakPolarHBondContact CD1-O 3.39Å; L598-M601 HydrophobicContact CD1-CG 3.98Å; L598-M601 HydrophobicContact CD2-CG 3.97Å; L598-M601 HydrophobicContact CD2-SD 3.95Å; L598-M601 HydrophobicContact CG-CG 4.22Å; L598-L613 HydrophobicContact CD2-CB 3.93Å; L598-L613 HydrophobicContact CD2-CD1 4.41Å; L598-L613 HydrophobicContact CD2-CD2 4.04Å; L598-L613 HydrophobicContact CD2-CG 4.36Å; L598-G616 PolarHBondContact O-N 2.89Å; L598-D617 WeakPolarHBondContact CB-O 3.4Å; L598-D617 PolarHBondContact N-O 3.01Å
599	A	90.3	Very high	83.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-27.9	-175.7	0	0	0	0	0	114.4	V583 V585 I597 I615 M737 L740	V583-A599 PolarHBondContact O-N 3.23Å; V585-A599 HydrophobicContact CB-CB 4.39Å; V585-A599 HydrophobicContact CG1-CB 3.66Å; V585-A599 HydrophobicContact CG2-CB 3.92Å; I597-A599 PolarHBondContact O-N 2.9Å; I597-A599 VanDerWaalsContact O-N 3.17Å; A599-I615 WeakPolarHBondContact O-CG2 3.3Å; A599-M737 HydrophobicContact CB-CB 4.07Å; A599-M737 HydrophobicContact CB-CE 4.43Å; A599-M737 HydrophobicContact CB-CG 4.04Å; A599-L740 HydrophobicContact CB-CD1 3.92Å
600	N	90.8	Very high	84.6	Confident	29 Å²	29	37.2 Å²	37.2	16%	0.155	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	160.3	175.5	-155.9	-8.8	0	0	0	111.3	V583 L598	V583-N600 HydrophobicContact CB-CB 3.97Å; V583-N600 HydrophobicContact CG2-CB 3.95Å; V583-N600 PolarHBondContact N-O 3.23Å; V583-N600 PolarHBondContact O-N 3.4Å; L598-N600 VanDerWaalsContact CD1-O 3.31Å; L598-N600 WeakPolarHBondContact CD1-O 3.39Å
601	M	91.1	Very high	85.9	Confident	35 Å²	35	38.7 Å²	38.7	17%	0.172	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	141	176.4	-72.6	-172.7	-79.1	0	0	111.7	G581 L598 N603 A607 A608 L613 I615 Y749	G581-M601 CarbonylContact O-C 3.53Å; G581-M601 WeakPolarHBondContact O-CA 3.15Å; L598-M601 HydrophobicContact CD1-CG 3.98Å; L598-M601 HydrophobicContact CD2-CG 3.97Å; L598-M601 HydrophobicContact CD2-SD 3.95Å; L598-M601 HydrophobicContact CG-CG 4.22Å; M601-N603 PolarHBondContact O-N 2.9Å; M601-A607 HydrophobicContact CG-CB 4.45Å; M601-A607 HydrophobicContact SD-CB 4.2Å; M601-A608 HydrophobicContact CB-CB 4.47Å; M601-L613 HydrophobicContact CE-CB 4.5Å; M601-L613 WeakPolarHBondContact CE-O 3.44Å; M601-L613 HydrophobicContact SD-CB 3.78Å; M601-I615 HydrophobicContact CE-CG1 4.05Å; M601-Y749 VanDerWaalsContact C-CE1 3.44Å
602	M	90.9	Very high	86.8	Confident	54 Å²	54	43.5 Å²	43.5	27%	0.266	26%	0.256	S	S	.	.			trans	-75	119.7	176.5	-169.7	172	68.4	0	0	109.6	I579 G581 G604 G605 A608 Y749	I579-M602 HydrophobicContact CD1-CE 4.12Å; I579-M602 HydrophobicContact CD1-SD 4.24Å; I579-M602 HydrophobicContact CG1-CE 4.1Å; G581-M602 WeakPolarHBondContact O-CB 3.21Å; G581-M602 PolarHBondContact O-N 3.11Å; M602-G604 PolarHBondContact O-N 3.43Å; M602-G605 PolarHBondContact O-N 3.47Å; M602-A608 WeakPolarHBondContact O-CB 3.33Å; M602-Y749 HydrophobicContact CB-CD1 3.67Å; M602-Y749 HydrophobicContact CB-CD2 4.06Å; M602-Y749 HydrophobicContact CB-CE1 3.83Å; M602-Y749 HydrophobicContact CB-CE2 4.19Å; M602-Y749 HydrophobicContact CB-CG 3.8Å; M602-Y749 HydrophobicContact CG-CD1 4.48Å; M602-Y749 HydrophobicContact CG-CD2 3.97Å; M602-Y749 HydrophobicContact CG-CE2 4.1Å; M602-Y749 HydrophobicContact CG-CG 4.16Å; M602-Y749 VanDerWaalsContact N-CE1 3.28Å; M602-Y749 HydrophobicContact SD-CD2 4.06Å; M602-Y749 HydrophobicContact SD-CG 4.21Å
603	N	88.9	Confident	87.9	Confident	164 Å²	164	40.9 Å²	40.9	88%	0.877	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	127.4	176.7	-169.7	11.8	0	0	0	110.6	M601 G605	M601-N603 PolarHBondContact O-N 2.9Å; N603-G605 VanDerWaalsContact C-N 3.27Å; N603-G605 PolarHBondContact O-N 3.33Å
604	G	86.3	Confident	88.7	Confident	50 Å²	50	41.1 Å²	41.1	52%	0.515	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	-10.2	-174.4	0	0	0	0	0	116.4	M602	M602-G604 PolarHBondContact O-N 3.43Å
605	G	89.6	Confident	89.3	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.021	24%	0.241	C	C	.	.	S	Bend	trans	-69.8	163	175.3	0	0	0	0	0	112.9	M602 N603 A607 A608 R609	M602-G605 PolarHBondContact O-N 3.47Å; N603-G605 VanDerWaalsContact C-N 3.27Å; N603-G605 PolarHBondContact O-N 3.33Å; G605-A607 VanDerWaalsContact C-N 3.3Å; G605-A607 PolarHBondContact O-N 3.14Å; G605-A608 PolarHBondContact O-N 3.12Å; G605-A608 VanDerWaalsContact O-N 3.12Å; G605-R609 VanDerWaalsContact O-CB 3.29Å; G605-R609 WeakPolarHBondContact O-CB 3.13Å; G605-R609 PolarHBondContact O-N 2.74Å
606	P	90.9	Very high	89.5	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-51.8	-42	-175.4	-29	34.6	0	0	0	115.1	K574 E578 I579 L580 R609 S610	K574-P606 HydrophobicContact CB-CB 3.82Å; K574-P606 HydrophobicContact CB-CG 3.5Å; K574-P606 HydrophobicContact CD-CG 4.18Å; E578-P606 HydrophobicContact CG-CG 3.74Å; E578-P606 WeakPolarHBondContact OE1-CD 3.33Å; E578-P606 WeakPolarHBondContact OE1-CG 3.02Å; I579-P606 VanDerWaalsContact O-CD 3.29Å; I579-P606 WeakPolarHBondContact O-CD 3.39Å; I579-P606 WeakPolarHBondContact O-CG 3.47Å; L580-P606 HydrophobicContact CD1-CB 4.48Å; L580-P606 WeakPolarHBondContact O-CD 3.5Å; P606-R609 PolarHBondContact O-N 3.21Å; P606-S610 PolarHBondContact O-N 3.41Å; P606-S610 VanDerWaalsContact O-N 3.16Å
607	A	90.1	Very high	89.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-53.9	176.8	0	0	0	0	0	112	L580 V582 M601 G605 S610 L613	L580-A607 WeakPolarHBondContact O-CB 3.3Å; L580-A607 PolarHBondContact O-N 3.08Å; L580-A607 VanDerWaalsContact O-N 3.07Å; V582-A607 HydrophobicContact CG1-CB 3.47Å; V582-A607 VanDerWaalsContact CG1-CB 3.47Å; M601-A607 HydrophobicContact CG-CB 4.45Å; M601-A607 HydrophobicContact SD-CB 4.2Å; G605-A607 VanDerWaalsContact C-N 3.3Å; G605-A607 PolarHBondContact O-N 3.14Å; A607-S610 WeakPolarHBondContact O-CB 3.31Å; A607-S610 PolarHBondContact O-N 3.09Å; A607-S610 PolarHBondContact O-OG 2.93Å; A607-L613 HydrophobicContact CB-CD1 3.61Å
608	A	89.9	Confident	89.5	Confident	35 Å²	35	40 Å²	40	29%	0.289	24%	0.238	S	C	.	.	H	α-helix	trans	-66.3	-40.3	178.4	0	0	0	0	0	112.4	M601 M602 G605 S610 G611	M601-A608 HydrophobicContact CB-CB 4.47Å; M602-A608 WeakPolarHBondContact O-CB 3.33Å; G605-A608 PolarHBondContact O-N 3.12Å; G605-A608 VanDerWaalsContact O-N 3.12Å; A608-S610 PolarHBondContact O-N 3.23Å; A608-G611 PolarHBondContact O-N 2.8Å
609	R	90.6	Very high	89.5	Confident	113 Å²	113	40.1 Å²	40.1	43%	0.426	24%	0.238	S	C	.	.	H	α-helix	trans	-58.6	-26.4	177.8	-179.1	169.9	66.5	-130.5	9.9	112.9	E573 E578 G605 P606	E573-R609 PolarHBondContact O-NH2 3.2Å; E578-R609 IonicContact OE1-CZ 3.63Å; E578-R609 IonicContact OE1-NH1 3.85Å; E578-R609 PolarHBondContact OE1-NH1 3.37Å; E578-R609 IonicContact OE1-NH2 2.66Å; E578-R609 PolarHBondContact OE1-NH2 3.31Å; E578-R609 IonicContact OE2-CZ 2.73Å; E578-R609 IonicContact OE2-NH1 2.69Å; E578-R609 IonicContact OE2-NH2 2.71Å; E578-R609 PolarHBondContact OE2-NH2 2.93Å; G605-R609 VanDerWaalsContact O-CB 3.29Å; G605-R609 WeakPolarHBondContact O-CB 3.13Å; G605-R609 PolarHBondContact O-N 2.74Å; P606-R609 PolarHBondContact O-N 3.21Å
610	S	87.2	Confident	89.5	Confident	34 Å²	34	41.6 Å²	41.6	24%	0.238	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-27.4	176.6	78.8	0	0	0	0	114.4	L572 P606 A607 A608 K612	L572-S610 WeakPolarHBondContact CD2-OG 3.42Å; P606-S610 PolarHBondContact O-N 3.41Å; P606-S610 VanDerWaalsContact O-N 3.16Å; A607-S610 WeakPolarHBondContact O-CB 3.31Å; A607-S610 PolarHBondContact O-N 3.09Å; A607-S610 PolarHBondContact O-OG 2.93Å; A608-S610 PolarHBondContact O-N 3.23Å; S610-K612 PolarHBondContact O-N 2.8Å; S610-K612 VanDerWaalsContact O-N 3.09Å; S610-K612 PolarHBondContact OG-N 3.42Å
611	G	87	Confident	89.5	Confident	67 Å²	67	41 Å²	41	69%	0.691	24%	0.244	S	C	*	.	S	Bend	trans	63.6	1.6	-171	0	0	0	0	0	115.9	A608	A608-G611 PolarHBondContact O-N 2.8Å
612	K	86.7	Confident	89.5	Confident	118 Å²	118	39.4 Å²	39.4	51%	0.513	24%	0.236	S	C	.	.			trans	-98.9	-16.7	-173.8	-63.9	174.2	-170.2	176.1	0	114.4	L570 S610	L570-K612 HydrophobicContact CD1-CB 4.06Å; L570-K612 HydrophobicContact CD2-CB 3.71Å; L570-K612 HydrophobicContact CD2-CD 4.01Å; L570-K612 HydrophobicContact CD2-CG 4.38Å; L570-K612 HydrophobicContact CG-CB 4.49Å; S610-K612 PolarHBondContact O-N 2.8Å; S610-K612 VanDerWaalsContact O-N 3.09Å; S610-K612 PolarHBondContact OG-N 3.42Å
613	L	90.3	Very high	89.4	Confident	11 Å²	11	39.9 Å²	39.9	6%	0.058	24%	0.24	C	C	.	.			trans	-94.5	143.5	175.8	-76.3	168.5	0	0	0	111	L570 L572 L598 M601 A607 L650 I652	L570-L613 HydrophobicContact CD1-CD2 3.63Å; L570-L613 HydrophobicContact CD1-CG 3.79Å; L572-L613 HydrophobicContact CD1-CD1 3.95Å; L598-L613 HydrophobicContact CD2-CB 3.93Å; L598-L613 HydrophobicContact CD2-CD1 4.41Å; L598-L613 HydrophobicContact CD2-CD2 4.04Å; L598-L613 HydrophobicContact CD2-CG 4.36Å; M601-L613 HydrophobicContact CE-CB 4.5Å; M601-L613 WeakPolarHBondContact CE-O 3.44Å; M601-L613 HydrophobicContact SD-CB 3.78Å; A607-L613 HydrophobicContact CB-CD1 3.61Å; L613-L650 HydrophobicContact CD1-CD1 4.11Å; L613-L650 HydrophobicContact CD2-CD1 4.18Å; L613-I652 HydrophobicContact CD2-CD1 4.18Å; L613-I652 HydrophobicContact CD2-CG2 4Å
614	S	90.1	Very high	89.2	Confident	58 Å²	58	35.2 Å²	35.2	41%	0.406	23%	0.23	S	C	.	.			trans	-127.8	147.8	178.1	-59.1	0	0	0	0	111.3	G616 D617	S614-G616 PolarHBondContact O-N 3.18Å; S614-D617 PolarHBondContact N-OD2 2.9Å; S614-D617 WeakPolarHBondContact O-CB 3.4Å; S614-D617 PolarHBondContact O-N 3.48Å; S614-D617 VanDerWaalsContact O-N 3.13Å
615	I	89.5	Confident	89.3	Confident	60 Å²	60	36.3 Å²	36.3	31%	0.308	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	122.6	174.5	-61.8	176	0	0	0	108.4	A599 M601 L741	A599-I615 WeakPolarHBondContact O-CG2 3.3Å; M601-I615 HydrophobicContact CE-CG1 4.05Å; I615-L741 HydrophobicContact CG2-CD2 4.49Å
616	G	87.9	Confident	89.3	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.01	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.7	-19.7	-170	0	0	0	0	0	114.6	I597 L598 S614 C655	I597-G616 WeakPolarHBondContact CG2-O 3.22Å; L598-G616 PolarHBondContact O-N 2.89Å; S614-G616 PolarHBondContact O-N 3.18Å; G616-C655 CarbonylContact C-O 3.56Å; G616-C655 PolarHBondContact O-SG 3.36Å
617	D	90.4	Very high	89.1	Confident	2 Å²	2	39 Å²	39	1%	0.011	25%	0.245	C	C	.	.			trans	-61	136.8	177	-69.9	-24	0	0	0	111.4	L598 S614 I652 S654	L598-D617 WeakPolarHBondContact CB-O 3.4Å; L598-D617 PolarHBondContact N-O 3.01Å; S614-D617 PolarHBondContact N-OD2 2.9Å; S614-D617 WeakPolarHBondContact O-CB 3.4Å; S614-D617 PolarHBondContact O-N 3.48Å; S614-D617 VanDerWaalsContact O-N 3.13Å; D617-I652 HydrophobicContact CB-CD1 3.95Å; D617-I652 VanDerWaalsContact OD2-CD1 3.23Å; D617-I652 WeakPolarHBondContact OD2-CD1 3.25Å; D617-S654 VanDerWaalsContact OD1-CA 3.25Å; D617-S654 WeakPolarHBondContact OD1-CA 3.48Å; D617-S654 WeakPolarHBondContact OD1-CB 3.48Å; D617-S654 PolarHBondContact OD1-OG 3.46Å
618	Q	89.4	Confident	88.9	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.019	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134	172.3	-85	177.7	78.8	0	0	110.8	T595 I597 M620 I652 V653 C655	T595-Q618 PolarHBondContact OG1-OE1 2.9Å; I597-Q618 HydrophobicContact CG1-CG 3.76Å; Q618-M620 HydrophobicContact CB-SD 4.34Å; Q618-I652 CarbonylContact O-C 3.5Å; Q618-I652 WeakPolarHBondContact O-CA 3.39Å; Q618-I652 WeakPolarHBondContact O-CB 3.42Å; Q618-V653 PolarHBondContact N-O 2.93Å; Q618-V653 PolarHBondContact O-N 3.45Å; Q618-C655 PolarHBondContact NE2-SG 2.87Å
619	I	91.3	Very high	88.5	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.8	179	-47.5	178.8	0	0	0	109.5	V584 V596 I622 L627 L650 I652	V584-I619 HydrophobicContact CG1-CD1 4.19Å; V596-I619 HydrophobicContact CG2-CB 4Å; V596-I619 HydrophobicContact CG2-CD1 4.39Å; V596-I619 HydrophobicContact CG2-CG1 4.42Å; V596-I619 PolarHBondContact O-N 3.28Å; I619-I622 HydrophobicContact CG2-CD1 4.31Å; I619-I622 HydrophobicContact CG2-CG1 3.96Å; I619-L627 HydrophobicContact CB-CD1 4.17Å; I619-L627 HydrophobicContact CG2-CD1 3.86Å; I619-L650 HydrophobicContact CG2-CD2 4.45Å; I619-I652 HydrophobicContact CG1-CG2 4.2Å; I619-I652 HydrophobicContact CG2-CG2 4.48Å
620	M	89.9	Confident	88.2	Confident	31 Å²	31	40 Å²	40	15%	0.153	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-40	-175.6	-52.7	-51.7	-67.3	0	0	112.4	F561 L593 T595 Q618 L627 V628 N651 V653	F561-M620 HydrophobicContact CE1-CE 4.24Å; F561-M620 HydrophobicContact CE1-SD 4.18Å; L593-M620 HydrophobicContact CB-CE 4.46Å; L593-M620 HydrophobicContact CD1-CE 3.55Å; T595-M620 HydrophobicContact CG2-CE 3.97Å; T595-M620 HydrophobicContact CG2-SD 3.97Å; Q618-M620 HydrophobicContact CB-SD 4.34Å; M620-L627 PolarHBondContact O-N 2.81Å; M620-V628 HydrophobicContact CE-CG2 3.76Å; M620-N651 PolarHBondContact N-O 3.47Å; M620-V653 HydrophobicContact CG-CB 4.45Å; M620-V653 HydrophobicContact CG-CG2 3.65Å; M620-V653 HydrophobicContact SD-CB 4.38Å; M620-V653 HydrophobicContact SD-CG2 3.88Å
621	S	91.1	Very high	88.2	Confident	18 Å²	18	42.2 Å²	42.2	13%	0.126	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	157.3	175.7	54.4	0	0	0	0	112.9	T625 L650 N651	S621-T625 CarbonylContact C-O 3.59Å; S621-T625 WeakPolarHBondContact CA-O 3.27Å; S621-T625 WeakPolarHBondContact CB-O 3.31Å; S621-L650 WeakPolarHBondContact O-CA 3.29Å; S621-N651 PolarHBondContact N-O 3.13Å; S621-N651 PolarHBondContact O-N 2.97Å; S621-N651 WeakPolarHBondContact OG-CB 3.17Å; S621-N651 PolarHBondContact OG-ND2 2.78Å
622	I	92.4	Very high	88.2	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.4	177	-54.1	-168.6	0	0	0	108.8	I619 G624 T625 L627 I638 I639 L642 V648 K649 L650	I619-I622 HydrophobicContact CG2-CD1 4.31Å; I619-I622 HydrophobicContact CG2-CG1 3.96Å; I622-G624 PolarHBondContact O-N 3.26Å; I622-G624 VanDerWaalsContact O-N 3.13Å; I622-T625 PolarHBondContact N-O 2.93Å; I622-T625 VanDerWaalsContact O-CB 3.31Å; I622-T625 WeakPolarHBondContact O-CB 3.45Å; I622-T625 PolarHBondContact O-N 3.05Å; I622-L627 HydrophobicContact CD1-CD1 3.86Å; I622-L627 HydrophobicContact CG1-CD1 3.92Å; I622-L627 HydrophobicContact CG1-CD2 4.47Å; I622-L627 HydrophobicContact CG1-CG 4.24Å; I622-I638 HydrophobicContact CB-CG2 4.41Å; I622-I638 HydrophobicContact CD1-CG2 4.45Å; I622-I639 HydrophobicContact CD1-CD1 4.27Å; I622-I639 HydrophobicContact CD1-CG1 3.5Å; I622-I639 VanDerWaalsContact CD1-CG1 3.5Å; I622-L642 HydrophobicContact CD1-CD1 4.4Å; I622-L642 HydrophobicContact CG2-CD1 3.8Å; I622-L642 HydrophobicContact CG2-CD2 3.67Å; I622-L642 HydrophobicContact CG2-CG 4.33Å; I622-V648 HydrophobicContact CG2-CG1 3.95Å; I622-K649 CarbonylContact C-O 3.56Å; I622-K649 WeakPolarHBondContact CA-O 3.34Å; I622-L650 HydrophobicContact CB-CD2 4.17Å; I622-L650 HydrophobicContact CD1-CD2 3.95Å; I622-L650 HydrophobicContact CG1-CD2 3.63Å; I622-L650 HydrophobicContact CG2-CD2 3.93Å
623	N	88.8	Confident	88.4	Confident	64 Å²	64	38.9 Å²	38.9	34%	0.342	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	32.1	-178.1	-60	-34.4	0	0	0	114	T625 L642 Q645 K649	N623-T625 VanDerWaalsContact C-N 3.32Å; N623-L642 WeakPolarHBondContact ND2-CD2 3.48Å; N623-Q645 PolarHBondContact ND2-OE1 2.96Å; N623-K649 PolarHBondContact N-O 2.91Å; N623-K649 PolarHBondContact OD1-N 2.92Å
624	G	83.6	Confident	88.4	Confident	65 Å²	65	41.5 Å²	41.5	67%	0.67	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-16.4	-174.9	0	0	0	0	0	114.9	I622 S626	I622-G624 PolarHBondContact O-N 3.26Å; I622-G624 VanDerWaalsContact O-N 3.13Å; G624-S626 PolarHBondContact O-N 3Å
625	T	88.7	Confident	88.4	Confident	74 Å²	74	38.8 Å²	38.8	45%	0.454	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	116.8	172.6	-53.3	0	0	0	0	110	S621 I622 N623 I638	S621-T625 CarbonylContact C-O 3.59Å; S621-T625 WeakPolarHBondContact CA-O 3.27Å; S621-T625 WeakPolarHBondContact CB-O 3.31Å; I622-T625 PolarHBondContact N-O 2.93Å; I622-T625 VanDerWaalsContact O-CB 3.31Å; I622-T625 WeakPolarHBondContact O-CB 3.45Å; I622-T625 PolarHBondContact O-N 3.05Å; N623-T625 VanDerWaalsContact C-N 3.32Å; T625-I638 HydrophobicContact CG2-CD1 4.08Å
626	S	88.4	Confident	88.5	Confident	61 Å²	61	38.3 Å²	38.3	43%	0.427	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	141.2	173	-173.9	0	0	0	0	111.5	G624 V628 L630	G624-S626 PolarHBondContact O-N 3Å; S626-V628 PolarHBondContact OG-N 3.15Å; S626-L630 VanDerWaalsContact O-CD1 3.26Å; S626-L630 WeakPolarHBondContact O-CD1 3.27Å
627	L	86.8	Confident	88.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	28%	0.277	C	S	.	.			trans	-102.5	-6.2	167.8	-59.4	-168.9	0	0	0	112.7	V596 I619 M620 I622 G629 L630 C635 I638	V596-L627 HydrophobicContact CG2-CD1 3.66Å; I619-L627 HydrophobicContact CB-CD1 4.17Å; I619-L627 HydrophobicContact CG2-CD1 3.86Å; M620-L627 PolarHBondContact O-N 2.81Å; I622-L627 HydrophobicContact CD1-CD1 3.86Å; I622-L627 HydrophobicContact CG1-CD1 3.92Å; I622-L627 HydrophobicContact CG1-CD2 4.47Å; I622-L627 HydrophobicContact CG1-CG 4.24Å; L627-G629 PolarHBondContact O-N 2.96Å; L627-L630 HydrophobicContact CD2-CD1 4.48Å; L627-L630 PolarHBondContact O-N 3.21Å; L627-C635 HydrophobicContact CD1-CB 4.46Å; L627-C635 HydrophobicContact CD2-CB 4.43Å; L627-I638 HydrophobicContact CD2-CD1 3.69Å; L627-I638 HydrophobicContact CD2-CG2 4.32Å
628	V	86.1	Confident	88.8	Confident	52 Å²	52	42 Å²	42	32%	0.315	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	125.8	-178.9	-169.1	0	0	0	0	109.7	L593 P594 T595 M620 S626 L630	L593-V628 HydrophobicContact CB-CG1 4.31Å; L593-V628 HydrophobicContact CD2-CG1 4.23Å; P594-V628 WeakPolarHBondContact O-CA 3.28Å; T595-V628 HydrophobicContact CG2-CB 4.44Å; T595-V628 HydrophobicContact CG2-CG1 4.35Å; T595-V628 HydrophobicContact CG2-CG2 4.02Å; M620-V628 HydrophobicContact CE-CG2 3.76Å; S626-V628 PolarHBondContact OG-N 3.15Å; V628-L630 VanDerWaalsContact C-N 3.27Å; V628-L630 PolarHBondContact O-N 3.15Å
629	G	81.7	Confident	88.9	Confident	51 Å²	51	41.9 Å²	41.9	53%	0.526	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	-7.6	-178.3	0	0	0	0	0	115.4	P594 L627	P594-G629 PolarHBondContact O-N 3.03Å; L627-G629 PolarHBondContact O-N 2.96Å
630	L	84.8	Confident	88.8	Confident	66 Å²	66	46.8 Å²	46.8	35%	0.346	31%	0.307	S	S	.	.			trans	-82.3	138.4	179.9	-64.3	-171.9	0	0	0	111.8	S626 L627 V628 T634 C635 I638	S626-L630 VanDerWaalsContact O-CD1 3.26Å; S626-L630 WeakPolarHBondContact O-CD1 3.27Å; L627-L630 HydrophobicContact CD2-CD1 4.48Å; L627-L630 PolarHBondContact O-N 3.21Å; V628-L630 VanDerWaalsContact C-N 3.27Å; V628-L630 PolarHBondContact O-N 3.15Å; L630-T634 HydrophobicContact CD1-CG2 4.15Å; L630-C635 VanDerWaalsContact CB-SG 3.56Å; L630-I638 HydrophobicContact CD1-CD1 3.75Å
631	P	87.3	Confident	88.8	Confident	80 Å²	80	48 Å²	48	52%	0.519	33%	0.327	S	S	.	.			trans	-57.8	148.9	173.8	-25.6	34.4	0	0	0	112.8	A633 T634 C635	P631-A633 PolarHBondContact O-N 3.49Å; P631-A633 VanDerWaalsContact O-N 3.13Å; P631-T634 WeakPolarHBondContact O-CA 3.37Å; P631-T634 WeakPolarHBondContact O-CB 3.28Å; P631-T634 PolarHBondContact O-N 3.22Å; P631-C635 PolarHBondContact O-N 3.03Å
632	L	88	Confident	88.7	Confident	37 Å²	37	47.4 Å²	47.4	19%	0.194	32%	0.323	C	S	.	.	H	α-helix	trans	-53.2	-39.3	-179.9	-178	66.1	0	0	0	113.1	V584 E586 V596 T634 C635 Q636	V584-L632 HydrophobicContact CG2-CD1 4.14Å; E586-L632 HydrophobicContact CG-CB 3.67Å; E586-L632 HydrophobicContact CG-CD1 4.27Å; E586-L632 HydrophobicContact CG-CD2 4.1Å; E586-L632 HydrophobicContact CG-CG 4.21Å; E586-L632 VanDerWaalsContact OE1-CB 3.22Å; E586-L632 WeakPolarHBondContact OE1-CB 3.42Å; V596-L632 HydrophobicContact CG1-CD1 3.82Å; L632-T634 VanDerWaalsContact C-N 3.31Å; L632-T634 PolarHBondContact O-N 2.95Å; L632-C635 PolarHBondContact O-N 3.33Å; L632-Q636 HydrophobicContact CD1-CG 4.16Å; L632-Q636 HydrophobicContact CG-CG 4.22Å; L632-Q636 WeakPolarHBondContact O-CB 3.43Å; L632-Q636 VanDerWaalsContact O-CG 3.26Å; L632-Q636 WeakPolarHBondContact O-CG 3.39Å; L632-Q636 PolarHBondContact O-N 3.08Å
633	A	89.8	Confident	88.5	Confident	79 Å²	79	52.2 Å²	52.2	65%	0.653	34%	0.344	S	S	*	.	H	α-helix	trans	-59	-41.9	177	0	0	0	0	0	112.1	P631 G637	P631-A633 PolarHBondContact O-N 3.49Å; P631-A633 VanDerWaalsContact O-N 3.13Å; A633-G637 PolarHBondContact O-N 3.15Å
634	T	90.5	Very high	88.5	Confident	66 Å²	66	55 Å²	55	41%	0.405	36%	0.359	S	S	.	.	H	α-helix	trans	-67.7	-47	176.5	-50.3	0	0	0	0	110.9	L630 P631 L632 Q636 G637 I638	L630-T634 HydrophobicContact CD1-CG2 4.15Å; P631-T634 WeakPolarHBondContact O-CA 3.37Å; P631-T634 WeakPolarHBondContact O-CB 3.28Å; P631-T634 PolarHBondContact O-N 3.22Å; L632-T634 VanDerWaalsContact C-N 3.31Å; L632-T634 PolarHBondContact O-N 2.95Å; T634-Q636 PolarHBondContact O-N 3.49Å; T634-G637 CarbonylContact O-C 3.53Å; T634-G637 WeakPolarHBondContact O-CA 3.17Å; T634-G637 PolarHBondContact O-N 3.33Å; T634-I638 HydrophobicContact CG2-CD1 4.28Å; T634-I638 WeakPolarHBondContact O-CG1 3.24Å; T634-I638 PolarHBondContact O-N 3.45Å
635	C	90.3	Very high	88.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-44.3	176.8	-66.5	0	0	0	0	112.4	V596 L627 L630 P631 L632 G637 I638 I639	V596-C635 HydrophobicContact CG1-CB 3.56Å; L627-C635 HydrophobicContact CD1-CB 4.46Å; L627-C635 HydrophobicContact CD2-CB 4.43Å; L630-C635 VanDerWaalsContact CB-SG 3.56Å; P631-C635 PolarHBondContact O-N 3.03Å; L632-C635 PolarHBondContact O-N 3.33Å; C635-G637 VanDerWaalsContact C-N 3.32Å; C635-G637 PolarHBondContact O-N 2.83Å; C635-I638 PolarHBondContact O-N 3.42Å; C635-I639 WeakPolarHBondContact O-CG1 3.34Å; C635-I639 PolarHBondContact O-N 2.78Å
636	Q	91.9	Very high	88.8	Confident	51 Å²	51	56 Å²	56	24%	0.238	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-35.9	172.8	-70.9	-176	7.6	0	0	112.1	V584 L632 T634 I639 K640 I750	V584-Q636 HydrophobicContact CG2-CG 3.78Å; L632-Q636 HydrophobicContact CD1-CG 4.16Å; L632-Q636 HydrophobicContact CG-CG 4.22Å; L632-Q636 WeakPolarHBondContact O-CB 3.43Å; L632-Q636 VanDerWaalsContact O-CG 3.26Å; L632-Q636 WeakPolarHBondContact O-CG 3.39Å; L632-Q636 PolarHBondContact O-N 3.08Å; T634-Q636 PolarHBondContact O-N 3.49Å; Q636-I639 PolarHBondContact O-N 3.07Å; Q636-K640 WeakPolarHBondContact O-CB 3.48Å; Q636-K640 WeakPolarHBondContact O-CD 3.4Å; Q636-K640 WeakPolarHBondContact O-CG 3.32Å; Q636-K640 PolarHBondContact O-N 3.32Å; Q636-I750 HydrophobicContact CB-CD1 3.98Å; Q636-I750 HydrophobicContact CG-CD1 3.88Å
637	G	91.6	Very high	88.9	Confident	39 Å²	39	57.9 Å²	57.9	40%	0.402	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-47.3	173.9	0	0	0	0	0	112.2	A633 T634 C635 I639 K640 G641	A633-G637 PolarHBondContact O-N 3.15Å; T634-G637 CarbonylContact O-C 3.53Å; T634-G637 WeakPolarHBondContact O-CA 3.17Å; T634-G637 PolarHBondContact O-N 3.33Å; C635-G637 VanDerWaalsContact C-N 3.32Å; C635-G637 PolarHBondContact O-N 2.83Å; G637-I639 PolarHBondContact O-N 3.22Å; G637-K640 PolarHBondContact O-N 2.84Å; G637-G641 PolarHBondContact O-N 2.92Å
638	I	91.6	Very high	89.2	Confident	42 Å²	42	58 Å²	58	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-56.8	-50.5	174.6	-68.3	163.7	0	0	0	110.1	I622 T625 L627 L630 T634 C635 K640 G641 L642	I622-I638 HydrophobicContact CB-CG2 4.41Å; I622-I638 HydrophobicContact CD1-CG2 4.45Å; T625-I638 HydrophobicContact CG2-CD1 4.08Å; L627-I638 HydrophobicContact CD2-CD1 3.69Å; L627-I638 HydrophobicContact CD2-CG2 4.32Å; L630-I638 HydrophobicContact CD1-CD1 3.75Å; T634-I638 HydrophobicContact CG2-CD1 4.28Å; T634-I638 WeakPolarHBondContact O-CG1 3.24Å; T634-I638 PolarHBondContact O-N 3.45Å; C635-I638 PolarHBondContact O-N 3.42Å; I638-K640 PolarHBondContact O-N 2.85Å; I638-G641 PolarHBondContact O-N 2.7Å; I638-G641 VanDerWaalsContact O-N 3.14Å; I638-L642 WeakPolarHBondContact O-CG 3.26Å; I638-L642 PolarHBondContact O-N 2.99Å
639	I	91.7	Very high	89.5	Confident	1 Å²	1	59 Å²	59	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-45.3	179.8	-65.2	161.5	0	0	0	111.7	L580 V582 V584 I622 C635 Q636 G637 G641 L642 I750	L580-I639 HydrophobicContact CB-CG2 4.22Å; L580-I639 HydrophobicContact CD2-CG2 4.05Å; V582-I639 HydrophobicContact CG2-CG2 4.05Å; V584-I639 HydrophobicContact CG1-CD1 3.92Å; V584-I639 HydrophobicContact CG2-CD1 3.95Å; I622-I639 HydrophobicContact CD1-CD1 4.27Å; I622-I639 HydrophobicContact CD1-CG1 3.5Å; I622-I639 VanDerWaalsContact CD1-CG1 3.5Å; C635-I639 WeakPolarHBondContact O-CG1 3.34Å; C635-I639 PolarHBondContact O-N 2.78Å; Q636-I639 PolarHBondContact O-N 3.07Å; G637-I639 PolarHBondContact O-N 3.22Å; I639-G641 VanDerWaalsContact C-N 3.28Å; I639-G641 PolarHBondContact O-N 2.91Å; I639-L642 HydrophobicContact CG2-CD1 4.45Å; I639-L642 VanDerWaalsContact O-CB 3.26Å; I639-L642 WeakPolarHBondContact O-CB 3.35Å; I639-L642 VanDerWaalsContact O-CG 3.25Å; I639-L642 WeakPolarHBondContact O-CG 3.44Å; I639-L642 PolarHBondContact O-N 3.27Å; I639-L642 VanDerWaalsContact O-N 3.14Å; I639-I750 HydrophobicContact CB-CD1 3.82Å; I639-I750 HydrophobicContact CB-CG1 4.4Å; I639-I750 HydrophobicContact CD1-CD1 4.02Å; I639-I750 HydrophobicContact CG2-CB 4.31Å; I639-I750 HydrophobicContact CG2-CD1 3.69Å; I639-I750 HydrophobicContact CG2-CG1 3.7Å
640	K	90.7	Very high	90	Very high	104 Å²	104	56.7 Å²	56.7	45%	0.452	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-36.6	175.6	-70.5	162.6	-167.9	167.9	0	111.9	Q636 G637 I638 L642 K643 I750	Q636-K640 WeakPolarHBondContact O-CB 3.48Å; Q636-K640 WeakPolarHBondContact O-CD 3.4Å; Q636-K640 WeakPolarHBondContact O-CG 3.32Å; Q636-K640 PolarHBondContact O-N 3.32Å; G637-K640 PolarHBondContact O-N 2.84Å; I638-K640 PolarHBondContact O-N 2.85Å; K640-L642 PolarHBondContact O-N 3.17Å; K640-K643 WeakPolarHBondContact O-CB 3.4Å; K640-K643 PolarHBondContact O-N 2.88Å; K640-I750 HydrophobicContact CD-CG2 4.39Å; K640-I750 VanDerWaalsContact CE-CG2 3.42Å; K640-I750 HydrophobicContact CG-CB 4.02Å; K640-I750 HydrophobicContact CG-CG2 4.07Å
641	G	89.1	Confident	90.3	Very high	56 Å²	56	55.8 Å²	55.8	58%	0.577	32%	0.32	S	S	*	.	H	α-helix	trans	-61.9	-25.2	176	0	0	0	0	0	114.1	G637 I638 I639 K643	G637-G641 PolarHBondContact O-N 2.92Å; I638-G641 PolarHBondContact O-N 2.7Å; I638-G641 VanDerWaalsContact O-N 3.14Å; I639-G641 VanDerWaalsContact C-N 3.28Å; I639-G641 PolarHBondContact O-N 2.91Å; G641-K643 PolarHBondContact O-N 2.82Å; G641-K643 VanDerWaalsContact O-N 3.15Å
642	L	88.2	Confident	90.5	Very high	7 Å²	7	52 Å²	52	4%	0.037	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-64.8	-17.5	178.7	-51.2	174.2	0	0	0	113.5	K574 L580 I622 N623 I638 I639 K640 N644 Q645 V648	K574-L642 WeakPolarHBondContact CE-O 3.25Å; K574-L642 PolarHBondContact NZ-O 2.91Å; L580-L642 HydrophobicContact CD2-CD1 4.25Å; I622-L642 HydrophobicContact CD1-CD1 4.4Å; I622-L642 HydrophobicContact CG2-CD1 3.8Å; I622-L642 HydrophobicContact CG2-CD2 3.67Å; I622-L642 HydrophobicContact CG2-CG 4.33Å; N623-L642 WeakPolarHBondContact ND2-CD2 3.48Å; I638-L642 WeakPolarHBondContact O-CG 3.26Å; I638-L642 PolarHBondContact O-N 2.99Å; I639-L642 HydrophobicContact CG2-CD1 4.45Å; I639-L642 VanDerWaalsContact O-CB 3.26Å; I639-L642 WeakPolarHBondContact O-CB 3.35Å; I639-L642 VanDerWaalsContact O-CG 3.25Å; I639-L642 WeakPolarHBondContact O-CG 3.44Å; I639-L642 PolarHBondContact O-N 3.27Å; I639-L642 VanDerWaalsContact O-N 3.14Å; K640-L642 PolarHBondContact O-N 3.17Å; L642-N644 PolarHBondContact O-N 2.68Å; L642-Q645 VanDerWaalsContact CD2-OE1 3.29Å; L642-Q645 WeakPolarHBondContact O-CB 3.35Å; L642-Q645 PolarHBondContact O-N 3.26Å; L642-V648 HydrophobicContact CB-CG2 4.27Å; L642-V648 HydrophobicContact CD1-CG1 3.86Å; L642-V648 HydrophobicContact CD1-CG2 4.17Å
643	K	88.1	Confident	90.5	Very high	101 Å²	101	50.5 Å²	50.5	44%	0.439	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-47.8	-32.3	-169.7	-175.9	177.4	-179.9	-177.6	0	115	G577 I579 K640 G641	G577-K643 WeakPolarHBondContact CA-O 3.44Å; G577-K643 PolarHBondContact N-O 2.76Å; G577-K643 WeakPolarHBondContact O-CE 3.43Å; I579-K643 HydrophobicContact CG2-CD 4.48Å; K640-K643 WeakPolarHBondContact O-CB 3.4Å; K640-K643 PolarHBondContact O-N 2.88Å; G641-K643 PolarHBondContact O-N 2.82Å; G641-K643 VanDerWaalsContact O-N 3.15Å
644	N	88.9	Confident	90.3	Very high	123 Å²	123	47.8 Å²	47.8	66%	0.658	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-90.5	-7.9	-177.9	-65.5	-17.2	0	0	0	114.6	L642	L642-N644 PolarHBondContact O-N 2.68Å
645	Q	88.4	Confident	89.8	Confident	80 Å²	80	45.3 Å²	45.3	37%	0.374	25%	0.249	S	C	.	.			trans	-87	140.9	179.9	-59.9	176.7	-27.3	0	0	111.8	K574 N623 L642	K574-Q645 WeakPolarHBondContact CE-O 3.33Å; K574-Q645 WeakPolarHBondContact CG-O 3.31Å; K574-Q645 PolarHBondContact NZ-O 2.72Å; N623-Q645 PolarHBondContact ND2-OE1 2.96Å; L642-Q645 VanDerWaalsContact CD2-OE1 3.29Å; L642-Q645 WeakPolarHBondContact O-CB 3.35Å; L642-Q645 PolarHBondContact O-N 3.26Å
646	T	90.8	Very high	89.3	Confident	79 Å²	79	48.9 Å²	48.9	49%	0.485	27%	0.273	S	S	.	.	S	Bend	trans	-84.1	-24.5	177.8	45.1	0	0	0	0	114.3	K574 K576	K574-T646 PolarHBondContact N-O 3.1Å; K574-T646 CarbonylContact O-C 3.51Å; K574-T646 VanDerWaalsContact O-CA 3.24Å; K574-T646 WeakPolarHBondContact O-CA 3.4Å; K576-T646 HydrophobicContact CD-CG2 4.35Å; K576-T646 HydrophobicContact CG-CG2 3.6Å
647	Q	90.5	Very high	88.8	Confident	102 Å²	102	48.5 Å²	48.5	48%	0.477	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.5	177.6	-162.6	-179.8	25.5	0	0	108.7	L572	L572-Q647 CarbonylContact O-C 3.54Å; L572-Q647 WeakPolarHBondContact O-CA 3.43Å
648	V	92.6	Very high	88.5	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125	172.5	-179.9	0	0	0	0	108.2	Q571 L572 K574 I622 L642 L650	Q571-V648 WeakPolarHBondContact CA-O 3.5Å; L572-V648 HydrophobicContact CB-CB 4.42Å; L572-V648 PolarHBondContact N-O 3.12Å; L572-V648 PolarHBondContact O-N 2.83Å; K574-V648 VanDerWaalsContact NZ-CG2 3.27Å; I622-V648 HydrophobicContact CG2-CG1 3.95Å; L642-V648 HydrophobicContact CB-CG2 4.27Å; L642-V648 HydrophobicContact CD1-CG1 3.86Å; L642-V648 HydrophobicContact CD1-CG2 4.17Å; V648-L650 HydrophobicContact CG1-CD2 3.7Å; V648-L650 HydrophobicContact CG1-CG 4.18Å
649	K	92.4	Very high	88.3	Confident	75 Å²	75	47.4 Å²	47.4	33%	0.326	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.2	169.9	179.5	167.8	164.6	151.3	0	108.8	E569 L570 I622 N623	E569-K649 HydrophobicContact CG-CG 4.47Å; E569-K649 WeakPolarHBondContact OE1-CE 3.29Å; E569-K649 IonicContact OE1-NZ 2.71Å; E569-K649 PolarHBondContact OE1-NZ 3.19Å; E569-K649 VanDerWaalsContact OE2-CE 3.27Å; E569-K649 WeakPolarHBondContact OE2-CE 3.44Å; E569-K649 IonicContact OE2-NZ 3.12Å; E569-K649 PolarHBondContact OE2-NZ 2.68Å; L570-K649 CarbonylContact O-C 3.53Å; L570-K649 WeakPolarHBondContact O-CA 3.43Å; I622-K649 CarbonylContact C-O 3.56Å; I622-K649 WeakPolarHBondContact CA-O 3.34Å; N623-K649 PolarHBondContact N-O 2.91Å; N623-K649 PolarHBondContact OD1-N 2.92Å
650	L	92.7	Very high	88.1	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145.1	172.8	-54.8	179.5	0	0	0	109.1	L570 L572 L613 I619 S621 I622 V648 I652	L570-L650 HydrophobicContact CB-CB 4.34Å; L570-L650 PolarHBondContact N-O 3.16Å; L570-L650 PolarHBondContact O-N 3.36Å; L572-L650 HydrophobicContact CD1-CD1 3.49Å; L572-L650 VanDerWaalsContact CD1-CD1 3.49Å; L572-L650 HydrophobicContact CD1-CG 4.05Å; L572-L650 HydrophobicContact CG-CD1 4.45Å; L613-L650 HydrophobicContact CD1-CD1 4.11Å; L613-L650 HydrophobicContact CD2-CD1 4.18Å; I619-L650 HydrophobicContact CG2-CD2 4.45Å; S621-L650 WeakPolarHBondContact O-CA 3.29Å; I622-L650 HydrophobicContact CB-CD2 4.17Å; I622-L650 HydrophobicContact CD1-CD2 3.95Å; I622-L650 HydrophobicContact CG1-CD2 3.63Å; I622-L650 HydrophobicContact CG2-CD2 3.93Å; V648-L650 HydrophobicContact CG1-CD2 3.7Å; V648-L650 HydrophobicContact CG1-CG 4.18Å; L650-I652 HydrophobicContact CB-CG2 4.32Å
651	N	91	Very high	88	Confident	47 Å²	47	44.8 Å²	44.8	25%	0.251	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.1	156.1	-66.9	-62.6	0	0	0	108.2	E569 M620 S621	E569-N651 WeakPolarHBondContact CB-OD1 3.48Å; E569-N651 WeakPolarHBondContact CG-OD1 3.42Å; M620-N651 PolarHBondContact N-O 3.47Å; S621-N651 PolarHBondContact N-O 3.13Å; S621-N651 PolarHBondContact O-N 2.97Å; S621-N651 WeakPolarHBondContact OG-CB 3.17Å; S621-N651 PolarHBondContact OG-ND2 2.78Å
652	I	91.1	Very high	87.9	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	157.3	177.5	63.4	153.6	0	0	0	111.3	C567 K568 L570 L613 D617 Q618 I619 L650	C567-I652 CarbonylContact C-O 3.41Å; C567-I652 WeakPolarHBondContact CA-O 3.23Å; K568-I652 HydrophobicContact CB-CD1 4.14Å; K568-I652 HydrophobicContact CB-CG1 3.79Å; K568-I652 HydrophobicContact CD-CD1 4.08Å; K568-I652 PolarHBondContact N-O 3.26Å; K568-I652 WeakPolarHBondContact O-CG1 3.42Å; K568-I652 PolarHBondContact O-N 3.12Å; L570-I652 HydrophobicContact CD1-CD1 3.84Å; L570-I652 HydrophobicContact CD1-CG1 4.01Å; L570-I652 HydrophobicContact CG-CD1 4.47Å; L570-I652 HydrophobicContact CG-CG1 4.24Å; L613-I652 HydrophobicContact CD2-CD1 4.18Å; L613-I652 HydrophobicContact CD2-CG2 4Å; D617-I652 HydrophobicContact CB-CD1 3.95Å; D617-I652 VanDerWaalsContact OD2-CD1 3.23Å; D617-I652 WeakPolarHBondContact OD2-CD1 3.25Å; Q618-I652 CarbonylContact O-C 3.5Å; Q618-I652 WeakPolarHBondContact O-CA 3.39Å; Q618-I652 WeakPolarHBondContact O-CB 3.42Å; I619-I652 HydrophobicContact CG1-CG2 4.2Å; I619-I652 HydrophobicContact CG2-CG2 4.48Å; L650-I652 HydrophobicContact CB-CG2 4.32Å
653	V	88.1	Confident	87.9	Confident	5 Å²	5	43 Å²	43	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.1	164.3	173.1	0	0	0	0	107.1	H560 F561 N566 Q618 M620 C655	H560-V653 HydrophobicContact CB-CG1 4.27Å; F561-V653 HydrophobicContact CD1-CB 4.22Å; F561-V653 HydrophobicContact CD1-CG1 3.84Å; F561-V653 HydrophobicContact CD1-CG2 3.92Å; F561-V653 HydrophobicContact CE1-CB 4.21Å; F561-V653 HydrophobicContact CE1-CG1 4.05Å; F561-V653 HydrophobicContact CE1-CG2 4.22Å; N566-V653 HydrophobicContact CB-CG1 4.5Å; Q618-V653 PolarHBondContact N-O 2.93Å; Q618-V653 PolarHBondContact O-N 3.45Å; M620-V653 HydrophobicContact CG-CB 4.45Å; M620-V653 HydrophobicContact CG-CG2 3.65Å; M620-V653 HydrophobicContact SD-CB 4.38Å; M620-V653 HydrophobicContact SD-CG2 3.88Å; V653-C655 PolarHBondContact O-N 3.38Å
654	S	85.8	Confident	87.7	Confident	21 Å²	21	42.9 Å²	42.9	15%	0.147	23%	0.231	C	C	.	.			trans	-84.9	109	-178.6	-142.1	0	0	0	0	109.9	N566 K568 D617	N566-S654 PolarHBondContact O-N 2.66Å; K568-S654 VanDerWaalsContact NZ-CB 3.27Å; K568-S654 PolarHBondContact NZ-OG 3.28Å; D617-S654 VanDerWaalsContact OD1-CA 3.25Å; D617-S654 WeakPolarHBondContact OD1-CA 3.48Å; D617-S654 WeakPolarHBondContact OD1-CB 3.48Å; D617-S654 PolarHBondContact OD1-OG 3.46Å
655	C	80.5	Confident	87.4	Confident	14 Å²	14	37.8 Å²	37.8	10%	0.095	20%	0.203	C	C	.	.			trans	-133.1	148.6	-177.1	50.4	0	0	0	0	110.5	H560 G616 Q618 V653	H560-C655 HydrophobicContact CB-CB 4.41Å; G616-C655 CarbonylContact C-O 3.56Å; G616-C655 PolarHBondContact O-SG 3.36Å; Q618-C655 PolarHBondContact NE2-SG 2.87Å; V653-C655 PolarHBondContact O-N 3.38Å
656	P	80.6	Confident	86.8	Confident	76 Å²	76	37.5 Å²	37.5	49%	0.494	21%	0.208	S	C	.	.			trans	-59.3	144.3	174.5	-23.4	33.9	0	0	0	111.9	H560 V658	H560-P656 VanDerWaalsContact CE1-CD 3.48Å; H560-P656 WeakPolarHBondContact CE1-CD 3.43Å; H560-P656 WeakPolarHBondContact NE2-CD 3.25Å; P656-V658 PolarHBondContact O-N 3.23Å
657	P	79.7	Confident	86.3	Confident	42 Å²	42	36.8 Å²	36.8	27%	0.273	20%	0.201	S	C	.	.	S	Bend	trans	-69.5	8.4	174.1	29.3	-35.7	0	0	0	114	M733 M737	P657-M733 HydrophobicContact CB-CE 4.31Å; P657-M733 WeakPolarHBondContact O-CG 3.39Å; P657-M737 HydrophobicContact CB-CE 3.93Å; P657-M737 HydrophobicContact CB-SD 3.51Å; P657-M737 VanDerWaalsContact CB-SD 3.51Å
658	V	87.2	Confident	85.8	Confident	40 Å²	40	36.5 Å²	36.5	24%	0.242	20%	0.202	C	C	.	.	S	Bend	trans	-127.4	118.1	-177.2	174.5	0	0	0	0	108.3	P656 I702 K731 T732 M733	P656-V658 PolarHBondContact O-N 3.23Å; V658-I702 HydrophobicContact CG1-CD1 3.86Å; V658-I702 HydrophobicContact CG2-CD1 3.81Å; V658-K731 HydrophobicContact CG1-CB 3.7Å; V658-K731 HydrophobicContact CG1-CD 4.2Å; V658-K731 HydrophobicContact CG1-CG 4.14Å; V658-T732 CarbonylContact C-O 3.57Å; V658-T732 WeakPolarHBondContact CA-O 3.37Å; V658-M733 HydrophobicContact CG2-CE 3.79Å
659	T	85.9	Confident	85	Confident	18 Å²	18	42.1 Å²	42.1	11%	0.11	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	121.5	174	-52.6	0	0	0	0	109.6	V661 H699 K731 T732	T659-V661 HydrophobicContact CG2-CG2 4.28Å; T659-H699 PolarHBondContact OG1-CE1 3.43Å; T659-K731 WeakPolarHBondContact O-CA 3.44Å; T659-T732 PolarHBondContact N-O 3.06Å; T659-T732 PolarHBondContact O-N 3Å
660	T	87.3	Confident	84.1	Confident	49 Å²	49	39.1 Å²	39.1	30%	0.301	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.2	167.2	-43.1	0	0	0	0	109.7	Y554 D556	Y554-T660 HydrophobicContact CE1-CG2 4.11Å; D556-T660 WeakPolarHBondContact OD2-CB 3.48Å; D556-T660 PolarHBondContact OD2-OG1 3.06Å
661	V	88.6	Confident	83.4	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.6	-176	-177.7	0	0	0	0	109.2	T659 I663 G693 V695 M730 T732	T659-V661 HydrophobicContact CG2-CG2 4.28Å; V661-I663 HydrophobicContact CG1-CG1 4.16Å; V661-G693 CarbonylContact C-O 3.49Å; V661-G693 VanDerWaalsContact CA-O 3.28Å; V661-G693 WeakPolarHBondContact CA-O 3.12Å; V661-G693 WeakPolarHBondContact CG1-O 3.47Å; V661-V695 HydrophobicContact CG1-CG2 3.6Å; V661-M730 HydrophobicContact CB-CE 4.4Å; V661-M730 HydrophobicContact CB-CG 3.82Å; V661-M730 WeakPolarHBondContact CB-O 3.47Å; V661-M730 HydrophobicContact CG1-CE 3.77Å; V661-M730 HydrophobicContact CG1-CG 4.04Å; V661-M730 PolarHBondContact N-O 3.18Å; V661-M730 PolarHBondContact O-N 2.69Å; V661-T732 HydrophobicContact CG2-CG2 3.9Å
662	L	87.6	Confident	83	Confident	27 Å²	27	44.8 Å²	44.8	14%	0.141	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	99.9	-178	179	58.9	0	0	0	110.7	Y554 G693 E727	Y554-L662 HydrophobicContact CD1-CB 3.92Å; Y554-L662 HydrophobicContact CD2-CB 4.06Å; Y554-L662 HydrophobicContact CD2-CD2 4Å; Y554-L662 HydrophobicContact CE1-CB 4.24Å; Y554-L662 HydrophobicContact CE2-CB 4.38Å; Y554-L662 HydrophobicContact CE2-CD2 4.19Å; Y554-L662 HydrophobicContact CG-CB 3.82Å; L662-G693 PolarHBondContact N-O 2.66Å; L662-G693 WeakPolarHBondContact O-CA 3.28Å; L662-E727 HydrophobicContact CD1-CB 4.11Å
663	I	87.9	Confident	82.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.3	177.3	-54.6	-179.7	0	0	0	109	V661 R665 L672 F674 I689 A690 V695 I728 M730	V661-I663 HydrophobicContact CG1-CG1 4.16Å; I663-R665 HydrophobicContact CG2-CB 4.48Å; I663-L672 HydrophobicContact CD1-CD2 4.5Å; I663-L672 HydrophobicContact CG2-CD2 3.87Å; I663-F674 HydrophobicContact CD1-CE1 4.01Å; I663-I689 HydrophobicContact CG2-CB 4.3Å; I663-I689 HydrophobicContact CG2-CG2 3.5Å; I663-I689 VanDerWaalsContact CG2-CG2 3.5Å; I663-A690 HydrophobicContact CD1-CB 4.16Å; I663-V695 HydrophobicContact CD1-CG2 3.94Å; I663-V695 HydrophobicContact CG1-CG2 4.48Å; I663-I728 HydrophobicContact CB-CB 4.23Å; I663-I728 PolarHBondContact N-O 3.17Å; I663-I728 PolarHBondContact O-N 3.31Å; I663-M730 HydrophobicContact CD1-CE 3.78Å
664	K	83.4	Confident	82.5	Confident	98 Å²	98	46.1 Å²	46.1	43%	0.426	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.3	173.4	-54.3	-159.1	-175.2	-155.3	0	109.7	I689 E727	K664-I689 WeakPolarHBondContact O-CG2 3.4Å; K664-E727 HydrophobicContact CD-CG 4.34Å; K664-E727 WeakPolarHBondContact CD-OE1 3.38Å; K664-E727 WeakPolarHBondContact CE-OE1 3.32Å; K664-E727 HydrophobicContact CG-CG 4.27Å; K664-E727 IonicContact NZ-OE1 3.85Å; K664-E727 PolarHBondContact NZ-OE1 3.09Å
665	R	84.3	Confident	82.3	Confident	15 Å²	15	48.2 Å²	48.2	6%	0.057	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	99.1	-176.8	-173.1	-145.6	-169.1	175.1	0.6	109.9	I663 D667 L668 Y670 L672 L721 S722 S724 V725 G726 I728	I663-R665 HydrophobicContact CG2-CB 4.48Å; R665-D667 VanDerWaalsContact C-N 3.34Å; R665-D667 PolarHBondContact NE-O 2.82Å; R665-D667 PolarHBondContact O-N 2.74Å; R665-L668 PolarHBondContact NH2-O 3.03Å; R665-Y670 PolarHBondContact NE-O 3.33Å; R665-Y670 PolarHBondContact NH2-O 2.73Å; R665-Y670 VanDerWaalsContact NH2-O 3.09Å; R665-L672 HydrophobicContact CB-CD2 4.16Å; R665-L672 HydrophobicContact CG-CD2 4.08Å; R665-L721 PolarHBondContact NH1-O 3.44Å; R665-S722 PolarHBondContact NH1-O 3.27Å; R665-S724 WeakPolarHBondContact CD-O 3.39Å; R665-S724 PolarHBondContact NH1-O 2.84Å; R665-V725 CarbonylContact O-C 3.58Å; R665-V725 WeakPolarHBondContact O-CA 3.11Å; R665-G726 PolarHBondContact N-O 3.36Å; R665-G726 PolarHBondContact O-N 2.64Å; R665-I728 HydrophobicContact CB-CD1 4.34Å
666	P	75.6	Confident	82.7	Confident	74 Å²	74	48.3 Å²	48.3	48%	0.481	26%	0.26	S	S	.	.			trans	-71.2	-24.5	-169.8	25.2	-32.4	0	0	0	114.7	I547 Y670	I547-P666 HydrophobicContact CD1-CG 3.49Å; I547-P666 VanDerWaalsContact CD1-CG 3.49Å; I547-P666 HydrophobicContact CG1-CG 3.94Å; I547-P666 HydrophobicContact CG2-CG 4.23Å; P666-Y670 HydrophobicContact CG-CD2 3.88Å; P666-Y670 HydrophobicContact CG-CE2 4Å
667	D	78.8	Confident	82.9	Confident	64 Å²	64	50.1 Å²	50.1	34%	0.342	26%	0.262	S	S	.	.			trans	-148.7	150.9	-173.6	-172.2	-33.6	0	0	0	110.1	R665 K669 Y670	R665-D667 VanDerWaalsContact C-N 3.34Å; R665-D667 PolarHBondContact NE-O 2.82Å; R665-D667 PolarHBondContact O-N 2.74Å; D667-K669 HydrophobicContact CB-CD 4.28Å; D667-K669 HydrophobicContact CB-CG 3.96Å; D667-K669 PolarHBondContact O-N 3.15Å; D667-K669 PolarHBondContact OD1-N 2.78Å; D667-K669 VanDerWaalsContact OD2-CD 3.29Å; D667-K669 WeakPolarHBondContact OD2-CD 3.45Å; D667-K669 WeakPolarHBondContact OD2-CE 3.48Å; D667-K669 IonicContact OD2-NZ 2.76Å; D667-Y670 HydrophobicContact CB-CD2 3.83Å; D667-Y670 HydrophobicContact CB-CE2 4.05Å; D667-Y670 PolarHBondContact O-N 2.86Å
668	L	80.3	Confident	83	Confident	97 Å²	97	53.7 Å²	53.7	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.7	173.6	-68.2	176.8	0	0	0	112.6	R665 Y670 S722 V725	R665-L668 PolarHBondContact NH2-O 3.03Å; L668-Y670 PolarHBondContact O-N 2.87Å; L668-Y670 VanDerWaalsContact O-N 3.16Å; L668-S722 VanDerWaalsContact CD2-O 3.25Å; L668-S722 WeakPolarHBondContact CD2-O 3.42Å; L668-V725 HydrophobicContact CD2-CG1 3.58Å; L668-V725 HydrophobicContact CG-CG1 3.74Å
669	K	76.2	Confident	82.9	Confident	119 Å²	119	51.8 Å²	51.8	52%	0.517	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.4	177.3	76.5	-167.1	178.4	-171	0	112.9	E543 D667	E543-K669 WeakPolarHBondContact OE2-CE 3.45Å; E543-K669 IonicContact OE2-NZ 3.73Å; E543-K669 PolarHBondContact OE2-NZ 3.32Å; D667-K669 HydrophobicContact CB-CD 4.28Å; D667-K669 HydrophobicContact CB-CG 3.96Å; D667-K669 PolarHBondContact O-N 3.15Å; D667-K669 PolarHBondContact OD1-N 2.78Å; D667-K669 VanDerWaalsContact OD2-CD 3.29Å; D667-K669 WeakPolarHBondContact OD2-CD 3.45Å; D667-K669 WeakPolarHBondContact OD2-CE 3.48Å; D667-K669 IonicContact OD2-NZ 2.76Å
670	Y	73.9	Confident	83.1	Confident	11 Å²	11	53.1 Å²	53.1	4%	0.043	27%	0.274	C	S	.	.	S	Bend	trans	-83	123.5	176.1	-62.7	-61.3	0	0	0	111.5	E543 Y544 I547 R665 P666 D667 L668	E543-Y670 VanDerWaalsContact CG-OH 3.32Å; E543-Y670 WeakPolarHBondContact CG-OH 3.09Å; E543-Y670 PolarHBondContact OE2-OH 2.71Å; Y544-Y670 AromaticContact CD2-CD1 3.42Å; Y544-Y670 HydrophobicContact CD2-CD1 3.42Å; Y544-Y670 VanDerWaalsContact CD2-CD1 3.42Å; Y544-Y670 AromaticContact CD2-CE1 3.64Å; Y544-Y670 HydrophobicContact CD2-CE1 3.64Å; Y544-Y670 HydrophobicContact CD2-CG 4.41Å; Y544-Y670 AromaticContact CE2-CD1 3.96Å; Y544-Y670 HydrophobicContact CE2-CD1 3.96Å; Y544-Y670 HydrophobicContact CG-CD1 4.41Å; Y544-Y670 HydrophobicContact CG-CE1 4.26Å; I547-Y670 HydrophobicContact CD1-CD2 3.92Å; I547-Y670 HydrophobicContact CD1-CE1 4.06Å; I547-Y670 HydrophobicContact CD1-CE2 3.26Å; R665-Y670 PolarHBondContact NE-O 3.33Å; R665-Y670 PolarHBondContact NH2-O 2.73Å; R665-Y670 VanDerWaalsContact NH2-O 3.09Å; P666-Y670 HydrophobicContact CG-CD2 3.88Å; P666-Y670 HydrophobicContact CG-CE2 4Å; D667-Y670 HydrophobicContact CB-CD2 3.83Å; D667-Y670 HydrophobicContact CB-CE2 4.05Å; D667-Y670 PolarHBondContact O-N 2.86Å; L668-Y670 PolarHBondContact O-N 2.87Å; L668-Y670 VanDerWaalsContact O-N 3.16Å
671	Q	78.6	Confident	83.2	Confident	148 Å²	148	50.9 Å²	50.9	69%	0.692	26%	0.26	S	S	*	.			trans	-73.7	141.6	171.1	-59.2	-170.1	41.7	0	0	110.4	G673	Q671-G673 PolarHBondContact O-N 2.82Å
672	L	82.3	Confident	82.9	Confident	19 Å²	19	53.5 Å²	53.5	10%	0.099	28%	0.278	C	S	.	.			trans	-65	-28.1	178.3	-62.9	169.2	0	0	0	112.3	I663 R665 F674 A690 L721 I728	I663-L672 HydrophobicContact CD1-CD2 4.5Å; I663-L672 HydrophobicContact CG2-CD2 3.87Å; R665-L672 HydrophobicContact CB-CD2 4.16Å; R665-L672 HydrophobicContact CG-CD2 4.08Å; L672-F674 HydrophobicContact CB-CD1 3.79Å; L672-F674 HydrophobicContact CB-CE1 3.81Å; L672-F674 HydrophobicContact CD1-CE1 3.95Å; L672-F674 HydrophobicContact CG-CE1 4.45Å; L672-A690 WeakPolarHBondContact O-CB 3.38Å; L672-A690 PolarHBondContact O-N 3.2Å; L672-L721 HydrophobicContact CD1-CB 3.84Å; L672-L721 HydrophobicContact CD1-CD2 4.38Å; L672-I728 HydrophobicContact CD2-CD1 3.7Å
673	G	81	Confident	82.5	Confident	6 Å²	6	55.2 Å²	55.2	6%	0.062	29%	0.292	C	S	.	.			trans	81.1	32.3	178.9	0	0	0	0	0	114.6	Q671 M685	Q671-G673 PolarHBondContact O-N 2.82Å; G673-M685 WeakPolarHBondContact O-CB 3.37Å; G673-M685 PolarHBondContact O-N 2.75Å
674	F	86.3	Confident	82.1	Confident	30 Å²	30	56.3 Å²	56.3	13%	0.132	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	157.6	170.6	76.5	-78.2	0	0	0	112.1	I663 L672 V676 I681 S683 L684 A690 V695 I701 L721 M730	I663-F674 HydrophobicContact CD1-CE1 4.01Å; L672-F674 HydrophobicContact CB-CD1 3.79Å; L672-F674 HydrophobicContact CB-CE1 3.81Å; L672-F674 HydrophobicContact CD1-CE1 3.95Å; L672-F674 HydrophobicContact CG-CE1 4.45Å; F674-V676 HydrophobicContact CE2-CB 4.4Å; F674-I681 HydrophobicContact CD2-CG1 4Å; F674-I681 HydrophobicContact CD2-CG2 4.12Å; F674-I681 HydrophobicContact CE2-CG1 4.04Å; F674-S683 CarbonylContact C-O 3.49Å; F674-S683 VanDerWaalsContact CA-O 3.32Å; F674-S683 WeakPolarHBondContact CA-O 3.32Å; F674-S683 WeakPolarHBondContact CB-O 3.43Å; F674-L684 HydrophobicContact CB-CD1 3.78Å; F674-A690 HydrophobicContact CB-CB 4.07Å; F674-A690 HydrophobicContact CD1-CB 3.43Å; F674-A690 VanDerWaalsContact CD1-CB 3.43Å; F674-A690 HydrophobicContact CE1-CB 4.12Å; F674-A690 HydrophobicContact CG-CB 4.07Å; F674-V695 HydrophobicContact CB-CG1 4.36Å; F674-V695 HydrophobicContact CD2-CG1 4.22Å; F674-V695 HydrophobicContact CG-CG1 4.22Å; F674-I701 HydrophobicContact CE2-CD1 4.13Å; F674-L721 HydrophobicContact CE2-CD1 4.16Å; F674-L721 HydrophobicContact CZ-CD1 3.7Å; F674-L721 HydrophobicContact CZ-CD2 4.11Å; F674-M730 HydrophobicContact CE1-CE 4.4Å; F674-M730 HydrophobicContact CZ-CE 3.88Å
675	S	83.1	Confident	81.7	Confident	64 Å²	64	55.5 Å²	55.5	45%	0.448	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.9	176.1	-57	0	0	0	0	111	C682 S683	S675-C682 PolarHBondContact O-N 3.22Å; S675-S683 PolarHBondContact N-O 2.99Å
676	V	87.9	Confident	81	Confident	16 Å²	16	59.8 Å²	59.8	10%	0.097	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.8	173.2	63.1	0	0	0	0	110.1	F674 I680 I701 H714 V718 L721	F674-V676 HydrophobicContact CE2-CB 4.4Å; V676-I680 CarbonylContact C-O 3.55Å; V676-I680 VanDerWaalsContact CA-O 3.28Å; V676-I680 WeakPolarHBondContact CA-O 3.44Å; V676-I680 WeakPolarHBondContact CG2-O 3.39Å; V676-I701 HydrophobicContact CB-CD1 4.49Å; V676-I701 HydrophobicContact CG2-CD1 3.98Å; V676-H714 PolarHBondContact O-CE1 3.47Å; V676-V718 HydrophobicContact CG1-CG2 3.8Å; V676-L721 HydrophobicContact CG1-CD1 4.26Å
677	Q	84.3	Confident	80.5	Confident	114 Å²	114	56.8 Å²	56.8	53%	0.533	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.3	170.8	-58.3	-178	2.5	0	0	108.9	G679 I680 C682	Q677-G679 PolarHBondContact O-N 2.92Å; Q677-I680 PolarHBondContact N-O 3.04Å; Q677-I680 PolarHBondContact O-N 3.33Å; Q677-C682 HydrophobicContact CG-CB 4.32Å
678	N	83.7	Confident	80.2	Confident	117 Å²	117	53.8 Å²	53.8	63%	0.626	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	26.3	-179.9	-61.1	-43.3	0	0	0	114.9	R700	N678-R700 PolarHBondContact O-NH1 2.97Å; N678-R700 PolarHBondContact O-NH2 3.01Å
679	G	84.1	Confident	80.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	0.8	-175.7	0	0	0	0	0	115.5	Q677 R700 I701	Q677-G679 PolarHBondContact O-N 2.92Å; G679-R700 CarbonylContact O-C 3.59Å; G679-R700 VanDerWaalsContact O-CA 3.32Å; G679-R700 WeakPolarHBondContact O-CA 3.41Å; G679-R700 WeakPolarHBondContact O-CG 3.44Å; G679-I701 PolarHBondContact O-N 3.41Å
680	I	89.6	Confident	80.6	Confident	47 Å²	47	43.5 Å²	43.5	24%	0.241	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.2	176.3	-56.3	174.4	0	0	0	109.5	V676 Q677 H699 R700 A735	V676-I680 CarbonylContact C-O 3.55Å; V676-I680 VanDerWaalsContact CA-O 3.28Å; V676-I680 WeakPolarHBondContact CA-O 3.44Å; V676-I680 WeakPolarHBondContact CG2-O 3.39Å; Q677-I680 PolarHBondContact N-O 3.04Å; Q677-I680 PolarHBondContact O-N 3.33Å; I680-H699 CarbonylContact C-O 3.59Å; I680-H699 WeakPolarHBondContact CA-O 3.45Å; I680-R700 HydrophobicContact CG1-CB 4.33Å; I680-R700 HydrophobicContact CG1-CG 4.32Å; I680-A735 HydrophobicContact CD1-CB 4.04Å; I680-A735 HydrophobicContact CG1-CB 4.17Å; I680-A735 HydrophobicContact CG2-CB 4.13Å
681	I	89.7	Confident	80.9	Confident	1 Å²	1	45 Å²	45	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.6	175.2	-62.6	141.1	0	0	0	108.7	F674 V695 R696 G698 H699 I701 T732	F674-I681 HydrophobicContact CD2-CG1 4Å; F674-I681 HydrophobicContact CD2-CG2 4.12Å; F674-I681 HydrophobicContact CE2-CG1 4.04Å; I681-V695 HydrophobicContact CD1-CG1 3.91Å; I681-V695 HydrophobicContact CG1-CG1 4.24Å; I681-V695 HydrophobicContact CG2-CG1 3.91Å; I681-R696 WeakPolarHBondContact CB-O 3.12Å; I681-R696 WeakPolarHBondContact CD1-O 3.28Å; I681-R696 WeakPolarHBondContact CG2-O 3.41Å; I681-G698 PolarHBondContact O-N 3Å; I681-H699 HydrophobicContact CD1-CB 4Å; I681-H699 PolarHBondContact N-O 3.44Å; I681-I701 HydrophobicContact CD1-CG1 4.01Å; I681-I701 HydrophobicContact CG1-CD1 4.41Å; I681-I701 HydrophobicContact CG1-CG1 4.18Å; I681-T732 HydrophobicContact CD1-CG2 4.18Å
682	C	82.9	Confident	80.8	Confident	57 Å²	57	40.5 Å²	40.5	39%	0.385	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-22	-172.7	-63.1	0	0	0	0	113.9	S675 Q677	S675-C682 PolarHBondContact O-N 3.22Å; Q677-C682 HydrophobicContact CG-CB 4.32Å
683	S	78.8	Confident	80.6	Confident	63 Å²	63	39.6 Å²	39.6	44%	0.441	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.9	176.1	-177	0	0	0	0	109.8	F674 S675	F674-S683 CarbonylContact C-O 3.49Å; F674-S683 VanDerWaalsContact CA-O 3.32Å; F674-S683 WeakPolarHBondContact CA-O 3.32Å; F674-S683 WeakPolarHBondContact CB-O 3.43Å; S675-S683 PolarHBondContact N-O 2.99Å
684	L	79.6	Confident	80.6	Confident	22 Å²	22	39.9 Å²	39.9	12%	0.115	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	133.5	-176.6	-177.7	62.7	0	0	0	108.5	F674 A690 E691 V695 V697	F674-L684 HydrophobicContact CB-CD1 3.78Å; L684-A690 HydrophobicContact CD1-CB 3.78Å; L684-E691 HydrophobicContact CD1-CB 4.1Å; L684-E691 HydrophobicContact CD2-CB 4.01Å; L684-E691 HydrophobicContact CD2-CG 4.07Å; L684-E691 HydrophobicContact CG-CB 4.11Å; L684-V695 HydrophobicContact CD1-CB 4.08Å; L684-V695 HydrophobicContact CD1-CG1 3.83Å; L684-V695 VanDerWaalsContact CD2-O 3.27Å; L684-V695 WeakPolarHBondContact CD2-O 3.39Å; L684-V697 HydrophobicContact CB-CG2 3.54Å; L684-V697 HydrophobicContact CD2-CG2 4.24Å
685	M	75.3	Confident	80.7	Confident	81 Å²	81	38.4 Å²	38.4	40%	0.399	21%	0.206	S	C	.	.			trans	-86.5	117	175.9	-65.6	178.7	68.6	0	0	109.5	I534 G673 G688	I534-M685 HydrophobicContact CD1-CE 4.1Å; G673-M685 WeakPolarHBondContact O-CB 3.37Å; G673-M685 PolarHBondContact O-N 2.75Å; M685-G688 PolarHBondContact O-N 3.47Å
686	R	69.6	Low	80.8	Confident	106 Å²	106	35.9 Å²	35.9	40%	0.4	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	136.9	178.9	-159.2	-174.3	-167.9	-175.5	5.9	111.3	E106 D107 G688 E691	E106-R686 IonicContact OE1-CZ 2.7Å; E106-R686 IonicContact OE1-NH1 3.46Å; E106-R686 PolarHBondContact OE1-NH1 2.92Å; D107-R686 VanDerWaalsContact N-NH2 3.2Å; D107-R686 IonicContact OD2-CZ 3.69Å; D107-R686 IonicContact OD2-NE 3.94Å; D107-R686 IonicContact OD2-NH2 2.66Å; D107-R686 PolarHBondContact OD2-NH2 2.86Å; R686-G688 PolarHBondContact O-N 2.96Å; R686-E691 WeakPolarHBondContact CA-OE1 3.32Å
687	G	65.4	Low	80.8	Confident	10 Å²	10	37 Å²	37	10%	0.103	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	-7.3	-174.2	0	0	0	0	0	115.4	E691 R692	G687-E691 WeakPolarHBondContact CA-OE2 3.49Å; G687-E691 PolarHBondContact N-OE2 3.16Å; G687-R692 PolarHBondContact O-NE 2.87Å; G687-R692 VanDerWaalsContact O-NE 3.16Å
688	G	72.1	Confident	80.8	Confident	2 Å²	2	33.3 Å²	33.3	2%	0.021	19%	0.186	C	C	.	.	S	Bend	trans	-75.2	169.4	-173.8	0	0	0	0	0	115	M685 R686 A690 E691 R692	M685-G688 PolarHBondContact O-N 3.47Å; R686-G688 PolarHBondContact O-N 2.96Å; G688-A690 VanDerWaalsContact C-N 3.26Å; G688-A690 PolarHBondContact O-N 2.69Å; G688-E691 PolarHBondContact O-N 2.95Å; G688-E691 VanDerWaalsContact O-N 3.15Å; G688-R692 PolarHBondContact O-N 2.83Å; G688-R692 VanDerWaalsContact O-N 3.15Å
689	I	80	Confident	81.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-37.2	-172.5	-45	-177.3	0	0	0	111.9	Y544 Q551 I663 K664 G693	Y544-I689 HydrophobicContact CE2-CD1 4.07Å; Y544-I689 HydrophobicContact CE2-CG1 4.17Å; Q551-I689 PolarHBondContact NE2-O 3.37Å; Q551-I689 VanDerWaalsContact OE1-CA 3.32Å; Q551-I689 VanDerWaalsContact OE1-CG2 3.23Å; I663-I689 HydrophobicContact CG2-CB 4.3Å; I663-I689 HydrophobicContact CG2-CG2 3.5Å; I663-I689 VanDerWaalsContact CG2-CG2 3.5Å; K664-I689 WeakPolarHBondContact O-CG2 3.4Å; I689-G693 PolarHBondContact O-N 3.44Å; I689-G693 VanDerWaalsContact O-N 3.16Å
690	A	84.1	Confident	81.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-47.4	175.8	0	0	0	0	0	113.7	I663 L672 F674 L684 G688 R692 G693 G694 V695	I663-A690 HydrophobicContact CD1-CB 4.16Å; L672-A690 WeakPolarHBondContact O-CB 3.38Å; L672-A690 PolarHBondContact O-N 3.2Å; F674-A690 HydrophobicContact CB-CB 4.07Å; F674-A690 HydrophobicContact CD1-CB 3.43Å; F674-A690 VanDerWaalsContact CD1-CB 3.43Å; F674-A690 HydrophobicContact CE1-CB 4.12Å; F674-A690 HydrophobicContact CG-CB 4.07Å; L684-A690 HydrophobicContact CD1-CB 3.78Å; G688-A690 VanDerWaalsContact C-N 3.26Å; G688-A690 PolarHBondContact O-N 2.69Å; A690-R692 PolarHBondContact O-N 2.97Å; A690-G693 PolarHBondContact O-N 3.28Å; A690-G693 VanDerWaalsContact O-N 3.08Å; A690-G694 PolarHBondContact O-N 2.91Å; A690-V695 HydrophobicContact CB-CB 3.97Å; A690-V695 HydrophobicContact CB-CG1 4.39Å; A690-V695 HydrophobicContact CB-CG2 3.75Å; A690-V695 VanDerWaalsContact O-CB 3.24Å; A690-V695 WeakPolarHBondContact O-CB 3.45Å; A690-V695 VanDerWaalsContact O-CG2 3.26Å; A690-V695 WeakPolarHBondContact O-CG2 3.39Å; A690-V695 PolarHBondContact O-N 2.82Å
691	E	80.7	Confident	81.6	Confident	43 Å²	43	27.5 Å²	27.5	20%	0.201	15%	0.153	C	C	.	.	H	α-helix	trans	-61.3	-47.8	-178.8	-175.3	-179.1	-96.8	0	0	110.3	L684 R686 G687 G688 G693 G694	L684-E691 HydrophobicContact CD1-CB 4.1Å; L684-E691 HydrophobicContact CD2-CB 4.01Å; L684-E691 HydrophobicContact CD2-CG 4.07Å; L684-E691 HydrophobicContact CG-CB 4.11Å; R686-E691 WeakPolarHBondContact CA-OE1 3.32Å; G687-E691 WeakPolarHBondContact CA-OE2 3.49Å; G687-E691 PolarHBondContact N-OE2 3.16Å; G688-E691 PolarHBondContact O-N 2.95Å; G688-E691 VanDerWaalsContact O-N 3.15Å; E691-G693 PolarHBondContact O-N 2.94Å; E691-G694 PolarHBondContact O-N 2.89Å
692	R	76.5	Confident	81.8	Confident	52 Å²	52	28.7 Å²	28.7	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-26.1	174.7	-70.2	176.9	172.5	-95.7	-2.5	113.9	I548 Q551 M553 Y554 G687 G688 A690 G694	I548-R692 PolarHBondContact O-NH1 3.29Å; Q551-R692 VanDerWaalsContact CD-CB 3.46Å; Q551-R692 HydrophobicContact CG-CB 3.97Å; Q551-R692 PolarHBondContact O-NH1 3.15Å; M553-R692 WeakPolarHBondContact CA-O 3.18Å; M553-R692 HydrophobicContact CG-CG 4.47Å; Y554-R692 PolarHBondContact N-O 2.95Å; G687-R692 PolarHBondContact O-NE 2.87Å; G687-R692 VanDerWaalsContact O-NE 3.16Å; G688-R692 PolarHBondContact O-N 2.83Å; G688-R692 VanDerWaalsContact O-N 3.15Å; A690-R692 PolarHBondContact O-N 2.97Å; R692-G694 VanDerWaalsContact C-N 3.31Å
693	G	78.5	Confident	82.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.2	174.3	0	0	0	0	0	114.6	V661 L662 I689 A690 E691	V661-G693 CarbonylContact C-O 3.49Å; V661-G693 VanDerWaalsContact CA-O 3.28Å; V661-G693 WeakPolarHBondContact CA-O 3.12Å; V661-G693 WeakPolarHBondContact CG1-O 3.47Å; L662-G693 PolarHBondContact N-O 2.66Å; L662-G693 WeakPolarHBondContact O-CA 3.28Å; I689-G693 PolarHBondContact O-N 3.44Å; I689-G693 VanDerWaalsContact O-N 3.16Å; A690-G693 PolarHBondContact O-N 3.28Å; A690-G693 VanDerWaalsContact O-N 3.08Å; E691-G693 PolarHBondContact O-N 2.94Å
694	G	80.7	Confident	83	Confident	12 Å²	12	25.6 Å²	25.6	12%	0.124	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.1	13.7	-177.6	0	0	0	0	0	115.3	A690 E691 R692	A690-G694 PolarHBondContact O-N 2.91Å; E691-G694 PolarHBondContact O-N 2.89Å; R692-G694 VanDerWaalsContact C-N 3.31Å
695	V	87.8	Confident	83.5	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.			trans	-67.8	135.1	175.6	175.8	0	0	0	0	110.8	V661 I663 F674 I681 L684 A690 M730	V661-V695 HydrophobicContact CG1-CG2 3.6Å; I663-V695 HydrophobicContact CD1-CG2 3.94Å; I663-V695 HydrophobicContact CG1-CG2 4.48Å; F674-V695 HydrophobicContact CB-CG1 4.36Å; F674-V695 HydrophobicContact CD2-CG1 4.22Å; F674-V695 HydrophobicContact CG-CG1 4.22Å; I681-V695 HydrophobicContact CD1-CG1 3.91Å; I681-V695 HydrophobicContact CG1-CG1 4.24Å; I681-V695 HydrophobicContact CG2-CG1 3.91Å; L684-V695 HydrophobicContact CD1-CB 4.08Å; L684-V695 HydrophobicContact CD1-CG1 3.83Å; L684-V695 VanDerWaalsContact CD2-O 3.27Å; L684-V695 WeakPolarHBondContact CD2-O 3.39Å; A690-V695 HydrophobicContact CB-CB 3.97Å; A690-V695 HydrophobicContact CB-CG1 4.39Å; A690-V695 HydrophobicContact CB-CG2 3.75Å; A690-V695 VanDerWaalsContact O-CB 3.24Å; A690-V695 WeakPolarHBondContact O-CB 3.45Å; A690-V695 VanDerWaalsContact O-CG2 3.26Å; A690-V695 WeakPolarHBondContact O-CG2 3.39Å; A690-V695 PolarHBondContact O-N 2.82Å; V695-M730 HydrophobicContact CG2-CE 3.37Å
696	R	86.8	Confident	84	Confident	10 Å²	10	27 Å²	27	4%	0.038	16%	0.155	C	C	.	.			trans	-123.1	142.7	176.7	-57.5	-172.9	-156.6	166.7	10.3	113	D557 S587 W589 S591 I681 H699	D557-R696 IonicContact OD1-CZ 3.64Å; D557-R696 IonicContact OD1-NH1 2.69Å; D557-R696 IonicContact OD1-NH2 3.76Å; D557-R696 PolarHBondContact OD1-NH2 3.14Å; D557-R696 IonicContact OD2-CZ 2.66Å; D557-R696 IonicContact OD2-NH1 2.66Å; D557-R696 IonicContact OD2-NH2 2.71Å; D557-R696 PolarHBondContact OD2-NH2 2.84Å; S587-R696 WeakPolarHBondContact O-CD 3.34Å; S587-R696 PolarHBondContact O-NH1 3.04Å; W589-R696 CarbonylContact O-C 3.53Å; W589-R696 WeakPolarHBondContact O-CA 3.35Å; W589-R696 VanDerWaalsContact O-CB 3.32Å; W589-R696 WeakPolarHBondContact O-CB 3.37Å; S591-R696 PolarHBondContact OG-NH1 2.84Å; I681-R696 WeakPolarHBondContact CB-O 3.12Å; I681-R696 WeakPolarHBondContact CD1-O 3.28Å; I681-R696 WeakPolarHBondContact CG2-O 3.41Å; R696-H699 PolarHBondContact O-N 2.88Å
697	V	86.5	Confident	85	Confident	41 Å²	41	28.9 Å²	28.9	25%	0.248	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-70.9	140.6	173.6	-174.3	0	0	0	0	109.8	W589 L684 H699	W589-V697 HydrophobicContact CB-CB 3.99Å; W589-V697 HydrophobicContact CB-CG2 4.38Å; W589-V697 PolarHBondContact O-N 2.99Å; L684-V697 HydrophobicContact CB-CG2 3.54Å; L684-V697 HydrophobicContact CD2-CG2 4.24Å; V697-H699 VanDerWaalsContact C-N 3.28Å; V697-H699 PolarHBondContact O-N 2.8Å
698	G	84.6	Confident	86.3	Confident	36 Å²	36	32.3 Å²	32.3	37%	0.371	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-3.1	-176.2	0	0	0	0	0	114.6	I681 A735	I681-G698 PolarHBondContact O-N 3Å; G698-A735 WeakPolarHBondContact O-CB 3.5Å; G698-A735 PolarHBondContact O-N 3.39Å
699	H	90.4	Very high	87.2	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	146.8	171.2	-79.4	-146.9	0	0	0	111.9	T659 I680 I681 R696 V697 T732 M733	T659-H699 PolarHBondContact OG1-CE1 3.43Å; I680-H699 CarbonylContact C-O 3.59Å; I680-H699 WeakPolarHBondContact CA-O 3.45Å; I681-H699 HydrophobicContact CD1-CB 4Å; I681-H699 PolarHBondContact N-O 3.44Å; R696-H699 PolarHBondContact O-N 2.88Å; V697-H699 VanDerWaalsContact C-N 3.28Å; V697-H699 PolarHBondContact O-N 2.8Å; H699-T732 PolarHBondContact ND1-OG1 3.17Å; H699-M733 CarbonylContact C-O 3.54Å; H699-M733 WeakPolarHBondContact CA-O 3.29Å
700	R	91.2	Very high	87.5	Confident	40 Å²	40	34.9 Å²	34.9	15%	0.151	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.5	166.3	-170.9	177.6	-176.2	70.7	8.2	109.4	N678 G679 I680 V710 T732 M733 A735	N678-R700 PolarHBondContact O-NH1 2.97Å; N678-R700 PolarHBondContact O-NH2 3.01Å; G679-R700 CarbonylContact O-C 3.59Å; G679-R700 VanDerWaalsContact O-CA 3.32Å; G679-R700 WeakPolarHBondContact O-CA 3.41Å; G679-R700 WeakPolarHBondContact O-CG 3.44Å; I680-R700 HydrophobicContact CG1-CB 4.33Å; I680-R700 HydrophobicContact CG1-CG 4.32Å; R700-V710 PolarHBondContact NH2-O 3.22Å; R700-T732 CarbonylContact O-C 3.53Å; R700-T732 VanDerWaalsContact O-CA 3.27Å; R700-T732 WeakPolarHBondContact O-CA 3.34Å; R700-M733 PolarHBondContact N-O 3.01Å; R700-M733 PolarHBondContact O-N 3.34Å; R700-A735 HydrophobicContact CB-CB 4.21Å
701	I	93.1	Very high	87.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.4	171.6	-44.8	176.1	0	0	0	108.1	F674 V676 G679 I681 I704 V709 I717 L721 M730 T732	F674-I701 HydrophobicContact CE2-CD1 4.13Å; V676-I701 HydrophobicContact CB-CD1 4.49Å; V676-I701 HydrophobicContact CG2-CD1 3.98Å; G679-I701 PolarHBondContact O-N 3.41Å; I681-I701 HydrophobicContact CD1-CG1 4.01Å; I681-I701 HydrophobicContact CG1-CD1 4.41Å; I681-I701 HydrophobicContact CG1-CG1 4.18Å; I701-I704 HydrophobicContact CG2-CD1 4.06Å; I701-I704 HydrophobicContact CG2-CG1 3.71Å; I701-V709 HydrophobicContact CB-CG2 4.14Å; I701-V709 HydrophobicContact CG2-CG2 3.78Å; I701-I717 HydrophobicContact CD1-CG2 4.3Å; I701-L721 HydrophobicContact CD1-CD1 4.14Å; I701-M730 HydrophobicContact CD1-SD 4.41Å; I701-M730 HydrophobicContact CG2-SD 4.22Å; I701-T732 HydrophobicContact CG1-CG2 4.42Å
702	I	92.7	Very high	87.9	Confident	26 Å²	26	40.3 Å²	40.3	13%	0.133	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-26	-178.3	63.7	169.1	0	0	0	113	V658 S708 V709 V710 K731 M733 F738	V658-I702 HydrophobicContact CG1-CD1 3.86Å; V658-I702 HydrophobicContact CG2-CD1 3.81Å; I702-S708 WeakPolarHBondContact O-CA 3.32Å; I702-S708 PolarHBondContact O-OG 3.02Å; I702-V709 PolarHBondContact O-N 3.42Å; I702-V710 HydrophobicContact CB-CG2 3.75Å; I702-V710 HydrophobicContact CG2-CG2 4Å; I702-K731 HydrophobicContact CD1-CB 4.2Å; I702-K731 HydrophobicContact CG1-CB 3.81Å; I702-K731 WeakPolarHBondContact CG1-O 3.29Å; I702-K731 PolarHBondContact N-O 3.22Å; I702-M733 HydrophobicContact CG2-CB 4.39Å; I702-F738 HydrophobicContact CG2-CD2 4.48Å
703	E	93.4	Very high	88.5	Confident	50 Å²	50	40.7 Å²	40.7	23%	0.234	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	140.4	-178.2	-163.6	-172.2	113	0	0	110.2	G706 Q707 M730 K731	E703-G706 WeakPolarHBondContact OE1-CA 3.33Å; E703-Q707 CarbonylContact C-O 3.52Å; E703-Q707 VanDerWaalsContact CA-O 3.29Å; E703-Q707 WeakPolarHBondContact CA-O 3.42Å; E703-M730 CarbonylContact O-C 3.56Å; E703-M730 VanDerWaalsContact O-CA 3.24Å; E703-M730 WeakPolarHBondContact O-CA 3.41Å; E703-M730 WeakPolarHBondContact O-CB 3.36Å; E703-K731 HydrophobicContact CB-CB 4.03Å; E703-K731 HydrophobicContact CB-CD 4.28Å; E703-K731 HydrophobicContact CB-CG 4.39Å; E703-K731 PolarHBondContact N-O 2.99Å; E703-K731 PolarHBondContact O-N 3.06Å; E703-K731 WeakPolarHBondContact OE1-CE 3.25Å; E703-K731 IonicContact OE1-NZ 3.88Å; E703-K731 PolarHBondContact OE1-NZ 3.17Å; E703-K731 WeakPolarHBondContact OE2-CD 3.11Å; E703-K731 IonicContact OE2-NZ 3.61Å; E703-K731 PolarHBondContact OE2-NZ 3.43Å
704	I	93.6	Very high	88.8	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.5	173.1	-54.2	178.8	0	0	0	108	I701 G706 Q707 V709 I717 L721 I728 M730	I701-I704 HydrophobicContact CG2-CD1 4.06Å; I701-I704 HydrophobicContact CG2-CG1 3.71Å; I704-G706 VanDerWaalsContact C-N 3.26Å; I704-G706 PolarHBondContact O-N 2.82Å; I704-Q707 PolarHBondContact N-O 2.83Å; I704-Q707 WeakPolarHBondContact O-CA 3.44Å; I704-Q707 WeakPolarHBondContact O-CB 3.42Å; I704-Q707 PolarHBondContact O-N 3.09Å; I704-V709 HydrophobicContact CB-CG1 4.37Å; I704-V709 HydrophobicContact CD1-CG1 4.02Å; I704-V709 HydrophobicContact CD1-CG2 4.3Å; I704-V709 HydrophobicContact CG1-CG1 4.02Å; I704-V709 HydrophobicContact CG1-CG2 4.09Å; I704-I717 HydrophobicContact CD1-CG2 3.98Å; I704-L721 HydrophobicContact CD1-CD1 4.37Å; I704-L721 HydrophobicContact CD1-CD2 3.91Å; I704-L721 HydrophobicContact CD1-CG 3.9Å; I704-I728 HydrophobicContact CG2-CG2 4.11Å; I704-M730 HydrophobicContact CB-CB 4.44Å; I704-M730 HydrophobicContact CG1-CB 4.12Å
705	N	89.9	Confident	89.2	Confident	73 Å²	73	50.6 Å²	50.6	39%	0.39	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	46.3	-178.9	-62.3	-23.8	0	0	0	112.8	Q707 H729	N705-Q707 PolarHBondContact O-N 2.84Å; N705-H729 PolarHBondContact N-O 3.33Å; N705-H729 PolarHBondContact OD1-N 3.06Å; N705-H729 PolarHBondContact OD1-O 3.27Å
706	G	87.6	Confident	89.3	Confident	59 Å²	59	57.2 Å²	57.2	61%	0.608	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-5.4	-177.3	0	0	0	0	0	115.7	E703 I704	E703-G706 WeakPolarHBondContact OE1-CA 3.33Å; I704-G706 VanDerWaalsContact C-N 3.26Å; I704-G706 PolarHBondContact O-N 2.82Å
707	Q	90.1	Very high	89.4	Confident	146 Å²	146	56.7 Å²	56.7	68%	0.682	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.3	179.6	-54.8	-173.9	10.3	0	0	110.6	E703 I704 N705 V709	E703-Q707 CarbonylContact C-O 3.52Å; E703-Q707 VanDerWaalsContact CA-O 3.29Å; E703-Q707 WeakPolarHBondContact CA-O 3.42Å; I704-Q707 PolarHBondContact N-O 2.83Å; I704-Q707 WeakPolarHBondContact O-CA 3.44Å; I704-Q707 WeakPolarHBondContact O-CB 3.42Å; I704-Q707 PolarHBondContact O-N 3.09Å; N705-Q707 PolarHBondContact O-N 2.84Å; Q707-V709 PolarHBondContact O-N 2.79Å
708	S	91.9	Very high	89.6	Confident	81 Å²	81	57.7 Å²	57.7	57%	0.566	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	133.1	176.4	-172.1	0	0	0	0	111.6	I702	I702-S708 WeakPolarHBondContact O-CA 3.32Å; I702-S708 PolarHBondContact O-OG 3.02Å
709	V	90.6	Very high	89.7	Confident	10 Å²	10	61.7 Å²	61.7	6%	0.061	35%	0.352	C	S	.	.			trans	-112.4	3.7	179.7	-64.3	0	0	0	0	113.6	I701 I702 I704 Q707 A711 T712 I717	I701-V709 HydrophobicContact CB-CG2 4.14Å; I701-V709 HydrophobicContact CG2-CG2 3.78Å; I702-V709 PolarHBondContact O-N 3.42Å; I704-V709 HydrophobicContact CB-CG1 4.37Å; I704-V709 HydrophobicContact CD1-CG1 4.02Å; I704-V709 HydrophobicContact CD1-CG2 4.3Å; I704-V709 HydrophobicContact CG1-CG1 4.02Å; I704-V709 HydrophobicContact CG1-CG2 4.09Å; Q707-V709 PolarHBondContact O-N 2.79Å; V709-A711 VanDerWaalsContact C-N 3.28Å; V709-A711 PolarHBondContact O-N 2.81Å; V709-T712 WeakPolarHBondContact O-CB 3.49Å; V709-T712 PolarHBondContact O-N 3.41Å; V709-I717 HydrophobicContact CB-CD1 4.11Å; V709-I717 HydrophobicContact CB-CG1 4.12Å; V709-I717 HydrophobicContact CG1-CG1 4.48Å; V709-I717 HydrophobicContact CG2-CD1 4.46Å
710	V	86.9	Confident	89.6	Confident	47 Å²	47	63.6 Å²	63.6	29%	0.285	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-43	-174.5	176.5	0	0	0	0	113.2	R700 I702 F738	R700-V710 PolarHBondContact NH2-O 3.22Å; I702-V710 HydrophobicContact CB-CG2 3.75Å; I702-V710 HydrophobicContact CG2-CG2 4Å; V710-F738 HydrophobicContact CG1-CE2 3.66Å; V710-F738 HydrophobicContact CG1-CZ 3.49Å; V710-F738 VanDerWaalsContact CG1-CZ 3.49Å; V710-F738 HydrophobicContact CG2-CE2 4.48Å
711	A	84.7	Confident	89.5	Confident	105 Å²	105	62 Å²	62	87%	0.868	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	10.6	-179.7	0	0	0	0	0	113.4	V709	V709-A711 VanDerWaalsContact C-N 3.28Å; V709-A711 PolarHBondContact O-N 2.81Å
712	T	87.8	Confident	89.2	Confident	51 Å²	51	64.8 Å²	64.8	31%	0.313	38%	0.382	S	S	.	.	S	Bend	trans	-87.8	137.5	-175.9	-67.4	0	0	0	0	110.6	V709 K716 I717	V709-T712 WeakPolarHBondContact O-CB 3.49Å; V709-T712 PolarHBondContact O-N 3.41Å; T712-K716 HydrophobicContact CG2-CB 3.58Å; T712-K716 HydrophobicContact CG2-CD 4.31Å; T712-I717 HydrophobicContact CG2-CG1 3.95Å
713	A	89.1	Confident	88.9	Confident	60 Å²	60	68.7 Å²	68.7	50%	0.496	40%	0.403	S	S	.	.			trans	-60.8	140.4	178	0	0	0	0	0	111.6	E715 K716 I717	A713-E715 VanDerWaalsContact C-N 3.28Å; A713-E715 PolarHBondContact O-N 3.41Å; A713-E715 VanDerWaalsContact O-N 3.15Å; A713-K716 WeakPolarHBondContact O-CB 3.27Å; A713-K716 PolarHBondContact O-N 3.16Å; A713-I717 PolarHBondContact O-N 3.25Å
714	H	86.6	Confident	88.5	Confident	66 Å²	66	67.3 Å²	67.3	31%	0.306	40%	0.399	S	S	.	.	H	α-helix	trans	-48.1	-45.3	-175.1	169.1	37.2	0	0	0	113.8	V676 K716 I717 V718	V676-H714 PolarHBondContact O-CE1 3.47Å; H714-K716 VanDerWaalsContact C-N 3.29Å; H714-K716 PolarHBondContact O-N 2.91Å; H714-I717 WeakPolarHBondContact O-CB 3.16Å; H714-I717 PolarHBondContact O-N 3.37Å; H714-V718 WeakPolarHBondContact CE1-CG2 3.42Å; H714-V718 PolarHBondContact O-N 3.18Å
715	E	88.8	Confident	88.2	Confident	155 Å²	155	70.6 Å²	70.6	72%	0.724	42%	0.419	S	S	*	.	H	α-helix	trans	-54.6	-42.3	177.8	-62.9	169.5	175.5	0	0	112.5	A713 V718 Q719	A713-E715 VanDerWaalsContact C-N 3.28Å; A713-E715 PolarHBondContact O-N 3.41Å; A713-E715 VanDerWaalsContact O-N 3.15Å; E715-V718 PolarHBondContact O-N 2.89Å; E715-Q719 VanDerWaalsContact O-CB 3.32Å; E715-Q719 WeakPolarHBondContact O-CB 3.35Å; E715-Q719 PolarHBondContact O-N 3.29Å
716	K	89.3	Confident	88	Confident	138 Å²	138	68.8 Å²	68.8	60%	0.6	42%	0.418	S	S	*	.	H	α-helix	trans	-71.4	-31.1	178.4	-69.1	-175.1	176.4	-174.2	0	112.4	T712 A713 H714 A720	T712-K716 HydrophobicContact CG2-CB 3.58Å; T712-K716 HydrophobicContact CG2-CD 4.31Å; A713-K716 WeakPolarHBondContact O-CB 3.27Å; A713-K716 PolarHBondContact O-N 3.16Å; H714-K716 VanDerWaalsContact C-N 3.29Å; H714-K716 PolarHBondContact O-N 2.91Å; K716-A720 VanDerWaalsContact O-CB 3.27Å; K716-A720 WeakPolarHBondContact O-CB 3.24Å; K716-A720 PolarHBondContact O-N 2.98Å
717	I	89.6	Confident	88	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-67.1	-45.9	173.5	-54.6	-177.9	0	0	0	109.5	I701 I704 V709 T712 A713 H714 A720 L721	I701-I717 HydrophobicContact CD1-CG2 4.3Å; I704-I717 HydrophobicContact CD1-CG2 3.98Å; V709-I717 HydrophobicContact CB-CD1 4.11Å; V709-I717 HydrophobicContact CB-CG1 4.12Å; V709-I717 HydrophobicContact CG1-CG1 4.48Å; V709-I717 HydrophobicContact CG2-CD1 4.46Å; T712-I717 HydrophobicContact CG2-CG1 3.95Å; A713-I717 PolarHBondContact O-N 3.25Å; H714-I717 WeakPolarHBondContact O-CB 3.16Å; H714-I717 PolarHBondContact O-N 3.37Å; I717-A720 PolarHBondContact O-N 2.93Å; I717-L721 HydrophobicContact CG2-CD1 4.13Å; I717-L721 WeakPolarHBondContact O-CG 3.48Å; I717-L721 PolarHBondContact O-N 2.8Å
718	V	89.2	Confident	88	Confident	62 Å²	62	63.7 Å²	63.7	38%	0.376	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-45.2	174.9	175.5	0	0	0	0	110.9	V676 H714 E715 A720 L721 S722	V676-V718 HydrophobicContact CG1-CG2 3.8Å; H714-V718 WeakPolarHBondContact CE1-CG2 3.42Å; H714-V718 PolarHBondContact O-N 3.18Å; E715-V718 PolarHBondContact O-N 2.89Å; V718-A720 PolarHBondContact O-N 3.35Å; V718-L721 PolarHBondContact O-N 2.91Å; V718-S722 WeakPolarHBondContact O-CB 3.29Å; V718-S722 PolarHBondContact O-N 3.34Å
719	Q	87.5	Confident	87.9	Confident	119 Å²	119	64.4 Å²	64.4	56%	0.556	37%	0.372	S	S	*	.	H	α-helix	trans	-62.9	-41.6	178.8	-169.4	177.4	29.6	0	0	112.3	E715 N723	E715-Q719 VanDerWaalsContact O-CB 3.32Å; E715-Q719 WeakPolarHBondContact O-CB 3.35Å; E715-Q719 PolarHBondContact O-N 3.29Å; Q719-N723 VanDerWaalsContact O-CB 3.28Å; Q719-N723 WeakPolarHBondContact O-CB 3.17Å; Q719-N723 VanDerWaalsContact O-CG 3.26Å; Q719-N723 PolarHBondContact O-N 2.92Å
720	A	89	Confident	88	Confident	41 Å²	41	64 Å²	64	34%	0.339	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-46	176.2	0	0	0	0	0	111.9	K716 I717 V718 S724	K716-A720 VanDerWaalsContact O-CB 3.27Å; K716-A720 WeakPolarHBondContact O-CB 3.24Å; K716-A720 PolarHBondContact O-N 2.98Å; I717-A720 PolarHBondContact O-N 2.93Å; V718-A720 PolarHBondContact O-N 3.35Å; A720-S724 WeakPolarHBondContact O-CB 3.46Å; A720-S724 PolarHBondContact O-N 3.46Å; A720-S724 PolarHBondContact O-OG 2.87Å
721	L	88.2	Confident	88.2	Confident	6 Å²	6	65.2 Å²	65.2	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-48	176.4	-71.1	168.5	0	0	0	111.8	R665 L672 F674 V676 I701 I704 I717 V718 N723 S724 M730	R665-L721 PolarHBondContact NH1-O 3.44Å; L672-L721 HydrophobicContact CD1-CB 3.84Å; L672-L721 HydrophobicContact CD1-CD2 4.38Å; F674-L721 HydrophobicContact CE2-CD1 4.16Å; F674-L721 HydrophobicContact CZ-CD1 3.7Å; F674-L721 HydrophobicContact CZ-CD2 4.11Å; V676-L721 HydrophobicContact CG1-CD1 4.26Å; I701-L721 HydrophobicContact CD1-CD1 4.14Å; I704-L721 HydrophobicContact CD1-CD1 4.37Å; I704-L721 HydrophobicContact CD1-CD2 3.91Å; I704-L721 HydrophobicContact CD1-CG 3.9Å; I717-L721 HydrophobicContact CG2-CD1 4.13Å; I717-L721 WeakPolarHBondContact O-CG 3.48Å; I717-L721 PolarHBondContact O-N 2.8Å; V718-L721 PolarHBondContact O-N 2.91Å; L721-N723 VanDerWaalsContact C-N 3.3Å; L721-N723 PolarHBondContact O-N 2.82Å; L721-S724 PolarHBondContact O-N 2.88Å; L721-M730 HydrophobicContact CD2-SD 4.04Å
722	S	86.3	Confident	88.5	Confident	59 Å²	59	60.2 Å²	60.2	41%	0.413	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-35.6	-177.6	-174.1	0	0	0	0	112.7	R665 L668 V718	R665-S722 PolarHBondContact NH1-O 3.27Å; L668-S722 VanDerWaalsContact CD2-O 3.25Å; L668-S722 WeakPolarHBondContact CD2-O 3.42Å; V718-S722 WeakPolarHBondContact O-CB 3.29Å; V718-S722 PolarHBondContact O-N 3.34Å
723	N	86.6	Confident	88.7	Confident	108 Å²	108	58.7 Å²	58.7	58%	0.578	32%	0.319	S	S	*	.	H	α-helix	trans	-91.4	-6.7	-179	-65.1	4.1	0	0	0	113.5	Q719 L721	Q719-N723 VanDerWaalsContact O-CB 3.28Å; Q719-N723 WeakPolarHBondContact O-CB 3.17Å; Q719-N723 VanDerWaalsContact O-CG 3.26Å; Q719-N723 PolarHBondContact O-N 2.92Å; L721-N723 VanDerWaalsContact C-N 3.3Å; L721-N723 PolarHBondContact O-N 2.82Å
724	S	85.8	Confident	88.7	Confident	21 Å²	21	56.2 Å²	56.2	15%	0.147	30%	0.298	C	S	.	.			trans	-82.8	134	179.4	-68	0	0	0	0	111.7	R665 A720 L721	R665-S724 WeakPolarHBondContact CD-O 3.39Å; R665-S724 PolarHBondContact NH1-O 2.84Å; A720-S724 WeakPolarHBondContact O-CB 3.46Å; A720-S724 PolarHBondContact O-N 3.46Å; A720-S724 PolarHBondContact O-OG 2.87Å; L721-S724 PolarHBondContact O-N 2.88Å
725	V	86.1	Confident	88.8	Confident	75 Å²	75	53.5 Å²	53.5	46%	0.455	29%	0.287	S	S	.	.			trans	-134.1	164.6	172.3	-68	0	0	0	0	109.4	R665 L668	R665-V725 CarbonylContact O-C 3.58Å; R665-V725 WeakPolarHBondContact O-CA 3.11Å; L668-V725 HydrophobicContact CD2-CG1 3.58Å; L668-V725 HydrophobicContact CG-CG1 3.74Å
726	G	85.6	Confident	88.7	Confident	36 Å²	36	47.5 Å²	47.5	37%	0.371	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78.8	-136	-168.1	0	0	0	0	0	111.1	R665	R665-G726 PolarHBondContact N-O 3.36Å; R665-G726 PolarHBondContact O-N 2.64Å
727	E	88.1	Confident	88.6	Confident	97 Å²	97	41 Å²	41	45%	0.453	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	98.8	-174.5	-59.7	-165.6	147.1	0	0	111.8	L662 K664 H729	L662-E727 HydrophobicContact CD1-CB 4.11Å; K664-E727 HydrophobicContact CD-CG 4.34Å; K664-E727 WeakPolarHBondContact CD-OE1 3.38Å; K664-E727 WeakPolarHBondContact CE-OE1 3.32Å; K664-E727 HydrophobicContact CG-CG 4.27Å; K664-E727 IonicContact NZ-OE1 3.85Å; K664-E727 PolarHBondContact NZ-OE1 3.09Å; E727-H729 PolarHBondContact O-N 2.98Å; E727-H729 PolarHBondContact O-ND1 2.76Å; E727-H729 IonicContact OE2-CE1 2.8Å
728	I	90.1	Very high	88.6	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	108.6	176.9	-40.9	179	0	0	0	108.3	I663 R665 L672 I704	I663-I728 HydrophobicContact CB-CB 4.23Å; I663-I728 PolarHBondContact N-O 3.17Å; I663-I728 PolarHBondContact O-N 3.31Å; R665-I728 HydrophobicContact CB-CD1 4.34Å; L672-I728 HydrophobicContact CD2-CD1 3.7Å; I704-I728 HydrophobicContact CG2-CG2 4.11Å
729	H	90.7	Very high	88.6	Confident	96 Å²	96	43.3 Å²	43.3	44%	0.444	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.6	175.5	-67	69.5	0	0	0	108.2	N705 E727	N705-H729 PolarHBondContact N-O 3.33Å; N705-H729 PolarHBondContact OD1-N 3.06Å; N705-H729 PolarHBondContact OD1-O 3.27Å; E727-H729 PolarHBondContact O-N 2.98Å; E727-H729 PolarHBondContact O-ND1 2.76Å; E727-H729 IonicContact OE2-CE1 2.8Å
730	M	91.9	Very high	88.6	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	160.8	175.2	68	178.6	-174.3	0	0	112.7	V661 I663 F674 V695 I701 E703 I704 L721	V661-M730 HydrophobicContact CB-CE 4.4Å; V661-M730 HydrophobicContact CB-CG 3.82Å; V661-M730 WeakPolarHBondContact CB-O 3.47Å; V661-M730 HydrophobicContact CG1-CE 3.77Å; V661-M730 HydrophobicContact CG1-CG 4.04Å; V661-M730 PolarHBondContact N-O 3.18Å; V661-M730 PolarHBondContact O-N 2.69Å; I663-M730 HydrophobicContact CD1-CE 3.78Å; F674-M730 HydrophobicContact CE1-CE 4.4Å; F674-M730 HydrophobicContact CZ-CE 3.88Å; V695-M730 HydrophobicContact CG2-CE 3.37Å; I701-M730 HydrophobicContact CD1-SD 4.41Å; I701-M730 HydrophobicContact CG2-SD 4.22Å; E703-M730 CarbonylContact O-C 3.56Å; E703-M730 VanDerWaalsContact O-CA 3.24Å; E703-M730 WeakPolarHBondContact O-CA 3.41Å; E703-M730 WeakPolarHBondContact O-CB 3.36Å; I704-M730 HydrophobicContact CB-CB 4.44Å; I704-M730 HydrophobicContact CG1-CB 4.12Å; L721-M730 HydrophobicContact CD2-SD 4.04Å
731	K	91.8	Very high	88.4	Confident	73 Å²	73	40.7 Å²	40.7	32%	0.317	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.3	178.9	-64.9	175.4	-169.9	145.4	0	109.7	V658 T659 I702 E703	V658-K731 HydrophobicContact CG1-CB 3.7Å; V658-K731 HydrophobicContact CG1-CD 4.2Å; V658-K731 HydrophobicContact CG1-CG 4.14Å; T659-K731 WeakPolarHBondContact O-CA 3.44Å; I702-K731 HydrophobicContact CD1-CB 4.2Å; I702-K731 HydrophobicContact CG1-CB 3.81Å; I702-K731 WeakPolarHBondContact CG1-O 3.29Å; I702-K731 PolarHBondContact N-O 3.22Å; E703-K731 HydrophobicContact CB-CB 4.03Å; E703-K731 HydrophobicContact CB-CD 4.28Å; E703-K731 HydrophobicContact CB-CG 4.39Å; E703-K731 PolarHBondContact N-O 2.99Å; E703-K731 PolarHBondContact O-N 3.06Å; E703-K731 WeakPolarHBondContact OE1-CE 3.25Å; E703-K731 IonicContact OE1-NZ 3.88Å; E703-K731 PolarHBondContact OE1-NZ 3.17Å; E703-K731 WeakPolarHBondContact OE2-CD 3.11Å; E703-K731 IonicContact OE2-NZ 3.61Å; E703-K731 PolarHBondContact OE2-NZ 3.43Å
732	T	91.6	Very high	88.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	156.6	-178.2	76.3	0	0	0	0	111.3	V658 T659 V661 I681 H699 R700 I701	V658-T732 CarbonylContact C-O 3.57Å; V658-T732 WeakPolarHBondContact CA-O 3.37Å; T659-T732 PolarHBondContact N-O 3.06Å; T659-T732 PolarHBondContact O-N 3Å; V661-T732 HydrophobicContact CG2-CG2 3.9Å; I681-T732 HydrophobicContact CD1-CG2 4.18Å; H699-T732 PolarHBondContact ND1-OG1 3.17Å; R700-T732 CarbonylContact O-C 3.53Å; R700-T732 VanDerWaalsContact O-CA 3.27Å; R700-T732 WeakPolarHBondContact O-CA 3.34Å; I701-T732 HydrophobicContact CG1-CG2 4.42Å
733	M	90.1	Very high	88.2	Confident	19 Å²	19	43.9 Å²	43.9	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.6	179.7	170.8	-176.8	-78	0	0	108.9	P657 V658 H699 R700 I702 A735 M737 F738 L741	P657-M733 HydrophobicContact CB-CE 4.31Å; P657-M733 WeakPolarHBondContact O-CG 3.39Å; V658-M733 HydrophobicContact CG2-CE 3.79Å; H699-M733 CarbonylContact C-O 3.54Å; H699-M733 WeakPolarHBondContact CA-O 3.29Å; R700-M733 PolarHBondContact N-O 3.01Å; R700-M733 PolarHBondContact O-N 3.34Å; I702-M733 HydrophobicContact CG2-CB 4.39Å; M733-A735 PolarHBondContact O-N 3.23Å; M733-M737 HydrophobicContact CE-SD 4.29Å; M733-M737 HydrophobicContact CG-CB 4.46Å; M733-M737 HydrophobicContact CG-SD 4Å; M733-M737 HydrophobicContact SD-CG 4.46Å; M733-M737 HydrophobicContact SD-SD 4.2Å; M733-F738 HydrophobicContact CG-CB 4.44Å; M733-F738 HydrophobicContact SD-CB 3.96Å; M733-F738 HydrophobicContact SD-CD2 4.26Å; M733-L741 HydrophobicContact CE-CD1 4.09Å; M733-L741 HydrophobicContact SD-CD1 4.02Å
734	P	89.6	Confident	88.1	Confident	7 Å²	7	45 Å²	45	5%	0.045	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	125.6	175.1	-26.1	32.4	0	0	0	111.9	V585 I597 A736 M737 F738	V585-P734 HydrophobicContact CG2-CB 4.3Å; I597-P734 HydrophobicContact CD1-CG 3.96Å; P734-A736 VanDerWaalsContact C-N 3.26Å; P734-A736 PolarHBondContact O-N 3.47Å; P734-M737 HydrophobicContact CB-CB 4.14Å; P734-M737 WeakPolarHBondContact O-CB 3.41Å; P734-M737 PolarHBondContact O-N 2.91Å; P734-F738 PolarHBondContact O-N 2.78Å
735	A	88.6	Confident	88.2	Confident	9 Å²	9	47.8 Å²	47.8	7%	0.074	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-30.5	-170	0	0	0	0	0	113.1	I680 G698 R700 M733 F738 R739	I680-A735 HydrophobicContact CD1-CB 4.04Å; I680-A735 HydrophobicContact CG1-CB 4.17Å; I680-A735 HydrophobicContact CG2-CB 4.13Å; G698-A735 WeakPolarHBondContact O-CB 3.5Å; G698-A735 PolarHBondContact O-N 3.39Å; R700-A735 HydrophobicContact CB-CB 4.21Å; M733-A735 PolarHBondContact O-N 3.23Å; A735-F738 PolarHBondContact O-N 3.37Å; A735-R739 WeakPolarHBondContact O-CG 3.28Å; A735-R739 PolarHBondContact O-N 3.23Å
736	A	86.9	Confident	88.2	Confident	30 Å²	30	49.6 Å²	49.6	25%	0.248	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-46.3	172.2	0	0	0	0	0	111.9	V585 P734 F738 R739 L740	V585-A736 HydrophobicContact CB-CB 4.48Å; V585-A736 HydrophobicContact CG1-CB 3.82Å; P734-A736 VanDerWaalsContact C-N 3.26Å; P734-A736 PolarHBondContact O-N 3.47Å; A736-F738 VanDerWaalsContact C-N 3.31Å; A736-F738 PolarHBondContact O-N 3.03Å; A736-R739 PolarHBondContact O-N 2.84Å; A736-L740 WeakPolarHBondContact O-CG 3.48Å; A736-L740 PolarHBondContact O-N 2.93Å
737	M	87.7	Confident	88.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-43.6	174	-175.8	-164.7	-79.2	0	0	111	I597 A599 P657 M733 P734 R739 L740 L741	I597-M737 HydrophobicContact CB-CE 4.43Å; I597-M737 HydrophobicContact CG2-CE 3.42Å; I597-M737 VanDerWaalsContact CG2-CE 3.42Å; A599-M737 HydrophobicContact CB-CB 4.07Å; A599-M737 HydrophobicContact CB-CE 4.43Å; A599-M737 HydrophobicContact CB-CG 4.04Å; P657-M737 HydrophobicContact CB-CE 3.93Å; P657-M737 HydrophobicContact CB-SD 3.51Å; P657-M737 VanDerWaalsContact CB-SD 3.51Å; M733-M737 HydrophobicContact CE-SD 4.29Å; M733-M737 HydrophobicContact CG-CB 4.46Å; M733-M737 HydrophobicContact CG-SD 4Å; M733-M737 HydrophobicContact SD-CG 4.46Å; M733-M737 HydrophobicContact SD-SD 4.2Å; P734-M737 HydrophobicContact CB-CB 4.14Å; P734-M737 WeakPolarHBondContact O-CB 3.41Å; P734-M737 PolarHBondContact O-N 2.91Å; M737-R739 PolarHBondContact O-N 2.73Å; M737-L740 PolarHBondContact O-N 2.96Å; M737-L741 HydrophobicContact CG-CD1 3.77Å; M737-L741 HydrophobicContact CG-CG 4.22Å; M737-L741 WeakPolarHBondContact O-CB 3.4Å; M737-L741 WeakPolarHBondContact O-CG 3.47Å; M737-L741 PolarHBondContact O-N 3.15Å; M737-L741 HydrophobicContact SD-CD1 4.18Å
738	F	89.1	Confident	88.3	Confident	22 Å²	22	52 Å²	52	10%	0.096	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-43.5	176.1	178.5	-88.2	0	0	0	112.7	I702 V710 M733 P734 A735 A736 T742	I702-F738 HydrophobicContact CG2-CD2 4.48Å; V710-F738 HydrophobicContact CG1-CE2 3.66Å; V710-F738 HydrophobicContact CG1-CZ 3.49Å; V710-F738 VanDerWaalsContact CG1-CZ 3.49Å; V710-F738 HydrophobicContact CG2-CE2 4.48Å; M733-F738 HydrophobicContact CG-CB 4.44Å; M733-F738 HydrophobicContact SD-CB 3.96Å; M733-F738 HydrophobicContact SD-CD2 4.26Å; P734-F738 PolarHBondContact O-N 2.78Å; A735-F738 PolarHBondContact O-N 3.37Å; A736-F738 VanDerWaalsContact C-N 3.31Å; A736-F738 PolarHBondContact O-N 3.03Å; F738-T742 HydrophobicContact CD1-CG2 4.41Å; F738-T742 HydrophobicContact CD2-CG2 4.4Å; F738-T742 HydrophobicContact CE1-CG2 3.92Å; F738-T742 HydrophobicContact CE2-CG2 3.91Å; F738-T742 HydrophobicContact CZ-CG2 3.63Å; F738-T742 WeakPolarHBondContact O-CB 3.32Å; F738-T742 WeakPolarHBondContact O-CG2 3.27Å; F738-T742 PolarHBondContact O-N 2.65Å; F738-T742 PolarHBondContact O-OG1 3.3Å
739	R	88.9	Confident	88.3	Confident	89 Å²	89	55.7 Å²	55.7	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-65.6	-39.4	177.3	-70.4	-170.5	-46.7	-117.3	4.6	112.4	A735 A736 M737 T742 G743 Q744 E745	A735-R739 WeakPolarHBondContact O-CG 3.28Å; A735-R739 PolarHBondContact O-N 3.23Å; A736-R739 PolarHBondContact O-N 2.84Å; M737-R739 PolarHBondContact O-N 2.73Å; R739-T742 PolarHBondContact O-OG1 3.25Å; R739-G743 PolarHBondContact O-N 3.23Å; R739-G743 VanDerWaalsContact O-N 3.17Å; R739-Q744 HydrophobicContact CB-CB 4.15Å; R739-Q744 HydrophobicContact CG-CB 4.4Å; R739-Q744 PolarHBondContact O-N 2.87Å; R739-E745 HydrophobicContact CB-CB 3.95Å; R739-E745 IonicContact CZ-OE2 3.72Å; R739-E745 IonicContact NE-OE2 2.87Å; R739-E745 PolarHBondContact NE-OE2 3.47Å; R739-E745 IonicContact NH2-OE1 2.79Å; R739-E745 PolarHBondContact NH2-OE1 2.92Å; R739-E745 IonicContact NH2-OE2 2.75Å; R739-E745 PolarHBondContact NH2-OE2 3.29Å; R739-E745 PolarHBondContact O-N 3.39Å
740	L	88	Confident	88.2	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-48.4	175.4	-69.2	166.2	0	0	0	111.5	V583 V585 A599 A736 M737 T742 G743 E745 P747	V583-L740 HydrophobicContact CG1-CD1 3.83Å; V585-L740 HydrophobicContact CG1-CD1 4.48Å; A599-L740 HydrophobicContact CB-CD1 3.92Å; A736-L740 WeakPolarHBondContact O-CG 3.48Å; A736-L740 PolarHBondContact O-N 2.93Å; M737-L740 PolarHBondContact O-N 2.96Å; L740-T742 VanDerWaalsContact C-N 3.31Å; L740-T742 PolarHBondContact O-N 2.79Å; L740-G743 PolarHBondContact O-N 2.75Å; L740-E745 HydrophobicContact CD2-CB 4.38Å; L740-E745 HydrophobicContact CD2-CG 4.35Å; L740-P747 HydrophobicContact CD2-CB 4.13Å
741	L	85.9	Confident	88	Confident	87 Å²	87	54.6 Å²	54.6	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-66.6	-29.6	179.3	-70.7	174.2	0	0	0	113.2	I615 M733 M737	I615-L741 HydrophobicContact CG2-CD2 4.49Å; M733-L741 HydrophobicContact CE-CD1 4.09Å; M733-L741 HydrophobicContact SD-CD1 4.02Å; M737-L741 HydrophobicContact CG-CD1 3.77Å; M737-L741 HydrophobicContact CG-CG 4.22Å; M737-L741 WeakPolarHBondContact O-CB 3.4Å; M737-L741 WeakPolarHBondContact O-CG 3.47Å; M737-L741 PolarHBondContact O-N 3.15Å; M737-L741 HydrophobicContact SD-CD1 4.18Å
742	T	85.6	Confident	87.8	Confident	67 Å²	67	53.6 Å²	53.6	41%	0.411	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.4	175.5	55	0	0	0	0	114.1	F738 R739 L740 Q744	F738-T742 HydrophobicContact CD1-CG2 4.41Å; F738-T742 HydrophobicContact CD2-CG2 4.4Å; F738-T742 HydrophobicContact CE1-CG2 3.92Å; F738-T742 HydrophobicContact CE2-CG2 3.91Å; F738-T742 HydrophobicContact CZ-CG2 3.63Å; F738-T742 WeakPolarHBondContact O-CB 3.32Å; F738-T742 WeakPolarHBondContact O-CG2 3.27Å; F738-T742 PolarHBondContact O-N 2.65Å; F738-T742 PolarHBondContact O-OG1 3.3Å; R739-T742 PolarHBondContact O-OG1 3.25Å; L740-T742 VanDerWaalsContact C-N 3.31Å; L740-T742 PolarHBondContact O-N 2.79Å; T742-Q744 PolarHBondContact O-N 2.94Å; T742-Q744 WeakPolarHBondContact OG1-CG 3.38Å; T742-Q744 PolarHBondContact OG1-NE2 2.83Å
743	G	83.7	Confident	87.6	Confident	66 Å²	66	56.6 Å²	56.6	68%	0.68	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	17.5	178.7	0	0	0	0	0	114.8	R739 L740 E745	R739-G743 PolarHBondContact O-N 3.23Å; R739-G743 VanDerWaalsContact O-N 3.17Å; L740-G743 PolarHBondContact O-N 2.75Å; G743-E745 VanDerWaalsContact C-N 3.3Å
744	Q	84.6	Confident	87.4	Confident	131 Å²	131	58.8 Å²	58.8	61%	0.612	33%	0.326	S	S	*	.	S	Bend	trans	-77.5	-19.3	176	-62.9	179	16.4	0	0	112.3	R739 T742	R739-Q744 HydrophobicContact CB-CB 4.15Å; R739-Q744 HydrophobicContact CG-CB 4.4Å; R739-Q744 PolarHBondContact O-N 2.87Å; T742-Q744 PolarHBondContact O-N 2.94Å; T742-Q744 WeakPolarHBondContact OG1-CG 3.38Å; T742-Q744 PolarHBondContact OG1-NE2 2.83Å
745	E	87.1	Confident	87.3	Confident	79 Å²	79	62.1 Å²	62.1	37%	0.369	34%	0.344	S	S	.	.	S	Bend	trans	-138.1	139.1	-177.2	-173.5	167.1	-156.7	0	0	109.4	R739 L740 G743	R739-E745 HydrophobicContact CB-CB 3.95Å; R739-E745 IonicContact CZ-OE2 3.72Å; R739-E745 IonicContact NE-OE2 2.87Å; R739-E745 PolarHBondContact NE-OE2 3.47Å; R739-E745 IonicContact NH2-OE1 2.79Å; R739-E745 PolarHBondContact NH2-OE1 2.92Å; R739-E745 IonicContact NH2-OE2 2.75Å; R739-E745 PolarHBondContact NH2-OE2 3.29Å; R739-E745 PolarHBondContact O-N 3.39Å; L740-E745 HydrophobicContact CD2-CB 4.38Å; L740-E745 HydrophobicContact CD2-CG 4.35Å; G743-E745 VanDerWaalsContact C-N 3.3Å
746	T	86.9	Confident	87.2	Confident	113 Å²	113	65.6 Å²	65.6	69%	0.693	36%	0.362	S	S	*	.			trans	-82	128.7	-176.9	49.8	0	0	0	0	111.3	L748	T746-L748 PolarHBondContact O-N 2.87Å
747	P	88.3	Confident	87.2	Confident	43 Å²	43	68.1 Å²	68.1	28%	0.279	37%	0.37	S	S	.	.			trans	-66.2	123.7	178.7	25.7	-33.4	0	0	0	112.3	V583 L740 Y749	V583-P747 HydrophobicContact CG2-CB 3.69Å; L740-P747 HydrophobicContact CD2-CB 4.13Å; P747-Y749 HydrophobicContact CB-CE1 3.94Å; P747-Y749 HydrophobicContact CB-CE2 4.04Å; P747-Y749 HydrophobicContact CG-CE1 4.46Å; P747-Y749 HydrophobicContact CG-CE2 3.9Å; P747-Y749 WeakPolarHBondContact CG-OH 3.09Å
748	L	87.8	Confident	87.2	Confident	142 Å²	142	73.4 Å²	73.4	74%	0.743	40%	0.398	S	S	*	.			trans	-96.8	94.7	172.6	-69.5	172	0	0	0	109.3	T746	T746-L748 PolarHBondContact O-N 2.87Å
749	Y	89.8	Confident	87	Confident	77 Å²	77	77.7 Å²	77.7	30%	0.302	42%	0.423	S	S	.	.			trans	-73.7	141.5	-177.6	-58.7	-68.4	0	0	0	113	V582 V583 M601 M602 P747	V582-Y749 WeakPolarHBondContact O-CA 3.37Å; V583-Y749 HydrophobicContact CG2-CD1 3.48Å; V583-Y749 VanDerWaalsContact CG2-CD1 3.48Å; V583-Y749 HydrophobicContact CG2-CE1 3.67Å; V583-Y749 HydrophobicContact CG2-CG 4.29Å; M601-Y749 VanDerWaalsContact C-CE1 3.44Å; M602-Y749 HydrophobicContact CB-CD1 3.67Å; M602-Y749 HydrophobicContact CB-CD2 4.06Å; M602-Y749 HydrophobicContact CB-CE1 3.83Å; M602-Y749 HydrophobicContact CB-CE2 4.19Å; M602-Y749 HydrophobicContact CB-CG 3.8Å; M602-Y749 HydrophobicContact CG-CD1 4.48Å; M602-Y749 HydrophobicContact CG-CD2 3.97Å; M602-Y749 HydrophobicContact CG-CE2 4.1Å; M602-Y749 HydrophobicContact CG-CG 4.16Å; M602-Y749 VanDerWaalsContact N-CE1 3.28Å; M602-Y749 HydrophobicContact SD-CD2 4.06Å; M602-Y749 HydrophobicContact SD-CG 4.21Å; P747-Y749 HydrophobicContact CB-CE1 3.94Å; P747-Y749 HydrophobicContact CB-CE2 4.04Å; P747-Y749 HydrophobicContact CG-CE1 4.46Å; P747-Y749 HydrophobicContact CG-CE2 3.9Å; P747-Y749 WeakPolarHBondContact CG-OH 3.09Å
750	I	88	Confident	86.9	Confident	20 Å²	20	76.6 Å²	76.6	10%	0.103	43%	0.431	C	S	.	.			trans	-131.1	0	178.6	62.5	169.7	0	0	0	111.8	I579 L580 G581 V582 V584 Q636 I639 K640	I579-I750 WeakPolarHBondContact CB-OXT 3.03Å; L580-I750 CarbonylContact C-O 3.57Å; L580-I750 PolarHBondContact N-O 2.69Å; L580-I750 PolarHBondContact N-OXT 3.16Å; G581-I750 PolarHBondContact N-O 3.39Å; V582-I750 HydrophobicContact CG2-CG1 4.05Å; V582-I750 PolarHBondContact N-O 2.78Å; V582-I750 WeakPolarHBondContact O-CG1 3.15Å; V582-I750 PolarHBondContact O-N 2.87Å; V584-I750 HydrophobicContact CG2-CD1 3.99Å; Q636-I750 HydrophobicContact CB-CD1 3.98Å; Q636-I750 HydrophobicContact CG-CD1 3.88Å; I639-I750 HydrophobicContact CB-CD1 3.82Å; I639-I750 HydrophobicContact CB-CG1 4.4Å; I639-I750 HydrophobicContact CD1-CD1 4.02Å; I639-I750 HydrophobicContact CG2-CB 4.31Å; I639-I750 HydrophobicContact CG2-CD1 3.69Å; I639-I750 HydrophobicContact CG2-CG1 3.7Å; K640-I750 HydrophobicContact CD-CG2 4.39Å; K640-I750 VanDerWaalsContact CE-CG2 3.42Å; K640-I750 HydrophobicContact CG-CB 4.02Å; K640-I750 HydrophobicContact CG-CG2 4.07Å

Retrieved 750 of 750 residues in 381.6 ms (Link to these results)

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