X5D7T2_HUMAN Loading...

Aryl hydrocarbon receptor nuclear translocator 2

Transcription factor that plays a role in the development of the hypothalamo-pituitary axis, postnatal brain growth, and visual and renal function. Specifically recognizes the xenobiotic response element (XRE).

AlphaFold DB , UniProt , Accession X5D7T2, Species HUMAN (Homo sapiens, Human), Gene ARNT2, Length 694 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	33.9	Very low	252 Å²	252	140.2 Å²	140.2	100%	1.241	87%	0.865	S	S	*	*				0	161.4	0	-80	173	164.1	0	0	108.8
2	A	30.1	Very low	33.6	Very low	97 Å²	97	144.7 Å²	144.7	80%	0.802	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-85.2	153.3	-167.3	0	0	0	0	0	114.1
3	T	28.4	Very low	33.3	Very low	132 Å²	132	141.5 Å²	141.5	81%	0.81	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-82	131.1	165.8	46.9	0	0	0	0	110.8
4	P	42.6	Very low	33.1	Very low	130 Å²	130	139.6 Å²	139.6	84%	0.844	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-77.8	172.8	167.5	33	-33.6	0	0	0	112.1
5	A	31.4	Very low	32.8	Very low	101 Å²	101	141.3 Å²	141.3	84%	0.835	87%	0.868	S	S	*	*			trans	-103.9	178.7	-162	0	0	0	0	0	115.6
6	A	31.3	Very low	32.9	Very low	101 Å²	101	142.7 Å²	142.7	84%	0.835	87%	0.866	S	S	*	*			trans	-77.8	168.2	-174.8	0	0	0	0	0	115
7	V	31.8	Very low	33.3	Very low	135 Å²	135	141.9 Å²	141.9	82%	0.818	86%	0.864	S	S	*	*			trans	-132	137.8	178.6	178.7	0	0	0	0	109.8
8	N	32	Very low	33	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	86%	0.862	S	S	*	*			trans	-97.3	148.6	174.4	-75.9	-17.6	0	0	0	111.9
9	P	37.8	Very low	32.9	Very low	118 Å²	118	137.4 Å²	137.4	77%	0.766	86%	0.86	S	S	*	*			trans	-94	167.3	157.2	23.6	-8.2	0	0	0	112.7
10	P	42.2	Very low	32.7	Very low	129 Å²	129	137.3 Å²	137.3	84%	0.838	86%	0.858	S	S	*	*			trans	-106.1	-179.5	-159.8	41.2	-37.2	0	0	0	116.3
11	E	30	Very low	32.6	Very low	192 Å²	192	136.4 Å²	136.4	90%	0.897	85%	0.852	S	S	*	*			trans	-69.9	161.9	177.2	-60	170.5	113.7	0	0	114.1
12	M	31.1	Very low	32.4	Very low	194 Å²	194	132 Å²	132	96%	0.956	83%	0.833	S	S	*	*			trans	-127.2	141.2	163.3	-82	-169.8	-77.2	0	0	110.3
13	A	29	Very low	33.2	Very low	103 Å²	103	132.7 Å²	132.7	85%	0.851	83%	0.829	S	S	*	*			trans	-109.1	156.9	175.4	0	0	0	0	0	111.3
14	S	31.1	Very low	33.2	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	83%	0.833	S	S	*	*			trans	-157.4	141.4	165	51.4	0	0	0	0	110.6
15	D	28.5	Very low	32.7	Very low	165 Å²	165	131.4 Å²	131.4	88%	0.882	83%	0.827	S	S	*	*			trans	-88.2	162.7	-168.1	-58.7	-85.2	0	0	0	115
16	I	34.4	Very low	33.7	Very low	163 Å²	163	132 Å²	132	84%	0.836	82%	0.822	S	S	*	*			trans	-132.6	135.1	168.4	-62.7	-177.2	0	0	0	107.8
17	P	39.5	Very low	33.7	Very low	130 Å²	130	136.4 Å²	136.4	84%	0.844	83%	0.828	S	S	*	*			trans	-83.5	165.4	-162.3	33.2	-38	0	0	0	115.3
18	G	28.7	Very low	33.6	Very low	80 Å²	80	134.9 Å²	134.9	83%	0.825	83%	0.829	S	S	*	*			trans	-122.1	166.3	-177.3	0	0	0	0	0	116
19	S	30.1	Very low	33.5	Very low	118 Å²	118	132 Å²	132	83%	0.825	83%	0.827	S	S	*	*			trans	-174.7	145	178	-178	0	0	0	0	108.6
20	V	29.7	Very low	33.1	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	83%	0.832	S	S	*	*			cis	-151.4	168.9	-11.8	123.1	0	0	0	0	107.3
21	T	29.3	Very low	32.5	Very low	120 Å²	120	130.6 Å²	130.6	74%	0.736	83%	0.829	S	S	*	*			trans	-122.5	157.1	-169.8	53.3	0	0	0	0	117
22	L	30.6	Very low	32.5	Very low	159 Å²	159	131.1 Å²	131.1	83%	0.832	83%	0.831	S	S	*	*			trans	85.1	161.1	161.6	-49.8	-172.8	0	0	0	118.3
23	P	48.2	Very low	32.5	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	83%	0.826	S	S	*	*				-139.1	178.8	-54.7	40.7	-26.1	0	0	0	113.2
24	V	28.1	Very low	32.4	Very low	148 Å²	148	135 Å²	135	90%	0.897	83%	0.828	S	S	*	*			trans	176.8	162.9	143.8	143.2	0	0	0	0	110.2
25	A	32.9	Very low	32.4	Very low	86 Å²	86	137.7 Å²	137.7	71%	0.711	83%	0.83	S	S	*	*			trans	-116.6	-142	-166.1	0	0	0	0	0	115.1
26	P	51.5	Low	32.5	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	83%	0.828	S	S	*	*				-125.9	166.7	-107.5	39.5	-23.6	0	0	0	116.2
27	M	30.8	Very low	32.2	Very low	195 Å²	195	130.3 Å²	130.3	96%	0.961	82%	0.823	S	S	*	*			trans	-144.1	158.9	160.4	-85.4	-60.2	157.7	0	0	111.7
28	A	29.8	Very low	31.7	Very low	102 Å²	102	129 Å²	129	84%	0.843	82%	0.823	S	S	*	*			trans	-137.4	154.2	-170.4	0	0	0	0	0	113.5
29	A	29.6	Very low	32	Very low	95 Å²	95	133.8 Å²	133.8	79%	0.785	83%	0.826	S	S	*	*			trans	-155.5	143.1	161.7	0	0	0	0	0	113
30	T	30.9	Very low	32.8	Very low	143 Å²	143	134.5 Å²	134.5	88%	0.877	83%	0.828	S	S	*	*			trans	-15.8	144.4	160.8	54.8	0	0	0	0	118.9
31	G	28.5	Very low	33.2	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	83%	0.829	S	S	*	*			cis	117.2	121.6	-2.1	0	0	0	0	0	114.8
32	Q	30.4	Very low	33.3	Very low	203 Å²	203	139.5 Å²	139.5	95%	0.949	84%	0.841	S	S	*	*			trans	-162.2	146.1	160.1	-115.9	-180	18.3	0	0	111.9
33	V	30.6	Very low	33.3	Very low	138 Å²	138	135.5 Å²	135.5	84%	0.836	84%	0.838	S	S	*	*			trans	-142.2	134.5	179.7	174.5	0	0	0	0	110.1
34	R	27.9	Very low	32.4	Very low	241 Å²	241	134.2 Å²	134.2	91%	0.909	84%	0.844	S	S	*	*			trans	-174.1	149.3	160.8	-102.1	164.6	-175.6	-170.2	0.7	107.9
35	M	30.3	Very low	32.7	Very low	173 Å²	173	137 Å²	137	85%	0.852	85%	0.845	S	S	*	*			cis	-179.7	155	-31.4	-117.4	-64.1	-167.4	0	0	105.8
36	A	31.3	Very low	33.1	Very low	101 Å²	101	144.6 Å²	144.6	84%	0.835	86%	0.855	S	S	*	*			trans	-55.3	157.6	-165.6	0	0	0	0	0	119.7
37	G	27.2	Very low	32.3	Very low	71 Å²	71	151.2 Å²	151.2	73%	0.732	87%	0.865	S	S	*	*			trans	-161.7	100.4	154.2	0	0	0	0	0	108.7
38	A	29.3	Very low	32.8	Very low	102 Å²	102	148 Å²	148	84%	0.843	86%	0.862	S	S	*	*				86.1	110	79.7	0	0	0	0	0	113.2
39	M	35.8	Very low	33	Very low	181 Å²	181	146.2 Å²	146.2	89%	0.892	85%	0.853	S	S	*	*			trans	-81.4	164.3	173.9	-67.9	-77.8	-171.6	0	0	111.5
40	P	46.2	Very low	33.4	Very low	133 Å²	133	149.6 Å²	149.6	86%	0.864	86%	0.855	S	S	*	*				-137.7	161.7	116.2	38	-28.5	0	0	0	114.3
41	A	38.3	Very low	34	Very low	101 Å²	101	150.3 Å²	150.3	84%	0.835	85%	0.853	S	S	*	*			trans	-115.1	152.1	-173.2	0	0	0	0	0	114.2
42	R	31.3	Very low	34.5	Very low	259 Å²	259	156.2 Å²	156.2	98%	0.977	86%	0.858	S	S	*	*			trans	-164.4	136.6	169.5	-137.1	176.2	-176.9	-178.2	0.7	108.9
43	G	29.5	Very low	35.4	Very low	75 Å²	75	153.4 Å²	153.4	77%	0.773	85%	0.85	S	S	*	*			cis	167.1	121.7	-11.2	0	0	0	0	0	112.1
44	G	31.2	Very low	36	Very low	84 Å²	84	154 Å²	154	87%	0.866	85%	0.848	S	S	*	*			trans	84.7	162.6	177.1	0	0	0	0	0	115.2
45	K	33.5	Very low	36.9	Very low	207 Å²	207	150.8 Å²	150.8	90%	0.9	84%	0.843	S	S	*	*			cis	-152.4	130.1	-2.6	-171.5	168.5	-177	172.5	0	109.9
46	R	40.5	Very low	37.9	Very low	246 Å²	246	150.2 Å²	150.2	93%	0.928	84%	0.844	S	S	*	*			trans	-67	146.6	172.3	-72.3	-176.6	174.8	-174.2	-3	110.5
47	R	36.4	Very low	38.5	Very low	251 Å²	251	149 Å²	149	95%	0.947	84%	0.841	S	S	*	*			trans	-121.8	133.1	153.2	-125.4	-178.1	-178.4	-173.3	-0.8	107.3
48	S	40.8	Very low	39.6	Very low	129 Å²	129	153 Å²	153	90%	0.902	84%	0.841	S	S	*	*			trans	-88.9	158.4	171	-165.4	0	0	0	0	109.5
49	G	33	Very low	40.5	Very low	63 Å²	63	149.6 Å²	149.6	65%	0.649	82%	0.815	S	S	*	*			trans	176.2	81.1	178.8	0	0	0	0	0	113.8
50	M	38.3	Very low	41.4	Very low	167 Å²	167	146.1 Å²	146.1	82%	0.823	81%	0.806	S	S	*	*			trans	48.7	127.7	164.3	-77.4	74.5	172.4	0	0	119.7
51	D	43.5	Very low	41.9	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	79%	0.792	S	S	*	*			trans	-62.9	140.4	150.5	-46.2	-87.8	0	0	0	110.5
52	F	40.2	Very low	42.7	Very low	198 Å²	198	146.2 Å²	146.2	87%	0.868	79%	0.785	S	S	*	*			trans	-148.1	105.7	156.3	-104.9	-83.5	0	0	0	106
53	D	47.9	Very low	43.7	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	76%	0.763	S	S	*	*			trans	-68.1	126.6	151.3	-76.2	-63.3	0	0	0	107
54	D	44.4	Very low	44.9	Very low	150 Å²	150	140.2 Å²	140.2	80%	0.802	76%	0.756	S	S	*	*				180	141.3	121.4	-90.8	-33.2	0	0	0	111.7
55	E	46.8	Very low	46.3	Very low	173 Å²	173	145.7 Å²	145.7	81%	0.808	75%	0.75	S	S	*	*			trans	45.8	127.5	159.2	-60.3	-173.6	116.2	0	0	123
56	D	50.4	Low	47.6	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	73%	0.734	S	S	*	*			trans	50.7	93.8	141.6	-69.5	2.3	0	0	0	120.9
57	G	43.1	Very low	49.1	Very low	75 Å²	75	134.6 Å²	134.6	77%	0.773	72%	0.715	S	S	*	*			trans	-144.1	36.6	175.3	0	0	0	0	0	115.4	G59	G57-G59 PolarHBondContact O-N 2.76Å
58	E	52.3	Low	51.1	Low	155 Å²	155	128.8 Å²	128.8	72%	0.724	70%	0.698	S	S	*	*			trans	-68.8	66.5	172.9	-80.7	-111.9	107.9	0	0	112.1	F63	E58-F63 WeakPolarHBondContact OE2-CE2 3.05Å
59	G	46.3	Very low	53.1	Low	30 Å²	30	125.2 Å²	125.2	31%	0.309	67%	0.673	S	S	.	*			trans	-63.1	131.8	179	0	0	0	0	0	112.1	G57 S61 K62	G57-G59 PolarHBondContact O-N 2.76Å; G59-S61 PolarHBondContact O-N 2.81Å; G59-K62 PolarHBondContact O-N 3.49Å
60	P	56.5	Low	55.6	Low	108 Å²	108	125.3 Å²	125.3	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-7.4	-173.8	24.6	-34.9	0	0	0	114.5	K62 S64	P60-K62 VanDerWaalsContact C-N 3.34Å; P60-K62 PolarHBondContact O-N 3.31Å; P60-S64 WeakPolarHBondContact O-CB 3.34Å; P60-S64 PolarHBondContact O-N 2.88Å
61	S	55.9	Low	57.8	Low	81 Å²	81	122 Å²	122	57%	0.566	64%	0.642	S	S	*	*	H	α-helix	trans	-67.7	-25.5	176.4	62.6	0	0	0	0	114.1	G59 R65	G59-S61 PolarHBondContact O-N 2.81Å; S61-R65 WeakPolarHBondContact O-CB 3.29Å; S61-R65 WeakPolarHBondContact O-CD 3.36Å; S61-R65 WeakPolarHBondContact O-CG 3.31Å; S61-R65 PolarHBondContact O-N 3.2Å
62	K	54.2	Low	60.1	Low	155 Å²	155	116.2 Å²	116.2	67%	0.674	61%	0.61	S	S	*	*	H	α-helix	trans	-72.8	-61.1	172.4	-76.9	-177.8	-178.7	171.4	0	110.8	G59 P60 S64 R65 E66	G59-K62 PolarHBondContact O-N 3.49Å; P60-K62 VanDerWaalsContact C-N 3.34Å; P60-K62 PolarHBondContact O-N 3.31Å; K62-S64 VanDerWaalsContact C-N 3.29Å; K62-S64 PolarHBondContact O-N 3.43Å; K62-R65 CarbonylContact O-C 3.59Å; K62-R65 PolarHBondContact O-N 3.06Å; K62-E66 PolarHBondContact O-N 3.27Å
63	F	52.6	Low	62.5	Low	122 Å²	122	112.4 Å²	112.4	54%	0.535	59%	0.59	S	S	.	*	H	α-helix	trans	-56.1	-38.5	179.7	-79.1	-81.3	0	0	0	113.6	E58 E66 N67	E58-F63 WeakPolarHBondContact OE2-CE2 3.05Å; F63-E66 WeakPolarHBondContact O-CB 3.47Å; F63-E66 PolarHBondContact O-N 2.68Å; F63-N67 WeakPolarHBondContact O-CB 3.34Å; F63-N67 PolarHBondContact O-N 2.87Å
64	S	55.6	Low	64.6	Low	87 Å²	87	113 Å²	113	61%	0.608	58%	0.581	S	S	*	*	H	α-helix	trans	-65.7	-40.2	176.1	-172	0	0	0	0	112.5	P60 K62 H68	P60-S64 WeakPolarHBondContact O-CB 3.34Å; P60-S64 PolarHBondContact O-N 2.88Å; K62-S64 VanDerWaalsContact C-N 3.29Å; K62-S64 PolarHBondContact O-N 3.43Å; S64-H68 WeakPolarHBondContact O-CB 3.41Å; S64-H68 PolarHBondContact O-N 3.1Å; S64-H68 VanDerWaalsContact O-N 3.15Å
65	R	59.9	Low	66.9	Low	199 Å²	199	112.9 Å²	112.9	75%	0.751	57%	0.569	S	S	*	*	H	α-helix	trans	-70.4	-34.5	173.6	-72.9	176.1	72.8	173.6	3.6	112.5	S61 K62 S69	S61-R65 WeakPolarHBondContact O-CB 3.29Å; S61-R65 WeakPolarHBondContact O-CD 3.36Å; S61-R65 WeakPolarHBondContact O-CG 3.31Å; S61-R65 PolarHBondContact O-N 3.2Å; K62-R65 CarbonylContact O-C 3.59Å; K62-R65 PolarHBondContact O-N 3.06Å; R65-S69 WeakPolarHBondContact O-CB 3.19Å; R65-S69 PolarHBondContact O-N 3.05Å
66	E	60.3	Low	69.1	Low	119 Å²	119	110.7 Å²	110.7	56%	0.556	55%	0.554	S	S	*	*	H	α-helix	trans	-62.7	-51.2	175.4	-170.4	98.7	-117.8	0	0	110.8	K62 F63 H68 S69 E70	K62-E66 PolarHBondContact O-N 3.27Å; F63-E66 WeakPolarHBondContact O-CB 3.47Å; F63-E66 PolarHBondContact O-N 2.68Å; E66-H68 PolarHBondContact O-N 3.21Å; E66-S69 CarbonylContact O-C 3.59Å; E66-S69 WeakPolarHBondContact O-CB 3.34Å; E66-S69 PolarHBondContact O-N 2.89Å; E66-S69 VanDerWaalsContact O-N 3.14Å; E66-E70 PolarHBondContact O-N 3.5Å
67	N	73.6	Confident	71.1	Confident	101 Å²	101	108 Å²	108	54%	0.54	54%	0.539	S	S	.	.	H	α-helix	trans	-60.3	-44.8	178.3	-168.8	-84.4	0	0	0	111.6	F63 S69 E70 I71	F63-N67 WeakPolarHBondContact O-CB 3.34Å; F63-N67 PolarHBondContact O-N 2.87Å; N67-S69 PolarHBondContact O-N 2.71Å; N67-E70 PolarHBondContact O-N 3.21Å; N67-I71 WeakPolarHBondContact O-CG1 3.36Å; N67-I71 PolarHBondContact O-N 2.91Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.35Å
68	H	76.9	Confident	73.6	Confident	128 Å²	128	110 Å²	110	59%	0.593	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-41.2	174.1	-174	75.8	0	0	0	112.7	S64 E66 E70 I71 E72	S64-H68 WeakPolarHBondContact O-CB 3.41Å; S64-H68 PolarHBondContact O-N 3.1Å; S64-H68 VanDerWaalsContact O-N 3.15Å; E66-H68 PolarHBondContact O-N 3.21Å; H68-E70 VanDerWaalsContact C-N 3.3Å; H68-E70 PolarHBondContact O-N 3.01Å; H68-I71 PolarHBondContact O-N 3.39Å; H68-E72 VanDerWaalsContact O-CB 3.25Å; H68-E72 WeakPolarHBondContact O-CB 3.33Å; H68-E72 PolarHBondContact O-N 2.96Å
69	S	83.6	Confident	75.5	Confident	54 Å²	54	107.2 Å²	107.2	38%	0.378	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-36.7	174.9	-174.3	0	0	0	0	111.9	R65 E66 N67 R73	R65-S69 WeakPolarHBondContact O-CB 3.19Å; R65-S69 PolarHBondContact O-N 3.05Å; E66-S69 CarbonylContact O-C 3.59Å; E66-S69 WeakPolarHBondContact O-CB 3.34Å; E66-S69 PolarHBondContact O-N 2.89Å; E66-S69 VanDerWaalsContact O-N 3.14Å; N67-S69 PolarHBondContact O-N 2.71Å; S69-R73 VanDerWaalsContact O-CB 3.31Å; S69-R73 WeakPolarHBondContact O-CB 3.32Å; S69-R73 PolarHBondContact O-N 2.75Å
70	E	85.2	Confident	77.8	Confident	65 Å²	65	108.2 Å²	108.2	30%	0.304	52%	0.515	S	S	.	.	H	α-helix	trans	-73.8	-41.4	177	-141.6	-138.9	136.9	0	0	112.6	E66 N67 H68 E72 R73 R74	E66-E70 PolarHBondContact O-N 3.5Å; N67-E70 PolarHBondContact O-N 3.21Å; H68-E70 VanDerWaalsContact C-N 3.3Å; H68-E70 PolarHBondContact O-N 3.01Å; E70-E72 VanDerWaalsContact C-N 3.3Å; E70-E72 PolarHBondContact O-N 3.39Å; E70-R73 WeakPolarHBondContact O-CB 3.29Å; E70-R73 PolarHBondContact O-N 3.13Å; E70-R74 VanDerWaalsContact O-CG 3.31Å; E70-R74 WeakPolarHBondContact O-CG 3.46Å; E70-R74 PolarHBondContact O-N 3Å; E70-R74 IonicContact OE1-CZ 2.82Å; E70-R74 IonicContact OE1-NE 3.48Å; E70-R74 PolarHBondContact OE1-NE 3.01Å; E70-R74 IonicContact OE1-NH2 3.19Å; E70-R74 PolarHBondContact OE1-NH2 2.78Å; E70-R74 IonicContact OE2-CZ 3.47Å; E70-R74 IonicContact OE2-NE 3.35Å; E70-R74 IonicContact OE2-NH2 2.74Å; E70-R74 PolarHBondContact OE2-NH2 2.92Å
71	I	85	Confident	79.5	Confident	98 Å²	98	108.1 Å²	108.1	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-58.4	-45.4	172.3	-70	166.1	0	0	0	110.2	N67 H68 R74 R75	N67-I71 WeakPolarHBondContact O-CG1 3.36Å; N67-I71 PolarHBondContact O-N 2.91Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.35Å; H68-I71 PolarHBondContact O-N 3.39Å; I71-R74 PolarHBondContact O-N 3.04Å; I71-R75 PolarHBondContact O-N 2.75Å
72	E	91.6	Very high	81.4	Confident	35 Å²	35	110.2 Å²	110.2	16%	0.164	50%	0.501	C	S	.	.	H	α-helix	trans	-62.7	-42	175	171.9	63.7	-147.3	0	0	111.8	H68 E70 R75 R76	H68-E72 VanDerWaalsContact O-CB 3.25Å; H68-E72 WeakPolarHBondContact O-CB 3.33Å; H68-E72 PolarHBondContact O-N 2.96Å; E70-E72 VanDerWaalsContact C-N 3.3Å; E70-E72 PolarHBondContact O-N 3.39Å; E72-R75 PolarHBondContact O-N 3.18Å; E72-R75 IonicContact OE1-CZ 2.82Å; E72-R75 IonicContact OE1-NH2 3.49Å; E72-R75 PolarHBondContact OE1-NH2 3.29Å; E72-R75 IonicContact OE2-CZ 2.64Å; E72-R75 IonicContact OE2-NH1 2.75Å; E72-R75 PolarHBondContact OE2-NH1 3.1Å; E72-R75 IonicContact OE2-NH2 2.72Å; E72-R75 PolarHBondContact OE2-NH2 3.15Å; E72-R76 VanDerWaalsContact CG-CZ 3.48Å; E72-R76 WeakPolarHBondContact O-CG 3.32Å; E72-R76 PolarHBondContact O-N 2.97Å; E72-R76 IonicContact OE1-CZ 3.19Å; E72-R76 IonicContact OE1-NE 3.52Å; E72-R76 PolarHBondContact OE1-NE 2.64Å; E72-R76 IonicContact OE1-NH2 2.75Å; E72-R76 PolarHBondContact OE1-NH2 3.08Å
73	R	90.6	Very high	83.3	Confident	119 Å²	119	103.8 Å²	103.8	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-59.3	-48.2	173	-172.2	-169	-62.2	146.8	-0.3	111.3	S69 E70 R75 R76 N77	S69-R73 VanDerWaalsContact O-CB 3.31Å; S69-R73 WeakPolarHBondContact O-CB 3.32Å; S69-R73 PolarHBondContact O-N 2.75Å; E70-R73 WeakPolarHBondContact O-CB 3.29Å; E70-R73 PolarHBondContact O-N 3.13Å; R73-R75 VanDerWaalsContact C-N 3.34Å; R73-R75 PolarHBondContact O-N 3.08Å; R73-R76 PolarHBondContact O-N 3.32Å; R73-N77 PolarHBondContact O-N 3.43Å; R73-N77 PolarHBondContact O-OD1 2.78Å
74	R	91	Very high	85.1	Confident	156 Å²	156	100.6 Å²	100.6	59%	0.589	46%	0.464	S	S	*	.	H	α-helix	trans	-59.9	-41.3	175.8	-68.5	174.2	-171.7	-166.4	8.3	111.2	E70 I71 N77 K78	E70-R74 VanDerWaalsContact O-CG 3.31Å; E70-R74 WeakPolarHBondContact O-CG 3.46Å; E70-R74 PolarHBondContact O-N 3Å; E70-R74 IonicContact OE1-CZ 2.82Å; E70-R74 IonicContact OE1-NE 3.48Å; E70-R74 PolarHBondContact OE1-NE 3.01Å; E70-R74 IonicContact OE1-NH2 3.19Å; E70-R74 PolarHBondContact OE1-NH2 2.78Å; E70-R74 IonicContact OE2-CZ 3.47Å; E70-R74 IonicContact OE2-NE 3.35Å; E70-R74 IonicContact OE2-NH2 2.74Å; E70-R74 PolarHBondContact OE2-NH2 2.92Å; I71-R74 PolarHBondContact O-N 3.04Å; R74-N77 PolarHBondContact O-N 3.45Å; R74-K78 WeakPolarHBondContact O-CB 3.48Å; R74-K78 PolarHBondContact O-N 3.21Å
75	R	92.6	Very high	87	Confident	149 Å²	149	100.5 Å²	100.5	56%	0.562	46%	0.455	S	S	*	.	H	α-helix	trans	-62.4	-45	174.2	-162.2	-172.1	78.2	-127.1	-12.9	112.2	I71 E72 R73 N77 K78 M79	I71-R75 PolarHBondContact O-N 2.75Å; E72-R75 PolarHBondContact O-N 3.18Å; E72-R75 IonicContact OE1-CZ 2.82Å; E72-R75 IonicContact OE1-NH2 3.49Å; E72-R75 PolarHBondContact OE1-NH2 3.29Å; E72-R75 IonicContact OE2-CZ 2.64Å; E72-R75 IonicContact OE2-NH1 2.75Å; E72-R75 PolarHBondContact OE2-NH1 3.1Å; E72-R75 IonicContact OE2-NH2 2.72Å; E72-R75 PolarHBondContact OE2-NH2 3.15Å; R73-R75 VanDerWaalsContact C-N 3.34Å; R73-R75 PolarHBondContact O-N 3.08Å; R75-N77 PolarHBondContact O-N 3.28Å; R75-K78 PolarHBondContact O-N 3.37Å; R75-M79 VanDerWaalsContact O-CB 3.29Å; R75-M79 WeakPolarHBondContact O-CB 3.45Å; R75-M79 PolarHBondContact O-N 2.72Å
76	R	92.9	Very high	88.5	Confident	127 Å²	127	93.8 Å²	93.8	48%	0.479	43%	0.433	S	S	.	.	H	α-helix	trans	-63.1	-39.5	177.2	-69.4	170.8	-165.5	165.2	3.1	112.4	E72 R73 T80	E72-R76 VanDerWaalsContact CG-CZ 3.48Å; E72-R76 WeakPolarHBondContact O-CG 3.32Å; E72-R76 PolarHBondContact O-N 2.97Å; E72-R76 IonicContact OE1-CZ 3.19Å; E72-R76 IonicContact OE1-NE 3.52Å; E72-R76 PolarHBondContact OE1-NE 2.64Å; E72-R76 IonicContact OE1-NH2 2.75Å; E72-R76 PolarHBondContact OE1-NH2 3.08Å; R73-R76 PolarHBondContact O-N 3.32Å; R76-T80 WeakPolarHBondContact O-CB 3.32Å; R76-T80 PolarHBondContact O-N 3.02Å; R76-T80 PolarHBondContact O-OG1 3.17Å
77	N	93.9	Very high	90	Very high	104 Å²	104	88.2 Å²	88.2	56%	0.556	41%	0.407	S	S	*	.	H	α-helix	trans	-65.5	-50.6	177.7	-70	7.1	0	0	0	110.3	R73 R74 R75 M79 T80 Q81	R73-N77 PolarHBondContact O-N 3.43Å; R73-N77 PolarHBondContact O-OD1 2.78Å; R74-N77 PolarHBondContact O-N 3.45Å; R75-N77 PolarHBondContact O-N 3.28Å; N77-M79 VanDerWaalsContact C-N 3.34Å; N77-M79 PolarHBondContact O-N 2.73Å; N77-T80 WeakPolarHBondContact O-CA 3.41Å; N77-T80 WeakPolarHBondContact O-CB 3.28Å; N77-T80 PolarHBondContact O-N 2.95Å; N77-Q81 PolarHBondContact O-N 3.4Å
78	K	94.1	Very high	90.8	Very high	118 Å²	118	87.2 Å²	87.2	51%	0.513	40%	0.402	S	S	.	.	H	α-helix	trans	-60.2	-39.4	176.3	-172.5	167	-178.3	172.3	0	113	R74 R75 T80 Q81 Y82	R74-K78 WeakPolarHBondContact O-CB 3.48Å; R74-K78 PolarHBondContact O-N 3.21Å; R75-K78 PolarHBondContact O-N 3.37Å; K78-T80 VanDerWaalsContact C-N 3.31Å; K78-T80 PolarHBondContact O-N 3.32Å; K78-Q81 PolarHBondContact O-N 2.82Å; K78-Y82 HydrophobicContact CD-CE2 4.22Å; K78-Y82 VanDerWaalsContact CE-CZ 3.46Å; K78-Y82 WeakPolarHBondContact CE-OH 3.22Å; K78-Y82 HydrophobicContact CG-CD2 4.19Å; K78-Y82 HydrophobicContact CG-CE2 3.74Å; K78-Y82 WeakPolarHBondContact O-CD2 3.35Å; K78-Y82 PolarHBondContact O-N 3.47Å
79	M	93.2	Very high	91.3	Very high	97 Å²	97	88.4 Å²	88.4	48%	0.478	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-34.4	172.2	-174.4	-177.3	75.5	0	0	112.3	R75 N77 I83	R75-M79 VanDerWaalsContact O-CB 3.29Å; R75-M79 WeakPolarHBondContact O-CB 3.45Å; R75-M79 PolarHBondContact O-N 2.72Å; N77-M79 VanDerWaalsContact C-N 3.34Å; N77-M79 PolarHBondContact O-N 2.73Å; M79-I83 WeakPolarHBondContact O-CG1 3.5Å; M79-I83 PolarHBondContact O-N 3.24Å
80	T	93.9	Very high	91.5	Very high	50 Å²	50	86.1 Å²	86.1	31%	0.307	39%	0.394	S	S	.	.	H	α-helix	trans	-71.8	-38.5	177.8	-56.8	0	0	0	0	111.7	R76 N77 K78 T84 K102	R76-T80 WeakPolarHBondContact O-CB 3.32Å; R76-T80 PolarHBondContact O-N 3.02Å; R76-T80 PolarHBondContact O-OG1 3.17Å; N77-T80 WeakPolarHBondContact O-CA 3.41Å; N77-T80 WeakPolarHBondContact O-CB 3.28Å; N77-T80 PolarHBondContact O-N 2.95Å; K78-T80 VanDerWaalsContact C-N 3.31Å; K78-T80 PolarHBondContact O-N 3.32Å; T80-T84 PolarHBondContact O-N 2.98Å; T80-T84 VanDerWaalsContact O-N 3.1Å; T80-T84 PolarHBondContact O-OG1 3.43Å; T80-K102 PolarHBondContact OG1-NZ 3.36Å
81	Q	93.8	Very high	91.3	Very high	106 Å²	106	86.6 Å²	86.6	50%	0.495	40%	0.402	S	S	.	.	H	α-helix	trans	-57.5	-56	169.3	175.9	177.3	-0.8	0	0	110.9	N77 K78 I83 T84 E85	N77-Q81 PolarHBondContact O-N 3.4Å; K78-Q81 PolarHBondContact O-N 2.82Å; Q81-I83 VanDerWaalsContact C-N 3.3Å; Q81-I83 PolarHBondContact O-N 2.84Å; Q81-T84 WeakPolarHBondContact O-CA 3.5Å; Q81-T84 WeakPolarHBondContact O-CB 3.49Å; Q81-T84 PolarHBondContact O-N 3.08Å; Q81-E85 HydrophobicContact CG-CG 4.42Å; Q81-E85 WeakPolarHBondContact CG-OE1 3.36Å; Q81-E85 PolarHBondContact NE2-OE1 3.23Å; Q81-E85 PolarHBondContact O-N 2.99Å
82	Y	95.4	Very high	91.2	Very high	126 Å²	126	85.5 Å²	85.5	49%	0.494	40%	0.4	S	S	.	.	H	α-helix	trans	-59.3	-35.2	-179.4	-69.8	-37.5	0	0	0	114.1	K78 T84 E85 L86	K78-Y82 HydrophobicContact CD-CE2 4.22Å; K78-Y82 VanDerWaalsContact CE-CZ 3.46Å; K78-Y82 WeakPolarHBondContact CE-OH 3.22Å; K78-Y82 HydrophobicContact CG-CD2 4.19Å; K78-Y82 HydrophobicContact CG-CE2 3.74Å; K78-Y82 WeakPolarHBondContact O-CD2 3.35Å; K78-Y82 PolarHBondContact O-N 3.47Å; Y82-T84 VanDerWaalsContact C-N 3.3Å; Y82-E85 WeakPolarHBondContact CD1-OE2 3.37Å; Y82-L86 WeakPolarHBondContact O-CB 3.41Å; Y82-L86 PolarHBondContact O-N 3.2Å
83	I	94	Very high	90.8	Very high	19 Å²	19	84 Å²	84	10%	0.097	39%	0.393	C	S	.	.	H	α-helix	trans	-70.5	-27.4	174.2	-67.1	-71.9	0	0	0	111.9	M79 Q81 S87 K102 I105 L106	M79-I83 WeakPolarHBondContact O-CG1 3.5Å; M79-I83 PolarHBondContact O-N 3.24Å; Q81-I83 VanDerWaalsContact C-N 3.3Å; Q81-I83 PolarHBondContact O-N 2.84Å; I83-S87 WeakPolarHBondContact O-CB 3.47Å; I83-S87 PolarHBondContact O-N 3.29Å; I83-K102 HydrophobicContact CG2-CB 4.03Å; I83-K102 HydrophobicContact CG2-CD 4.37Å; I83-K102 HydrophobicContact CG2-CG 3.85Å; I83-I105 HydrophobicContact CG2-CB 4.36Å; I83-I105 HydrophobicContact CG2-CD1 3.72Å; I83-I105 HydrophobicContact CG2-CG2 4.22Å; I83-L106 HydrophobicContact CD1-CD1 3.98Å; I83-L106 HydrophobicContact CD1-CD2 3.67Å; I83-L106 HydrophobicContact CD1-CG 3.74Å
84	T	90.6	Very high	90.6	Very high	55 Å²	55	81.2 Å²	81.2	34%	0.337	39%	0.392	S	S	.	.	H	α-helix	trans	-75.9	-49.8	176.3	-52.1	0	0	0	0	110.4	T80 Q81 Y82 L86 S87 D88	T80-T84 PolarHBondContact O-N 2.98Å; T80-T84 VanDerWaalsContact O-N 3.1Å; T80-T84 PolarHBondContact O-OG1 3.43Å; Q81-T84 WeakPolarHBondContact O-CA 3.5Å; Q81-T84 WeakPolarHBondContact O-CB 3.49Å; Q81-T84 PolarHBondContact O-N 3.08Å; Y82-T84 VanDerWaalsContact C-N 3.3Å; T84-L86 VanDerWaalsContact C-N 3.28Å; T84-L86 PolarHBondContact O-N 2.83Å; T84-S87 WeakPolarHBondContact O-CA 3.19Å; T84-S87 VanDerWaalsContact O-CB 3.31Å; T84-S87 WeakPolarHBondContact O-CB 3.38Å; T84-S87 PolarHBondContact O-N 2.93Å; T84-D88 VanDerWaalsContact O-CG 3.27Å; T84-D88 PolarHBondContact O-N 3.45Å
85	E	94.2	Very high	90.1	Very high	86 Å²	86	77.9 Å²	77.9	40%	0.402	40%	0.398	S	S	.	.	H	α-helix	trans	-55.6	-42.5	172.8	-67.2	166.3	-177.1	0	0	111.3	Q81 Y82 S87 D88 M89	Q81-E85 HydrophobicContact CG-CG 4.42Å; Q81-E85 WeakPolarHBondContact CG-OE1 3.36Å; Q81-E85 PolarHBondContact NE2-OE1 3.23Å; Q81-E85 PolarHBondContact O-N 2.99Å; Y82-E85 WeakPolarHBondContact CD1-OE2 3.37Å; E85-S87 PolarHBondContact O-N 2.92Å; E85-D88 PolarHBondContact O-N 2.94Å; E85-M89 WeakPolarHBondContact O-CB 3.38Å; E85-M89 VanDerWaalsContact O-CG 3.26Å; E85-M89 WeakPolarHBondContact O-CG 3.37Å; E85-M89 PolarHBondContact O-N 3.26Å
86	L	92.9	Very high	89.7	Confident	58 Å²	58	74.9 Å²	74.9	30%	0.304	39%	0.393	S	S	.	.	H	α-helix	trans	-65.3	-34.3	174.1	-177.8	63.5	0	0	0	113.3	Y82 T84 D88 V90 I105 L106 A109	Y82-L86 WeakPolarHBondContact O-CB 3.41Å; Y82-L86 PolarHBondContact O-N 3.2Å; T84-L86 VanDerWaalsContact C-N 3.28Å; T84-L86 PolarHBondContact O-N 2.83Å; L86-D88 VanDerWaalsContact C-N 3.32Å; L86-V90 HydrophobicContact CD1-CG2 4.01Å; L86-V90 HydrophobicContact CG-CG2 4.49Å; L86-V90 WeakPolarHBondContact O-CB 3.41Å; L86-V90 VanDerWaalsContact O-CG2 3.24Å; L86-V90 WeakPolarHBondContact O-CG2 3.42Å; L86-V90 PolarHBondContact O-N 3.14Å; L86-I105 HydrophobicContact CD2-CG2 4.42Å; L86-I105 HydrophobicContact CG-CG2 4.34Å; L86-L106 HydrophobicContact CD2-CD2 3.98Å; L86-A109 HydrophobicContact CD1-CB 4.03Å; L86-A109 HydrophobicContact CD2-CB 3.95Å; L86-A109 HydrophobicContact CG-CB 4.07Å
87	S	92.3	Very high	88.9	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.014	42%	0.415	C	S	.	.	H	α-helix	trans	-67.5	-36.4	174.7	-171.7	0	0	0	0	111.7	I83 T84 E85 C93 S94	I83-S87 WeakPolarHBondContact O-CB 3.47Å; I83-S87 PolarHBondContact O-N 3.29Å; T84-S87 WeakPolarHBondContact O-CA 3.19Å; T84-S87 VanDerWaalsContact O-CB 3.31Å; T84-S87 WeakPolarHBondContact O-CB 3.38Å; T84-S87 PolarHBondContact O-N 2.93Å; E85-S87 PolarHBondContact O-N 2.92Å; S87-C93 WeakPolarHBondContact O-CB 3.09Å; S87-S94 PolarHBondContact O-N 3.21Å
88	D	90.2	Very high	88.5	Confident	79 Å²	79	79.9 Å²	79.9	42%	0.422	43%	0.428	S	S	.	.	H	α-helix	trans	-79.8	-31.7	-176.7	-59.3	-21.9	0	0	0	110.4	T84 E85 L86 S94 K99	T84-D88 VanDerWaalsContact O-CG 3.27Å; T84-D88 PolarHBondContact O-N 3.45Å; E85-D88 PolarHBondContact O-N 2.94Å; L86-D88 VanDerWaalsContact C-N 3.32Å; D88-S94 WeakPolarHBondContact O-CB 3.46Å; D88-S94 PolarHBondContact O-OG 3.07Å; D88-K99 VanDerWaalsContact CG-NZ 3.29Å; D88-K99 IonicContact OD1-NZ 3.37Å; D88-K99 PolarHBondContact OD1-NZ 3.15Å; D88-K99 IonicContact OD2-NZ 2.69Å; D88-K99 PolarHBondContact OD2-NZ 3.07Å
89	M	85.5	Confident	87.9	Confident	154 Å²	154	80.5 Å²	80.5	76%	0.759	43%	0.431	S	S	*	.	H	α-helix	trans	-80.1	-10.9	175.4	-71.3	-64.7	-64.3	0	0	116	E85	E85-M89 WeakPolarHBondContact O-CB 3.38Å; E85-M89 VanDerWaalsContact O-CG 3.26Å; E85-M89 WeakPolarHBondContact O-CG 3.37Å; E85-M89 PolarHBondContact O-N 3.26Å
90	V	88.4	Confident	87.7	Confident	6 Å²	6	77.2 Å²	77.2	4%	0.036	42%	0.417	C	S	.	.	S	Bend	trans	-102.3	112.2	178.4	171	0	0	0	0	109.1	L86 T92 C93 S94 A109 H112	L86-V90 HydrophobicContact CD1-CG2 4.01Å; L86-V90 HydrophobicContact CG-CG2 4.49Å; L86-V90 WeakPolarHBondContact O-CB 3.41Å; L86-V90 VanDerWaalsContact O-CG2 3.24Å; L86-V90 WeakPolarHBondContact O-CG2 3.42Å; L86-V90 PolarHBondContact O-N 3.14Å; V90-T92 VanDerWaalsContact C-N 3.25Å; V90-T92 PolarHBondContact O-N 2.66Å; V90-T92 VanDerWaalsContact O-N 3.09Å; V90-C93 HydrophobicContact CB-CB 4.09Å; V90-C93 HydrophobicContact CG1-CB 4.18Å; V90-C93 WeakPolarHBondContact O-CA 3.38Å; V90-C93 WeakPolarHBondContact O-CB 3.39Å; V90-C93 PolarHBondContact O-N 3.11Å; V90-S94 PolarHBondContact O-N 2.63Å; V90-S94 PolarHBondContact O-OG 2.85Å; V90-A109 HydrophobicContact CG2-CB 3.89Å; V90-H112 HydrophobicContact CG1-CB 4.09Å
91	P	82.3	Confident	87.6	Confident	75 Å²	75	79.1 Å²	79.1	49%	0.487	43%	0.425	S	S	.	.	H	α-helix	trans	-56.9	-33.2	-169.9	-28.9	35.6	0	0	0	115.1	C93 A95	P91-C93 VanDerWaalsContact C-N 3.33Å; P91-A95 VanDerWaalsContact O-CB 3.29Å; P91-A95 WeakPolarHBondContact O-CB 3.28Å; P91-A95 PolarHBondContact O-N 2.92Å
92	T	82.8	Confident	87.5	Confident	75 Å²	75	78.4 Å²	78.4	46%	0.46	42%	0.421	S	S	.	.	H	α-helix	trans	-74.1	-23.5	176.8	52.4	0	0	0	0	113.2	V90 M108	V90-T92 VanDerWaalsContact C-N 3.25Å; V90-T92 PolarHBondContact O-N 2.66Å; V90-T92 VanDerWaalsContact O-N 3.09Å; T92-M108 WeakPolarHBondContact O-CE 3.2Å
93	C	83.1	Confident	87.4	Confident	2 Å²	2	76.9 Å²	76.9	1%	0.014	42%	0.42	C	S	.	.	H	α-helix	trans	-84.5	-44.2	174.9	-66.2	0	0	0	0	111.5	S87 V90 P91 L96 M108	S87-C93 WeakPolarHBondContact O-CB 3.09Å; V90-C93 HydrophobicContact CB-CB 4.09Å; V90-C93 HydrophobicContact CG1-CB 4.18Å; V90-C93 WeakPolarHBondContact O-CA 3.38Å; V90-C93 WeakPolarHBondContact O-CB 3.39Å; V90-C93 PolarHBondContact O-N 3.11Å; P91-C93 VanDerWaalsContact C-N 3.33Å; C93-L96 WeakPolarHBondContact O-CB 3.37Å; C93-L96 PolarHBondContact O-N 2.95Å; C93-M108 WeakPolarHBondContact SG-CB 3.38Å
94	S	85.8	Confident	87.3	Confident	62 Å²	62	77.9 Å²	77.9	43%	0.434	43%	0.428	S	S	.	.	H	α-helix	trans	-74.1	-24.8	-175.4	55.4	0	0	0	0	113.7	S87 D88 V90 L96	S87-S94 PolarHBondContact O-N 3.21Å; D88-S94 WeakPolarHBondContact O-CB 3.46Å; D88-S94 PolarHBondContact O-OG 3.07Å; V90-S94 PolarHBondContact O-N 2.63Å; V90-S94 PolarHBondContact O-OG 2.85Å; S94-L96 PolarHBondContact O-N 3.47Å
95	A	80.8	Confident	87.4	Confident	86 Å²	86	75.7 Å²	75.7	71%	0.711	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-4.5	172	0	0	0	0	0	114.6	P91	P91-A95 VanDerWaalsContact O-CB 3.29Å; P91-A95 WeakPolarHBondContact O-CB 3.28Å; P91-A95 PolarHBondContact O-N 2.92Å
96	L	84.3	Confident	87.4	Confident	85 Å²	85	75.3 Å²	75.3	45%	0.445	41%	0.414	S	S	.	.			trans	-89.5	120.2	-179.3	-67.8	171.2	0	0	0	112	C93 S94 R98 P100 M108	C93-L96 WeakPolarHBondContact O-CB 3.37Å; C93-L96 PolarHBondContact O-N 2.95Å; S94-L96 PolarHBondContact O-N 3.47Å; L96-R98 PolarHBondContact O-N 3.08Å; L96-P100 HydrophobicContact CD1-CB 4.37Å; L96-P100 HydrophobicContact CD1-CG 3.94Å; L96-M108 HydrophobicContact CD1-CE 4.02Å
97	A	75.1	Confident	87.4	Confident	115 Å²	115	80.3 Å²	80.3	95%	0.95	43%	0.429	S	S	*	.	S	Bend	trans	-62.9	-2.9	177.8	0	0	0	0	0	115.4
98	R	86	Confident	87.3	Confident	222 Å²	222	82.2 Å²	82.2	84%	0.838	44%	0.438	S	S	*	.	S	Bend	trans	-132	128.7	164.7	-75.9	-176.9	172.4	170	-1.6	108.1	L96 P100	L96-R98 PolarHBondContact O-N 3.08Å; R98-P100 WeakPolarHBondContact O-CD 3.45Å
99	K	81.9	Confident	87.4	Confident	131 Å²	131	78.6 Å²	78.6	57%	0.57	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-58.9	120.8	176.6	-63.5	-146.6	176.6	-146.8	0	109.6	D88	D88-K99 VanDerWaalsContact CG-NZ 3.29Å; D88-K99 IonicContact OD1-NZ 3.37Å; D88-K99 PolarHBondContact OD1-NZ 3.15Å; D88-K99 IonicContact OD2-NZ 2.69Å; D88-K99 PolarHBondContact OD2-NZ 3.07Å
100	P	87.6	Confident	87.6	Confident	27 Å²	27	74.5 Å²	74.5	18%	0.175	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-69.4	167.8	179.8	24.2	-29.2	0	0	0	111.9	L96 R98 T104 I105	L96-P100 HydrophobicContact CD1-CB 4.37Å; L96-P100 HydrophobicContact CD1-CG 3.94Å; R98-P100 WeakPolarHBondContact O-CD 3.45Å; P100-T104 HydrophobicContact CB-CG2 3.85Å; P100-I105 HydrophobicContact CB-CG1 4.43Å; P100-I105 HydrophobicContact CG-CG1 3.78Å; P100-I105 WeakPolarHBondContact O-CD1 3.43Å
101	D	92.6	Very high	87.5	Confident	91 Å²	91	78 Å²	78	49%	0.487	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-68.2	159.6	178.1	75.6	-91.3	0	0	0	112.2	L103 T104 I105	D101-L103 VanDerWaalsContact C-N 3.26Å; D101-L103 PolarHBondContact O-N 3.4Å; D101-L103 WeakPolarHBondContact OD2-CA 3.43Å; D101-L103 VanDerWaalsContact OD2-CB 3.32Å; D101-L103 WeakPolarHBondContact OD2-CB 3.42Å; D101-L103 PolarHBondContact OD2-N 3.14Å; D101-T104 PolarHBondContact O-N 2.87Å; D101-T104 VanDerWaalsContact O-N 3.09Å; D101-T104 WeakPolarHBondContact OD1-CB 3.32Å; D101-T104 PolarHBondContact OD1-OG1 3.35Å; D101-T104 PolarHBondContact OD2-N 2.95Å; D101-I105 WeakPolarHBondContact O-CG1 3.28Å; D101-I105 PolarHBondContact O-N 2.7Å
102	K	91.6	Very high	87.6	Confident	91 Å²	91	77 Å²	77	40%	0.396	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-31.4	-174.7	-60.4	-170.1	173.1	176.6	0	114.2	T80 I83 L106	T80-K102 PolarHBondContact OG1-NZ 3.36Å; I83-K102 HydrophobicContact CG2-CB 4.03Å; I83-K102 HydrophobicContact CG2-CD 4.37Å; I83-K102 HydrophobicContact CG2-CG 3.85Å; K102-L106 WeakPolarHBondContact O-CG 3.36Å; K102-L106 PolarHBondContact O-N 2.87Å
103	L	93.5	Very high	87.6	Confident	93 Å²	93	77 Å²	77	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-78.5	-37.6	178.5	179.3	61.2	0	0	0	110.7	D101 L106 R107	D101-L103 VanDerWaalsContact C-N 3.26Å; D101-L103 PolarHBondContact O-N 3.4Å; D101-L103 WeakPolarHBondContact OD2-CA 3.43Å; D101-L103 VanDerWaalsContact OD2-CB 3.32Å; D101-L103 WeakPolarHBondContact OD2-CB 3.42Å; D101-L103 PolarHBondContact OD2-N 3.14Å; L103-L106 PolarHBondContact O-N 3.15Å; L103-R107 WeakPolarHBondContact O-CB 3.46Å; L103-R107 VanDerWaalsContact O-CG 3.25Å; L103-R107 WeakPolarHBondContact O-CG 3.37Å; L103-R107 PolarHBondContact O-N 2.68Å
104	T	91.8	Very high	87.4	Confident	41 Å²	41	84 Å²	84	25%	0.252	44%	0.442	S	S	.	.	H	α-helix	trans	-65.9	-43.1	173.1	-65.1	0	0	0	0	111.8	P100 D101 L106 R107 M108	P100-T104 HydrophobicContact CB-CG2 3.85Å; D101-T104 PolarHBondContact O-N 2.87Å; D101-T104 VanDerWaalsContact O-N 3.09Å; D101-T104 WeakPolarHBondContact OD1-CB 3.32Å; D101-T104 PolarHBondContact OD1-OG1 3.35Å; D101-T104 PolarHBondContact OD2-N 2.95Å; T104-L106 VanDerWaalsContact C-N 3.32Å; T104-L106 PolarHBondContact O-N 2.81Å; T104-R107 PolarHBondContact O-N 2.8Å; T104-M108 HydrophobicContact CG2-CG 4.27Å; T104-M108 HydrophobicContact CG2-SD 3.52Å; T104-M108 VanDerWaalsContact CG2-SD 3.52Å; T104-M108 WeakPolarHBondContact O-CB 3.38Å; T104-M108 VanDerWaalsContact O-CG 3.32Å; T104-M108 WeakPolarHBondContact O-CG 3.46Å; T104-M108 PolarHBondContact O-N 3.39Å
105	I	93.1	Very high	86.8	Confident	9 Å²	9	85.9 Å²	85.9	5%	0.046	46%	0.455	C	S	.	.	H	α-helix	trans	-53.5	-49.8	171.9	-66.4	162.7	0	0	0	110.5	I83 L86 P100 D101 R107 M108 A109	I83-I105 HydrophobicContact CG2-CB 4.36Å; I83-I105 HydrophobicContact CG2-CD1 3.72Å; I83-I105 HydrophobicContact CG2-CG2 4.22Å; L86-I105 HydrophobicContact CD2-CG2 4.42Å; L86-I105 HydrophobicContact CG-CG2 4.34Å; P100-I105 HydrophobicContact CB-CG1 4.43Å; P100-I105 HydrophobicContact CG-CG1 3.78Å; P100-I105 WeakPolarHBondContact O-CD1 3.43Å; D101-I105 WeakPolarHBondContact O-CG1 3.28Å; D101-I105 PolarHBondContact O-N 2.7Å; I105-R107 PolarHBondContact O-N 3.48Å; I105-M108 PolarHBondContact O-N 2.97Å; I105-A109 VanDerWaalsContact O-CB 3.28Å; I105-A109 WeakPolarHBondContact O-CB 3.45Å; I105-A109 PolarHBondContact O-N 3.22Å
106	L	94.5	Very high	86.1	Confident	78 Å²	78	88 Å²	88	41%	0.408	45%	0.451	S	S	.	.	H	α-helix	trans	-63.9	-40.4	178.8	-73.9	169.6	0	0	0	112.8	I83 L86 K102 L103 T104 V110	I83-L106 HydrophobicContact CD1-CD1 3.98Å; I83-L106 HydrophobicContact CD1-CD2 3.67Å; I83-L106 HydrophobicContact CD1-CG 3.74Å; L86-L106 HydrophobicContact CD2-CD2 3.98Å; K102-L106 WeakPolarHBondContact O-CG 3.36Å; K102-L106 PolarHBondContact O-N 2.87Å; L103-L106 PolarHBondContact O-N 3.15Å; T104-L106 VanDerWaalsContact C-N 3.32Å; T104-L106 PolarHBondContact O-N 2.81Å; L106-V110 WeakPolarHBondContact O-CB 3.43Å; L106-V110 VanDerWaalsContact O-CG2 3.27Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 2.88Å
107	R	92.2	Very high	85.1	Confident	162 Å²	162	91.5 Å²	91.5	61%	0.611	46%	0.459	S	S	*	.	H	α-helix	trans	-63.7	-42.6	176.3	-75.4	166.6	171.9	-179.1	-3.3	111.9	L103 T104 I105 V110 S111	L103-R107 WeakPolarHBondContact O-CB 3.46Å; L103-R107 VanDerWaalsContact O-CG 3.25Å; L103-R107 WeakPolarHBondContact O-CG 3.37Å; L103-R107 PolarHBondContact O-N 2.68Å; T104-R107 PolarHBondContact O-N 2.8Å; I105-R107 PolarHBondContact O-N 3.48Å; R107-V110 PolarHBondContact O-N 3.33Å; R107-S111 WeakPolarHBondContact O-CB 3.35Å; R107-S111 PolarHBondContact O-N 2.83Å
108	M	90.8	Very high	83.8	Confident	43 Å²	43	88.2 Å²	88.2	21%	0.212	44%	0.436	C	S	.	.	H	α-helix	trans	-70.7	-40	178.7	-69.3	171.5	69.3	0	0	111.5	T92 C93 L96 T104 I105 S111 H112	T92-M108 WeakPolarHBondContact O-CE 3.2Å; C93-M108 WeakPolarHBondContact SG-CB 3.38Å; L96-M108 HydrophobicContact CD1-CE 4.02Å; T104-M108 HydrophobicContact CG2-CG 4.27Å; T104-M108 HydrophobicContact CG2-SD 3.52Å; T104-M108 VanDerWaalsContact CG2-SD 3.52Å; T104-M108 WeakPolarHBondContact O-CB 3.38Å; T104-M108 VanDerWaalsContact O-CG 3.32Å; T104-M108 WeakPolarHBondContact O-CG 3.46Å; T104-M108 PolarHBondContact O-N 3.39Å; I105-M108 PolarHBondContact O-N 2.97Å; M108-S111 WeakPolarHBondContact O-CB 3.38Å; M108-S111 PolarHBondContact O-N 2.96Å; M108-H112 WeakPolarHBondContact O-CB 3.36Å; M108-H112 PolarHBondContact O-N 2.87Å
109	A	91.4	Very high	82	Confident	3 Å²	3	84.8 Å²	84.8	3%	0.025	44%	0.44	C	S	.	.	H	α-helix	trans	-60.6	-43.1	170.8	0	0	0	0	0	112.5	L86 V90 I105 H112 M113	L86-A109 HydrophobicContact CD1-CB 4.03Å; L86-A109 HydrophobicContact CD2-CB 3.95Å; L86-A109 HydrophobicContact CG-CB 4.07Å; V90-A109 HydrophobicContact CG2-CB 3.89Å; I105-A109 VanDerWaalsContact O-CB 3.28Å; I105-A109 WeakPolarHBondContact O-CB 3.45Å; I105-A109 PolarHBondContact O-N 3.22Å; A109-H112 PolarHBondContact O-N 2.88Å; A109-M113 WeakPolarHBondContact O-CB 3.15Å; A109-M113 WeakPolarHBondContact O-CG 3.47Å; A109-M113 PolarHBondContact O-N 2.86Å
110	V	90.6	Very high	80.6	Confident	67 Å²	67	82 Å²	82	41%	0.406	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-38.1	174.5	167.3	0	0	0	0	111.6	L106 R107 M113 K114	L106-V110 WeakPolarHBondContact O-CB 3.43Å; L106-V110 VanDerWaalsContact O-CG2 3.27Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 2.88Å; R107-V110 PolarHBondContact O-N 3.33Å; V110-M113 HydrophobicContact CG2-CE 4.19Å; V110-K114 HydrophobicContact CG1-CD 4.27Å; V110-K114 WeakPolarHBondContact O-CB 3.39Å; V110-K114 VanDerWaalsContact O-CG 3.31Å; V110-K114 WeakPolarHBondContact O-CG 3.24Å; V110-K114 PolarHBondContact O-N 2.9Å
111	S	86.6	Confident	78.3	Confident	79 Å²	79	88.2 Å²	88.2	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-63.8	-46.8	174	-164.1	0	0	0	0	111.5	R107 M108 M113 K114 S115	R107-S111 WeakPolarHBondContact O-CB 3.35Å; R107-S111 PolarHBondContact O-N 2.83Å; M108-S111 WeakPolarHBondContact O-CB 3.38Å; M108-S111 PolarHBondContact O-N 2.96Å; S111-M113 PolarHBondContact O-N 2.92Å; S111-K114 PolarHBondContact O-N 3.35Å; S111-S115 PolarHBondContact O-N 3.42Å
112	H	82.9	Confident	76.3	Confident	54 Å²	54	94 Å²	94	25%	0.25	50%	0.501	C	S	.	.	H	α-helix	trans	-59.2	-48	175.8	-171.6	-113.9	0	0	0	111.6	V90 M108 A109 K114 S115 M116	V90-H112 HydrophobicContact CG1-CB 4.09Å; M108-H112 WeakPolarHBondContact O-CB 3.36Å; M108-H112 PolarHBondContact O-N 2.87Å; A109-H112 PolarHBondContact O-N 2.88Å; H112-K114 VanDerWaalsContact C-N 3.33Å; H112-K114 PolarHBondContact O-N 2.95Å; H112-S115 WeakPolarHBondContact O-CB 3.47Å; H112-S115 PolarHBondContact O-N 2.94Å; H112-M116 VanDerWaalsContact CE1-SD 3.56Å; H112-M116 WeakPolarHBondContact O-CG 3.38Å; H112-M116 PolarHBondContact O-N 3.3Å
113	M	82.4	Confident	73.6	Confident	77 Å²	77	94.1 Å²	94.1	38%	0.379	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-34.2	174.8	-75.5	-169.2	-70.2	0	0	113.6	A109 V110 S111 M116 R117	A109-M113 WeakPolarHBondContact O-CB 3.15Å; A109-M113 WeakPolarHBondContact O-CG 3.47Å; A109-M113 PolarHBondContact O-N 2.86Å; V110-M113 HydrophobicContact CG2-CE 4.19Å; S111-M113 PolarHBondContact O-N 2.92Å; M113-M116 HydrophobicContact CG-CE 4.23Å; M113-R117 WeakPolarHBondContact O-CB 3.45Å; M113-R117 VanDerWaalsContact O-CG 3.22Å; M113-R117 WeakPolarHBondContact O-CG 3.47Å; M113-R117 PolarHBondContact O-N 3.41Å
114	K	79.7	Confident	71.2	Confident	149 Å²	149	97.3 Å²	97.3	65%	0.648	54%	0.537	S	S	*	.	H	α-helix	trans	-68.6	-40.2	173.6	-78.4	177.9	176.9	-172.6	0	111.7	V110 S111 H112 R117 G118	V110-K114 HydrophobicContact CG1-CD 4.27Å; V110-K114 WeakPolarHBondContact O-CB 3.39Å; V110-K114 VanDerWaalsContact O-CG 3.31Å; V110-K114 WeakPolarHBondContact O-CG 3.24Å; V110-K114 PolarHBondContact O-N 2.9Å; S111-K114 PolarHBondContact O-N 3.35Å; H112-K114 VanDerWaalsContact C-N 3.33Å; H112-K114 PolarHBondContact O-N 2.95Å; K114-R117 PolarHBondContact O-N 3.02Å; K114-G118 PolarHBondContact O-N 3.26Å
115	S	74.3	Confident	69.1	Low	100 Å²	100	101.2 Å²	101.2	70%	0.699	56%	0.556	S	S	*	*	H	α-helix	trans	-59.9	-49.5	173.3	-163.6	0	0	0	0	111.2	S111 H112 R117 G118	S111-S115 PolarHBondContact O-N 3.42Å; H112-S115 WeakPolarHBondContact O-CB 3.47Å; H112-S115 PolarHBondContact O-N 2.94Å; S115-R117 VanDerWaalsContact C-N 3.34Å; S115-R117 PolarHBondContact O-N 3.47Å; S115-G118 PolarHBondContact O-N 2.96Å
116	M	66	Low	67.1	Low	130 Å²	130	104.5 Å²	104.5	64%	0.64	59%	0.593	S	S	*	*	H	α-helix	trans	-66.1	-28.1	178.5	-66.7	-168.4	-56.2	0	0	114.5	H112 M113	H112-M116 VanDerWaalsContact CE1-SD 3.56Å; H112-M116 WeakPolarHBondContact O-CG 3.38Å; H112-M116 PolarHBondContact O-N 3.3Å; M113-M116 HydrophobicContact CG-CE 4.23Å
117	R	62.5	Low	64.9	Low	160 Å²	160	105.7 Å²	105.7	60%	0.604	61%	0.613	S	S	*	*	H	α-helix	trans	-90.2	-14.2	178.8	-68.9	178.7	-164.8	-69.6	-4.3	113.8	M113 K114 S115 S131	M113-R117 WeakPolarHBondContact O-CB 3.45Å; M113-R117 VanDerWaalsContact O-CG 3.22Å; M113-R117 WeakPolarHBondContact O-CG 3.47Å; M113-R117 PolarHBondContact O-N 3.41Å; K114-R117 PolarHBondContact O-N 3.02Å; S115-R117 VanDerWaalsContact C-N 3.34Å; S115-R117 PolarHBondContact O-N 3.47Å; R117-S131 PolarHBondContact NH1-OG 2.97Å
118	G	48.3	Very low	63.4	Low	46 Å²	46	105 Å²	105	47%	0.474	61%	0.612	S	S	.	*			trans	70.9	162.9	-177.4	0	0	0	0	0	114.5	K114 S115 G120	K114-G118 PolarHBondContact O-N 3.26Å; S115-G118 PolarHBondContact O-N 2.96Å; G118-G120 PolarHBondContact O-N 3.12Å
119	T	48.5	Very low	61.6	Low	149 Å²	149	106.8 Å²	106.8	91%	0.914	62%	0.619	S	S	*	*	S	Bend	trans	-70.1	117.8	167.5	-34.5	0	0	0	0	107.9	N121	T119-N121 PolarHBondContact O-N 3.07Å
120	G	52.5	Low	60.1	Low	73 Å²	73	109 Å²	109	75%	0.753	63%	0.633	S	S	*	*			trans	-65.9	130.4	-158	0	0	0	0	0	115.9	G118	G118-G120 PolarHBondContact O-N 3.12Å
121	N	39.4	Very low	58.6	Low	157 Å²	157	110.2 Å²	110.2	84%	0.84	64%	0.644	S	S	*	*			trans	-104.1	144.9	169	-103.5	0.5	0	0	0	111.6	T119	T119-N121 PolarHBondContact O-N 3.07Å
122	K	49.3	Very low	57.8	Low	212 Å²	212	114.2 Å²	114.2	92%	0.922	65%	0.652	S	S	*	*			trans	-90.5	100.4	177.8	-65.8	177.1	-179.6	176.4	0	110.5
123	S	36.3	Very low	57.1	Low	94 Å²	94	113.2 Å²	113.2	66%	0.657	65%	0.648	S	S	*	*			trans	-135.8	131.7	170.4	-58.3	0	0	0	0	110.2	D125	S123-D125 PolarHBondContact O-N 2.88Å
124	T	42.5	Very low	57	Low	160 Å²	160	113.2 Å²	113.2	98%	0.982	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	34.9	-173.3	52.3	0	0	0	0	113.9
125	D	46.8	Very low	56.6	Low	123 Å²	123	111.8 Å²	111.8	66%	0.658	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	-9.4	-170.8	-154.3	28.5	0	0	0	112.4	S123 A127	S123-D125 PolarHBondContact O-N 2.88Å; D125-A127 VanDerWaalsContact C-N 3.33Å; D125-A127 PolarHBondContact O-N 2.75Å
126	G	50.9	Low	56.5	Low	79 Å²	79	112.9 Å²	112.9	81%	0.814	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	50.5	-171.4	0	0	0	0	0	115.9
127	A	49.9	Very low	57.1	Low	102 Å²	102	111.4 Å²	111.4	84%	0.843	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	-6.2	-174.1	0	0	0	0	0	116.3	D125	D125-A127 VanDerWaalsContact C-N 3.33Å; D125-A127 PolarHBondContact O-N 2.75Å
128	Y	59	Low	57.8	Low	148 Å²	148	104.8 Å²	104.8	58%	0.58	61%	0.61	S	S	*	*	S	Bend	trans	-105.7	-18.4	-175.4	71	-92.4	0	0	0	115.1
129	K	53.3	Low	58.9	Low	81 Å²	81	105.1 Å²	105.1	35%	0.352	60%	0.599	S	S	.	*	S	Bend	trans	-109.6	110	-175.3	-175.6	176	-176	-178.1	0	110.2	L133 E135 L138	K129-L133 WeakPolarHBondContact CE-O 3.2Å; K129-E135 IonicContact NZ-OE2 2.9Å; K129-E135 PolarHBondContact NZ-OE2 3.27Å; K129-L138 HydrophobicContact CB-CD2 4.06Å; K129-L138 HydrophobicContact CG-CD2 3.91Å
130	P	59.5	Low	60.1	Low	49 Å²	49	103.8 Å²	103.8	32%	0.318	58%	0.582	S	S	.	*			trans	-70.7	138.5	176.1	31.1	-34.6	0	0	0	109.7	F132 L133	P130-F132 HydrophobicContact CB-CD1 3.77Å; P130-F132 HydrophobicContact CB-CE1 3.54Å; P130-F132 HydrophobicContact CB-CZ 4.33Å; P130-F132 HydrophobicContact CG-CD1 4.3Å; P130-F132 HydrophobicContact CG-CE1 3.87Å; P130-F132 HydrophobicContact CG-CZ 4.16Å; P130-F132 PolarHBondContact O-N 3.44Å; P130-L133 HydrophobicContact CG-CD1 4.1Å; P130-L133 HydrophobicContact CG-CG 4.39Å; P130-L133 PolarHBondContact O-N 2.8Å
131	S	59.2	Low	61.3	Low	92 Å²	92	104.5 Å²	104.5	64%	0.643	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	22.4	-170.9	82.2	0	0	0	0	115.4	R117	R117-S131 PolarHBondContact NH1-OG 2.97Å
132	F	70.8	Confident	62.9	Low	164 Å²	164	100.6 Å²	100.6	72%	0.719	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-5.6	174.8	71.7	-98.1	0	0	0	112.9	P130	P130-F132 HydrophobicContact CB-CD1 3.77Å; P130-F132 HydrophobicContact CB-CE1 3.54Å; P130-F132 HydrophobicContact CB-CZ 4.33Å; P130-F132 HydrophobicContact CG-CD1 4.3Å; P130-F132 HydrophobicContact CG-CE1 3.87Å; P130-F132 HydrophobicContact CG-CZ 4.16Å; P130-F132 PolarHBondContact O-N 3.44Å
133	L	68.8	Low	63.8	Low	33 Å²	33	91.1 Å²	91.1	17%	0.173	51%	0.506	C	S	.	.	S	Bend	trans	-113.8	137	174.1	-63.1	176.2	0	0	0	110.4	K129 P130 E137 L138 L141	K129-L133 WeakPolarHBondContact CE-O 3.2Å; P130-L133 HydrophobicContact CG-CD1 4.1Å; P130-L133 HydrophobicContact CG-CG 4.39Å; P130-L133 PolarHBondContact O-N 2.8Å; L133-E137 HydrophobicContact CD2-CB 4.21Å; L133-L138 HydrophobicContact CB-CB 4.23Å; L133-L138 HydrophobicContact CD1-CB 4.31Å; L133-L138 HydrophobicContact CD1-CD1 3.89Å; L133-L141 HydrophobicContact CD1-CD2 3.97Å
134	T	79.5	Confident	65.4	Low	77 Å²	77	92.6 Å²	92.6	47%	0.472	50%	0.502	S	S	.	.			trans	-65.6	168.5	161	65.4	0	0	0	0	110.5	Q136 E137 L138	T134-Q136 VanDerWaalsContact C-N 3.3Å; T134-Q136 PolarHBondContact O-N 3.33Å; T134-E137 WeakPolarHBondContact CB-OE2 3.5Å; T134-E137 VanDerWaalsContact CG2-OE2 3.25Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.43Å; T134-E137 PolarHBondContact N-OE2 3.19Å; T134-E137 WeakPolarHBondContact OG1-CB 3.41Å; T134-E137 VanDerWaalsContact OG1-CD 3.25Å; T134-E137 VanDerWaalsContact OG1-CG 3.27Å; T134-E137 WeakPolarHBondContact OG1-CG 3.34Å; T134-E137 PolarHBondContact OG1-N 2.84Å; T134-E137 PolarHBondContact OG1-OE2 3.16Å; T134-L138 WeakPolarHBondContact O-CB 3.49Å; T134-L138 PolarHBondContact O-N 3.16Å
135	E	70.7	Confident	66.5	Low	119 Å²	119	89.1 Å²	89.1	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-66.6	-35.9	177.7	-149.5	140.5	129.8	0	0	112.2	K129 K139	K129-E135 IonicContact NZ-OE2 2.9Å; K129-E135 PolarHBondContact NZ-OE2 3.27Å; E135-K139 WeakPolarHBondContact O-CB 3.5Å; E135-K139 PolarHBondContact O-N 3.24Å
136	Q	73.3	Confident	67.4	Low	122 Å²	122	83.9 Å²	83.9	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-73.9	-37.7	-178.6	-169.6	67.9	-0.1	0	0	111.8	T134 H140	T134-Q136 VanDerWaalsContact C-N 3.3Å; T134-Q136 PolarHBondContact O-N 3.33Å; Q136-H140 WeakPolarHBondContact O-CB 3.47Å; Q136-H140 PolarHBondContact O-N 2.75Å
137	E	77.9	Confident	68.4	Low	99 Å²	99	83.1 Å²	83.1	46%	0.463	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-45.1	171.5	-69.2	160.8	133.1	0	0	111.3	L133 T134 K139 H140 L141	L133-E137 HydrophobicContact CD2-CB 4.21Å; T134-E137 WeakPolarHBondContact CB-OE2 3.5Å; T134-E137 VanDerWaalsContact CG2-OE2 3.25Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.43Å; T134-E137 PolarHBondContact N-OE2 3.19Å; T134-E137 WeakPolarHBondContact OG1-CB 3.41Å; T134-E137 VanDerWaalsContact OG1-CD 3.25Å; T134-E137 VanDerWaalsContact OG1-CG 3.27Å; T134-E137 WeakPolarHBondContact OG1-CG 3.34Å; T134-E137 PolarHBondContact OG1-N 2.84Å; T134-E137 PolarHBondContact OG1-OE2 3.16Å; E137-K139 VanDerWaalsContact C-N 3.32Å; E137-K139 PolarHBondContact O-N 2.88Å; E137-H140 PolarHBondContact O-N 3.5Å; E137-L141 WeakPolarHBondContact O-CB 3.34Å; E137-L141 PolarHBondContact O-N 3.5Å
138	L	77.7	Confident	69.9	Low	22 Å²	22	78.3 Å²	78.3	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-62.3	-40.8	176.3	-178.2	61.9	0	0	0	111.4	K129 L133 T134 I142	K129-L138 HydrophobicContact CB-CD2 4.06Å; K129-L138 HydrophobicContact CG-CD2 3.91Å; L133-L138 HydrophobicContact CB-CB 4.23Å; L133-L138 HydrophobicContact CD1-CB 4.31Å; L133-L138 HydrophobicContact CD1-CD1 3.89Å; T134-L138 WeakPolarHBondContact O-CB 3.49Å; T134-L138 PolarHBondContact O-N 3.16Å; L138-I142 HydrophobicContact CD1-CD1 3.7Å; L138-I142 HydrophobicContact CD1-CG1 4.07Å; L138-I142 HydrophobicContact CG-CD1 3.83Å; L138-I142 VanDerWaalsContact O-CB 3.29Å; L138-I142 WeakPolarHBondContact O-CB 3.27Å; L138-I142 WeakPolarHBondContact O-CG1 3.36Å; L138-I142 PolarHBondContact O-N 2.97Å
139	K	72.1	Confident	71.3	Confident	53 Å²	53	71.3 Å²	71.3	23%	0.23	37%	0.373	C	S	.	.	H	α-helix	trans	-58.2	-55.3	172.1	179.3	-167.6	173.2	-161.8	0	110.6	E135 E137 I142 L143 S164 D165	E135-K139 WeakPolarHBondContact O-CB 3.5Å; E135-K139 PolarHBondContact O-N 3.24Å; E137-K139 VanDerWaalsContact C-N 3.32Å; E137-K139 PolarHBondContact O-N 2.88Å; K139-I142 PolarHBondContact O-N 3.19Å; K139-L143 HydrophobicContact CD-CD1 4.31Å; K139-L143 HydrophobicContact CG-CD1 3.56Å; K139-L143 WeakPolarHBondContact O-CB 3.31Å; K139-L143 WeakPolarHBondContact O-CD1 3.41Å; K139-L143 WeakPolarHBondContact O-CG 3.5Å; K139-L143 PolarHBondContact O-N 3.5Å; K139-S164 WeakPolarHBondContact CE-OG 3.48Å; K139-S164 PolarHBondContact NZ-OG 2.84Å; K139-D165 WeakPolarHBondContact CE-OD1 3.2Å; K139-D165 IonicContact NZ-OD1 2.78Å; K139-D165 PolarHBondContact NZ-OD1 2.96Å; K139-D165 IonicContact NZ-OD2 3.75Å; K139-D165 PolarHBondContact NZ-OD2 2.85Å
140	H	72.8	Confident	73	Confident	121 Å²	121	70.2 Å²	70.2	56%	0.56	37%	0.371	S	S	*	.	H	α-helix	trans	-61.5	-48	-177	-163.9	83.4	0	0	0	111.6	Q136 E137 I142 L143 E144	Q136-H140 WeakPolarHBondContact O-CB 3.47Å; Q136-H140 PolarHBondContact O-N 2.75Å; E137-H140 PolarHBondContact O-N 3.5Å; H140-I142 PolarHBondContact O-N 3.16Å; H140-L143 PolarHBondContact O-N 3.08Å; H140-L143 VanDerWaalsContact O-N 3.15Å; H140-E144 WeakPolarHBondContact O-CB 3.48Å; H140-E144 PolarHBondContact O-N 2.93Å
141	L	77.3	Confident	74.4	Confident	88 Å²	88	67.9 Å²	67.9	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-42.3	178.7	-179.7	64	0	0	0	112.4	L133 E137 A145	L133-L141 HydrophobicContact CD1-CD2 3.97Å; E137-L141 WeakPolarHBondContact O-CB 3.34Å; E137-L141 PolarHBondContact O-N 3.5Å; L141-A145 WeakPolarHBondContact O-CB 3.47Å; L141-A145 PolarHBondContact O-N 2.81Å
142	I	72.9	Confident	75.9	Confident	74 Å²	74	64.4 Å²	64.4	38%	0.379	33%	0.331	S	S	.	.	H	α-helix	trans	-64.6	-41.4	175.5	-74	172.3	0	0	0	110.8	L138 K139 H140 A146 I314	L138-I142 HydrophobicContact CD1-CD1 3.7Å; L138-I142 HydrophobicContact CD1-CG1 4.07Å; L138-I142 HydrophobicContact CG-CD1 3.83Å; L138-I142 VanDerWaalsContact O-CB 3.29Å; L138-I142 WeakPolarHBondContact O-CB 3.27Å; L138-I142 WeakPolarHBondContact O-CG1 3.36Å; L138-I142 PolarHBondContact O-N 2.97Å; K139-I142 PolarHBondContact O-N 3.19Å; H140-I142 PolarHBondContact O-N 3.16Å; I142-A146 WeakPolarHBondContact O-CB 3.38Å; I142-A146 PolarHBondContact O-N 2.66Å; I142-I314 HydrophobicContact CG2-CD1 4.2Å
143	L	68.8	Low	76.8	Confident	13 Å²	13	56.6 Å²	56.6	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-74.6	-38.6	-176	-64.9	168.1	0	0	0	112.1	K139 H140 A146 D147 G148 S166	K139-L143 HydrophobicContact CD-CD1 4.31Å; K139-L143 HydrophobicContact CG-CD1 3.56Å; K139-L143 WeakPolarHBondContact O-CB 3.31Å; K139-L143 WeakPolarHBondContact O-CD1 3.41Å; K139-L143 WeakPolarHBondContact O-CG 3.5Å; K139-L143 PolarHBondContact O-N 3.5Å; H140-L143 PolarHBondContact O-N 3.08Å; H140-L143 VanDerWaalsContact O-N 3.15Å; L143-A146 PolarHBondContact O-N 2.86Å; L143-D147 PolarHBondContact O-N 3.46Å; L143-D147 VanDerWaalsContact O-N 3.15Å; L143-G148 WeakPolarHBondContact CD2-O 3.47Å; L143-G148 PolarHBondContact O-N 2.84Å; L143-S166 WeakPolarHBondContact CD1-OG 3.15Å
144	E	70.1	Confident	77.8	Confident	126 Å²	126	55.4 Å²	55.4	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-64.6	-50.5	172.6	-176.3	-179.8	-162.2	0	0	111.5	H140 A146 D147	H140-E144 WeakPolarHBondContact O-CB 3.48Å; H140-E144 PolarHBondContact O-N 2.93Å; E144-A146 PolarHBondContact O-N 2.88Å; E144-D147 PolarHBondContact O-N 3.21Å
145	A	65.4	Low	78	Confident	87 Å²	87	51.9 Å²	51.9	72%	0.719	27%	0.27	S	S	*	.	H	α-helix	trans	-71	-12	178.4	0	0	0	0	0	113.7	L141	L141-A145 WeakPolarHBondContact O-CB 3.47Å; L141-A145 PolarHBondContact O-N 2.81Å
146	A	65.8	Low	78.5	Confident	12 Å²	12	51.9 Å²	51.9	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-99	-15.6	178.2	0	0	0	0	0	114.6	I142 L143 E144 G148 R316	I142-A146 WeakPolarHBondContact O-CB 3.38Å; I142-A146 PolarHBondContact O-N 2.66Å; L143-A146 PolarHBondContact O-N 2.86Å; E144-A146 PolarHBondContact O-N 2.88Å; A146-G148 VanDerWaalsContact C-N 3.26Å; A146-G148 PolarHBondContact O-N 3.31Å; A146-R316 HydrophobicContact CB-CG 4.03Å; A146-R316 VanDerWaalsContact CB-NE 3.31Å; A146-R316 WeakPolarHBondContact O-CB 3.36Å; A146-R316 WeakPolarHBondContact O-CD 3.15Å; A146-R316 VanDerWaalsContact O-CG 3.28Å; A146-R316 WeakPolarHBondContact O-CG 3.19Å
147	D	71.3	Confident	79	Confident	64 Å²	64	49.6 Å²	49.6	34%	0.342	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	54.2	-163.2	-86.1	-45.2	0	0	0	111.4	L143 E144 K261 L317	L143-D147 PolarHBondContact O-N 3.46Å; L143-D147 VanDerWaalsContact O-N 3.15Å; E144-D147 PolarHBondContact O-N 3.21Å; D147-K261 WeakPolarHBondContact OD1-CD 3.39Å; D147-K261 IonicContact OD1-NZ 3Å; D147-K261 PolarHBondContact OD1-NZ 3.42Å; D147-K261 IonicContact OD2-NZ 3.76Å; D147-K261 PolarHBondContact OD2-NZ 2.78Å; D147-L317 WeakPolarHBondContact O-CB 3.4Å; D147-L317 PolarHBondContact O-N 3.44Å
148	G	82.6	Confident	79.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	177.2	-165	0	0	0	0	0	115.8	L143 A146 W315	L143-G148 WeakPolarHBondContact CD2-O 3.47Å; L143-G148 PolarHBondContact O-N 2.84Å; A146-G148 VanDerWaalsContact C-N 3.26Å; A146-G148 PolarHBondContact O-N 3.31Å; G148-W315 CarbonylContact C-O 3.43Å; G148-W315 WeakPolarHBondContact CA-O 3.41Å
149	F	87.3	Confident	80	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.2	178.6	66.5	-83	0	0	0	112.2	F151 V163 V167 V170 L171 W178 M241 I314 W315	F149-F151 HydrophobicContact CD2-CB 4.48Å; F149-F151 HydrophobicContact CE2-CB 4.42Å; F149-V163 HydrophobicContact CD2-CG2 4Å; F149-V163 HydrophobicContact CE2-CG2 4.26Å; F149-V167 HydrophobicContact CB-CB 4.48Å; F149-V167 HydrophobicContact CD2-CB 4.08Å; F149-V167 HydrophobicContact CD2-CG2 4.12Å; F149-V167 HydrophobicContact CE1-CG2 4.42Å; F149-V167 HydrophobicContact CE2-CB 4.44Å; F149-V167 HydrophobicContact CE2-CG2 3.98Å; F149-V167 HydrophobicContact CG-CB 4.18Å; F149-V167 HydrophobicContact CG-CG2 4.38Å; F149-V167 HydrophobicContact CZ-CG2 4.15Å; F149-V170 HydrophobicContact CD1-CB 4.19Å; F149-V170 HydrophobicContact CD1-CG1 4.01Å; F149-V170 HydrophobicContact CE1-CG1 4.36Å; F149-L171 HydrophobicContact CE1-CD1 3.53Å; F149-L171 HydrophobicContact CE1-CG 3.87Å; F149-L171 HydrophobicContact CZ-CD1 3.57Å; F149-L171 HydrophobicContact CZ-CG 4.4Å; F149-W178 AromaticContact CE2-CH2 3.9Å; F149-W178 HydrophobicContact CE2-CH2 3.9Å; F149-W178 HydrophobicContact CE2-CZ2 4.49Å; F149-W178 AromaticContact CE2-CZ3 3.96Å; F149-W178 HydrophobicContact CE2-CZ3 3.96Å; F149-W178 AromaticContact CZ-CH2 3.77Å; F149-W178 HydrophobicContact CZ-CH2 3.77Å; F149-W178 HydrophobicContact CZ-CZ2 4.26Å; F149-W178 HydrophobicContact CZ-CZ3 4.29Å; F149-M241 HydrophobicContact CZ-SD 4.02Å; F149-I314 WeakPolarHBondContact O-CA 3.36Å; F149-W315 HydrophobicContact CD1-CB 3.99Å; F149-W315 HydrophobicContact CE1-CB 3.59Å; F149-W315 HydrophobicContact CE1-CG 4.11Å; F149-W315 HydrophobicContact CE2-CB 4.34Å; F149-W315 AromaticContact CE2-CD1 3.54Å; F149-W315 HydrophobicContact CE2-CG 4.28Å; F149-W315 HydrophobicContact CZ-CB 3.79Å; F149-W315 AromaticContact CZ-CD1 3.39Å; F149-W315 AromaticContact CZ-CG 3.81Å; F149-W315 HydrophobicContact CZ-CG 3.81Å; F149-W315 PolarHBondContact N-O 3.14Å; F149-W315 PolarHBondContact O-N 2.94Å
150	L	88.1	Confident	80.9	Confident	59 Å²	59	46.4 Å²	46.4	31%	0.309	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	140.3	172.6	-177.5	73.5	0	0	0	109.8	Y162 S164 A313 I314	L150-Y162 HydrophobicContact CD2-CE1 4.13Å; L150-Y162 HydrophobicContact CG-CE1 4.47Å; L150-S164 PolarHBondContact O-N 3.35Å; L150-A313 WeakPolarHBondContact CD1-O 3.34Å; L150-I314 HydrophobicContact CD1-CG1 3.8Å
151	F	89.8	Confident	81.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160.9	173.6	78.3	-71	0	0	0	111.9	F149 V153 Y162 L183 L311 A313 W315	F149-F151 HydrophobicContact CD2-CB 4.48Å; F149-F151 HydrophobicContact CE2-CB 4.42Å; F151-V153 HydrophobicContact CD2-CG1 3.86Å; F151-V153 HydrophobicContact CD2-CG2 4.33Å; F151-V153 HydrophobicContact CE2-CG1 4.05Å; F151-V153 HydrophobicContact CE2-CG2 3.82Å; F151-Y162 CarbonylContact C-O 3.56Å; F151-Y162 VanDerWaalsContact CA-O 3.3Å; F151-Y162 WeakPolarHBondContact CA-O 3.41Å; F151-L183 HydrophobicContact CE2-CD1 4.33Å; F151-L183 HydrophobicContact CE2-CD2 4Å; F151-L311 HydrophobicContact CZ-CD2 4.21Å; F151-A313 HydrophobicContact CD1-CB 4.06Å; F151-A313 WeakPolarHBondContact CD1-O 3.31Å; F151-A313 HydrophobicContact CE1-CB 3.29Å; F151-A313 HydrophobicContact CZ-CB 3.63Å; F151-A313 PolarHBondContact N-O 3Å; F151-A313 PolarHBondContact O-N 3.37Å; F151-A313 VanDerWaalsContact O-O 3.13Å; F151-W315 AromaticContact CD1-CD1 3.17Å; F151-W315 HydrophobicContact CD1-CG 4.08Å; F151-W315 AromaticContact CD1-NE1 3.43Å; F151-W315 AromaticContact CD2-NE1 3.95Å; F151-W315 AromaticContact CE1-CD1 3.13Å; F151-W315 HydrophobicContact CE1-CD2 4.15Å; F151-W315 AromaticContact CE1-CE2 3.72Å; F151-W315 AromaticContact CE1-CG 3.81Å; F151-W315 HydrophobicContact CE1-CG 3.81Å; F151-W315 AromaticContact CE1-NE1 3.02Å; F151-W315 AromaticContact CE2-NE1 3.61Å; F151-W315 AromaticContact CG-CD1 3.85Å; F151-W315 AromaticContact CG-NE1 3.88Å; F151-W315 AromaticContact CZ-CD1 3.78Å; F151-W315 AromaticContact CZ-CE2 3.68Å; F151-W315 HydrophobicContact CZ-CZ2 4.12Å; F151-W315 AromaticContact CZ-NE1 3.13Å
152	V	90.5	Very high	82.2	Confident	19 Å²	19	43 Å²	43	12%	0.115	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.9	172.9	-171.8	0	0	0	0	109.2	I161 Y162 C310 L311 V312	V152-I161 HydrophobicContact CB-CB 4.47Å; V152-I161 HydrophobicContact CG1-CB 4.38Å; V152-I161 HydrophobicContact CG1-CD1 4.44Å; V152-I161 PolarHBondContact O-N 3.14Å; V152-Y162 HydrophobicContact CG2-CD1 4.34Å; V152-Y162 PolarHBondContact N-O 3.47Å; V152-Y162 PolarHBondContact O-N 2.82Å; V152-Y162 VanDerWaalsContact O-N 3.1Å; V152-C310 HydrophobicContact CG1-CB 3.83Å; V152-L311 VanDerWaalsContact CA-O 3.3Å; V152-L311 WeakPolarHBondContact CA-O 3.49Å; V152-V312 HydrophobicContact CG1-CG2 4.08Å; V152-V312 HydrophobicContact CG2-CG1 4.36Å; V152-V312 HydrophobicContact CG2-CG2 4.14Å
153	V	90.8	Very high	83	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.9	176.6	-72.8	0	0	0	0	111.6	F151 A155 R159 V160 L183 L199 C310 L311	F151-V153 HydrophobicContact CD2-CG1 3.86Å; F151-V153 HydrophobicContact CD2-CG2 4.33Å; F151-V153 HydrophobicContact CE2-CG1 4.05Å; F151-V153 HydrophobicContact CE2-CG2 3.82Å; V153-A155 PolarHBondContact O-N 3.32Å; V153-R159 WeakPolarHBondContact CA-O 3.38Å; V153-V160 HydrophobicContact CG1-CB 4.37Å; V153-V160 HydrophobicContact CG1-CG2 3.91Å; V153-L183 HydrophobicContact CG1-CB 4.11Å; V153-L183 HydrophobicContact CG1-CD1 4.47Å; V153-L183 HydrophobicContact CG1-CD2 4.19Å; V153-L183 HydrophobicContact CG2-CD2 4.16Å; V153-L199 HydrophobicContact CG2-CD2 3.95Å; V153-C310 CarbonylContact O-C 3.54Å; V153-C310 WeakPolarHBondContact O-CA 3.44Å; V153-C310 WeakPolarHBondContact O-CB 3.46Å; V153-L311 HydrophobicContact CG2-CB 3.93Å; V153-L311 HydrophobicContact CG2-CD2 4.43Å; V153-L311 PolarHBondContact N-O 2.94Å; V153-L311 VanDerWaalsContact N-O 3.16Å; V153-L311 PolarHBondContact O-N 3.31Å
154	A	88.9	Confident	83.8	Confident	7 Å²	7	38.9 Å²	38.9	6%	0.058	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	127.2	167.7	0	0	0	0	0	109.9	E156 T157 G158 R159 I161	A154-E156 VanDerWaalsContact C-N 3.29Å; A154-E156 PolarHBondContact O-N 2.98Å; A154-T157 VanDerWaalsContact CB-OG1 3.31Å; A154-T157 WeakPolarHBondContact CB-OG1 3.02Å; A154-G158 VanDerWaalsContact O-CA 3.28Å; A154-G158 WeakPolarHBondContact O-CA 3.14Å; A154-G158 PolarHBondContact O-N 3.31Å; A154-R159 HydrophobicContact CB-CB 4.43Å; A154-R159 PolarHBondContact N-O 2.79Å; A154-I161 HydrophobicContact CB-CD1 4.17Å
155	A	84.4	Confident	84.5	Confident	4 Å²	4	36 Å²	36	3%	0.033	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-23.5	-173.6	0	0	0	0	0	113.3	V153 S307 Y309	V153-A155 PolarHBondContact O-N 3.32Å; A155-S307 PolarHBondContact N-OG 2.85Å; A155-Y309 WeakPolarHBondContact CB-O 3.49Å; A155-Y309 PolarHBondContact N-O 3.1Å
156	E	80.9	Confident	85.2	Confident	119 Å²	119	32.9 Å²	32.9	56%	0.556	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-48.9	-179.5	-174.3	171.7	-141.9	0	0	112.3	A154 G306 S307	A154-E156 VanDerWaalsContact C-N 3.29Å; A154-E156 PolarHBondContact O-N 2.98Å; E156-G306 WeakPolarHBondContact OE2-CA 3.41Å; E156-S307 PolarHBondContact N-OG 3.45Å; E156-S307 PolarHBondContact OE2-N 3.37Å; E156-S307 VanDerWaalsContact OE2-N 3.11Å
157	T	84.4	Confident	86.1	Confident	74 Å²	74	32.3 Å²	32.3	45%	0.454	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-16.6	-174.4	60.6	0	0	0	0	114.1	A154 R159	A154-T157 VanDerWaalsContact CB-OG1 3.31Å; A154-T157 WeakPolarHBondContact CB-OG1 3.02Å; T157-R159 PolarHBondContact O-N 2.88Å; T157-R159 WeakPolarHBondContact OG1-CB 3.28Å; T157-R159 PolarHBondContact OG1-N 3.26Å
158	G	86.6	Confident	86.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.			trans	69.8	3.3	-171.4	0	0	0	0	0	114.9	A154 V160 L183	A154-G158 VanDerWaalsContact O-CA 3.28Å; A154-G158 WeakPolarHBondContact O-CA 3.14Å; A154-G158 PolarHBondContact O-N 3.31Å; G158-V160 PolarHBondContact O-N 3.16Å; G158-L183 PolarHBondContact O-N 2.88Å
159	R	89.4	Confident	86.3	Confident	101 Å²	101	34.5 Å²	34.5	38%	0.381	18%	0.179	S	C	.	.	B	Isolated β-bridge	trans	-59.1	131.3	177.3	-169.8	-178.8	-175.1	-152.8	-2.5	110	V153 A154 T157 I161 D300	V153-R159 WeakPolarHBondContact CA-O 3.38Å; A154-R159 HydrophobicContact CB-CB 4.43Å; A154-R159 PolarHBondContact N-O 2.79Å; T157-R159 PolarHBondContact O-N 2.88Å; T157-R159 WeakPolarHBondContact OG1-CB 3.28Å; T157-R159 PolarHBondContact OG1-N 3.26Å; R159-I161 PolarHBondContact O-N 2.81Å; R159-D300 IonicContact CZ-OD1 2.67Å; R159-D300 IonicContact NH1-OD1 3Å; R159-D300 PolarHBondContact NH1-OD1 2.87Å; R159-D300 VanDerWaalsContact NH1-OD1 3.11Å; R159-D300 IonicContact NH2-OD1 2.71Å
160	V	90.5	Very high	85.9	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.03	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.8	176.1	-180	0	0	0	0	109.4	V153 G158 V163 W178 S181	V153-V160 HydrophobicContact CG1-CB 4.37Å; V153-V160 HydrophobicContact CG1-CG2 3.91Å; G158-V160 PolarHBondContact O-N 3.16Å; V160-V163 HydrophobicContact CG1-CB 4.34Å; V160-V163 HydrophobicContact CG1-CG1 4.42Å; V160-W178 WeakPolarHBondContact CB-O 3.25Å; V160-W178 HydrophobicContact CG2-CE3 4.21Å; V160-S181 PolarHBondContact N-O 2.93Å
161	I	88.6	Confident	85.6	Confident	50 Å²	50	32.5 Å²	32.5	26%	0.256	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-39.2	177.2	-56.9	173.5	0	0	0	109.9	V152 A154 R159 W289 C310	V152-I161 HydrophobicContact CB-CB 4.47Å; V152-I161 HydrophobicContact CG1-CB 4.38Å; V152-I161 HydrophobicContact CG1-CD1 4.44Å; V152-I161 PolarHBondContact O-N 3.14Å; A154-I161 HydrophobicContact CB-CD1 4.17Å; R159-I161 PolarHBondContact O-N 2.81Å; I161-W289 HydrophobicContact CD1-CD2 4.37Å; I161-W289 HydrophobicContact CD1-CG 4.44Å; I161-W289 HydrophobicContact CG2-CH2 4.11Å; I161-W289 HydrophobicContact CG2-CZ2 3.9Å; I161-C310 HydrophobicContact CD1-CB 4.11Å
162	Y	88.3	Confident	85.1	Confident	88 Å²	88	32.8 Å²	32.8	35%	0.345	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	148.4	179.1	178	-92.7	0	0	0	111.1	L150 F151 V152	L150-Y162 HydrophobicContact CD2-CE1 4.13Å; L150-Y162 HydrophobicContact CG-CE1 4.47Å; F151-Y162 CarbonylContact C-O 3.56Å; F151-Y162 VanDerWaalsContact CA-O 3.3Å; F151-Y162 WeakPolarHBondContact CA-O 3.41Å; V152-Y162 HydrophobicContact CG2-CD1 4.34Å; V152-Y162 PolarHBondContact N-O 3.47Å; V152-Y162 PolarHBondContact O-N 2.82Å; V152-Y162 VanDerWaalsContact O-N 3.1Å
163	V	89.7	Confident	84.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	145.5	170.5	54.2	0	0	0	0	108.4	F149 V160 V167 Q175 W178 F179	F149-V163 HydrophobicContact CD2-CG2 4Å; F149-V163 HydrophobicContact CE2-CG2 4.26Å; V160-V163 HydrophobicContact CG1-CB 4.34Å; V160-V163 HydrophobicContact CG1-CG1 4.42Å; V163-V167 HydrophobicContact CG2-CB 3.74Å; V163-V167 HydrophobicContact CG2-CG1 3.84Å; V163-V167 HydrophobicContact CG2-CG2 4.13Å; V163-Q175 HydrophobicContact CG1-CG 3.64Å; V163-Q175 PolarHBondContact O-NE2 2.74Å; V163-W178 HydrophobicContact CB-CB 4.39Å; V163-W178 HydrophobicContact CB-CE3 4.48Å; V163-W178 HydrophobicContact CG1-CB 3.66Å; V163-W178 HydrophobicContact CG1-CG 4.4Å; V163-W178 HydrophobicContact CG2-CD2 4.3Å; V163-W178 HydrophobicContact CG2-CE3 4.18Å; V163-W178 HydrophobicContact CG2-CG 4.45Å; V163-F179 HydrophobicContact CG1-CE2 4.33Å; V163-F179 HydrophobicContact CG1-CZ 4.39Å
164	S	86.8	Confident	84.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.			trans	-80.4	141.9	176.1	-151.2	0	0	0	0	111.5	K139 L150 S166 V167	K139-S164 WeakPolarHBondContact CE-OG 3.48Å; K139-S164 PolarHBondContact NZ-OG 2.84Å; L150-S164 PolarHBondContact O-N 3.35Å; S164-S166 PolarHBondContact O-N 2.96Å; S164-V167 WeakPolarHBondContact O-CB 3.34Å; S164-V167 WeakPolarHBondContact O-CG1 3.3Å; S164-V167 PolarHBondContact O-N 2.96Å
165	D	83.4	Confident	84.5	Confident	66 Å²	66	36.8 Å²	36.8	35%	0.353	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-27.3	-42.8	156.7	49.3	-0.7	0	0	0	115.9	K139 V167 T168	K139-D165 WeakPolarHBondContact CE-OD1 3.2Å; K139-D165 IonicContact NZ-OD1 2.78Å; K139-D165 PolarHBondContact NZ-OD1 2.96Å; K139-D165 IonicContact NZ-OD2 3.75Å; K139-D165 PolarHBondContact NZ-OD2 2.85Å; D165-V167 PolarHBondContact O-N 3.11Å; D165-T168 PolarHBondContact O-N 3.47Å; D165-T168 VanDerWaalsContact O-N 3.08Å; D165-T168 PolarHBondContact O-OG1 3.31Å
166	S	80.4	Confident	84.6	Confident	21 Å²	21	41.1 Å²	41.1	15%	0.147	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-9.6	175.8	-63.6	0	0	0	0	115.9	L143 S164 T168 P169 V170	L143-S166 WeakPolarHBondContact CD1-OG 3.15Å; S164-S166 PolarHBondContact O-N 2.96Å; S166-T168 PolarHBondContact O-N 3.19Å; S166-P169 VanDerWaalsContact O-CD 3.3Å; S166-P169 WeakPolarHBondContact O-CD 3.3Å; S166-P169 WeakPolarHBondContact O-CG 3.46Å; S166-V170 WeakPolarHBondContact O-CB 3.21Å; S166-V170 VanDerWaalsContact O-CG2 3.24Å; S166-V170 WeakPolarHBondContact O-CG2 3.36Å; S166-V170 PolarHBondContact O-N 2.87Å
167	V	85	Confident	84.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-33.3	168.8	71.9	0	0	0	0	111.7	F149 V163 S164 D165 V170 L171 N172 Q175 W178	F149-V167 HydrophobicContact CB-CB 4.48Å; F149-V167 HydrophobicContact CD2-CB 4.08Å; F149-V167 HydrophobicContact CD2-CG2 4.12Å; F149-V167 HydrophobicContact CE1-CG2 4.42Å; F149-V167 HydrophobicContact CE2-CB 4.44Å; F149-V167 HydrophobicContact CE2-CG2 3.98Å; F149-V167 HydrophobicContact CG-CB 4.18Å; F149-V167 HydrophobicContact CG-CG2 4.38Å; F149-V167 HydrophobicContact CZ-CG2 4.15Å; V163-V167 HydrophobicContact CG2-CB 3.74Å; V163-V167 HydrophobicContact CG2-CG1 3.84Å; V163-V167 HydrophobicContact CG2-CG2 4.13Å; S164-V167 WeakPolarHBondContact O-CB 3.34Å; S164-V167 WeakPolarHBondContact O-CG1 3.3Å; S164-V167 PolarHBondContact O-N 2.96Å; D165-V167 PolarHBondContact O-N 3.11Å; V167-V170 PolarHBondContact O-N 2.97Å; V167-L171 HydrophobicContact CG2-CB 4.41Å; V167-L171 HydrophobicContact CG2-CD1 4.38Å; V167-L171 PolarHBondContact O-N 2.88Å; V167-N172 PolarHBondContact O-N 3.34Å; V167-Q175 HydrophobicContact CG1-CB 4.46Å; V167-W178 HydrophobicContact CG2-CD2 4.21Å; V167-W178 HydrophobicContact CG2-CZ2 3.97Å
168	T	82.9	Confident	85	Confident	44 Å²	44	35.6 Å²	35.6	27%	0.27	19%	0.19	S	C	.	.	H	α-helix	trans	-64.8	-54.5	-179.7	-42	0	0	0	0	112.5	D165 S166 V170 N172 Q173	D165-T168 PolarHBondContact O-N 3.47Å; D165-T168 VanDerWaalsContact O-N 3.08Å; D165-T168 PolarHBondContact O-OG1 3.31Å; S166-T168 PolarHBondContact O-N 3.19Å; T168-V170 VanDerWaalsContact C-N 3.31Å; T168-V170 PolarHBondContact O-N 3.44Å; T168-N172 WeakPolarHBondContact O-CA 3.24Å; T168-N172 PolarHBondContact O-N 3.24Å; T168-Q173 WeakPolarHBondContact CA-O 3.4Å
169	P	76.3	Confident	84.9	Confident	68 Å²	68	40.4 Å²	40.4	44%	0.442	21%	0.211	S	C	.	.	H	α-helix	trans	-68.3	-22.4	175.8	25.5	-35.5	0	0	0	114.8	S166	S166-P169 VanDerWaalsContact O-CD 3.3Å; S166-P169 WeakPolarHBondContact O-CD 3.3Å; S166-P169 WeakPolarHBondContact O-CG 3.46Å
170	V	78.9	Confident	84.1	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.097	22%	0.215	C	C	.	.	H	α-helix	trans	-88.5	-51.9	-177.3	178	0	0	0	0	112.7	F149 S166 V167 T168 L317	F149-V170 HydrophobicContact CD1-CB 4.19Å; F149-V170 HydrophobicContact CD1-CG1 4.01Å; F149-V170 HydrophobicContact CE1-CG1 4.36Å; S166-V170 WeakPolarHBondContact O-CB 3.21Å; S166-V170 VanDerWaalsContact O-CG2 3.24Å; S166-V170 WeakPolarHBondContact O-CG2 3.36Å; S166-V170 PolarHBondContact O-N 2.87Å; V167-V170 PolarHBondContact O-N 2.97Å; T168-V170 VanDerWaalsContact C-N 3.31Å; T168-V170 PolarHBondContact O-N 3.44Å; V170-L317 HydrophobicContact CG1-CB 4Å; V170-L317 HydrophobicContact CG1-CD1 4.3Å; V170-L317 HydrophobicContact CG1-CD2 4.28Å; V170-L317 HydrophobicContact CG1-CG 4.42Å
171	L	80.8	Confident	83.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-109.2	-7.9	-176.9	-66.7	-177.4	0	0	0	114.2	F149 V167 Q173 W178 M241 C243 G244 V280 L317	F149-L171 HydrophobicContact CE1-CD1 3.53Å; F149-L171 HydrophobicContact CE1-CG 3.87Å; F149-L171 HydrophobicContact CZ-CD1 3.57Å; F149-L171 HydrophobicContact CZ-CG 4.4Å; V167-L171 HydrophobicContact CG2-CB 4.41Å; V167-L171 HydrophobicContact CG2-CD1 4.38Å; V167-L171 PolarHBondContact O-N 2.88Å; L171-Q173 PolarHBondContact O-N 2.75Å; L171-W178 HydrophobicContact CD1-CH2 4.18Å; L171-W178 HydrophobicContact CD1-CZ2 3.73Å; L171-M241 HydrophobicContact CD1-CB 4.12Å; L171-M241 HydrophobicContact CD1-SD 3.93Å; L171-M241 HydrophobicContact CD2-CB 4.39Å; L171-C243 CarbonylContact O-C 3.39Å; L171-C243 WeakPolarHBondContact O-CA 3.46Å; L171-G244 PolarHBondContact O-N 3.26Å; L171-V280 HydrophobicContact CD2-CG1 4.35Å; L171-L317 HydrophobicContact CD2-CD1 4.2Å
172	N	80.2	Confident	84	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.032	22%	0.216	C	C	.	.			trans	61.4	29.7	179	-156.8	88.3	0	0	0	114	V167 T168 G244 A246 R262	V167-N172 PolarHBondContact O-N 3.34Å; T168-N172 WeakPolarHBondContact O-CA 3.24Å; T168-N172 PolarHBondContact O-N 3.24Å; N172-G244 WeakPolarHBondContact CB-O 3.49Å; N172-G244 PolarHBondContact ND2-O 2.87Å; N172-G244 CarbonylContact O-C 3.56Å; N172-G244 VanDerWaalsContact O-CA 3.26Å; N172-G244 WeakPolarHBondContact O-CA 3.28Å; N172-G244 VanDerWaalsContact O-O 3.13Å; N172-A246 PolarHBondContact ND2-N 2.89Å; N172-A246 VanDerWaalsContact ND2-N 3.19Å; N172-A246 PolarHBondContact ND2-O 2.92Å; N172-A246 WeakPolarHBondContact O-CB 3.43Å; N172-A246 PolarHBondContact O-N 2.95Å; N172-R262 VanDerWaalsContact CB-NH1 3.28Å; N172-R262 VanDerWaalsContact OD1-CZ 3.3Å; N172-R262 PolarHBondContact OD1-NH1 2.84Å; N172-R262 VanDerWaalsContact OD1-NH1 3.12Å; N172-R262 PolarHBondContact OD1-NH2 2.93Å
173	Q	84.1	Confident	84.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.2	C	C	.	.			trans	-106.2	144.1	164.3	-71.2	175.7	-60.1	0	0	109.9	T168 L171 E177 G244	T168-Q173 WeakPolarHBondContact CA-O 3.4Å; L171-Q173 PolarHBondContact O-N 2.75Å; Q173-E177 PolarHBondContact NE2-OE1 2.88Å; Q173-G244 VanDerWaalsContact CG-CA 3.46Å
174	P	85.1	Confident	84.2	Confident	48 Å²	48	35 Å²	35	31%	0.312	21%	0.206	S	C	.	.			trans	-73.4	148.7	173.4	32.9	-34.4	0	0	0	110.9	S176 E177	P174-S176 PolarHBondContact O-N 2.75Å; P174-S176 VanDerWaalsContact O-N 3.1Å; P174-E177 WeakPolarHBondContact CD-OE2 3.46Å; P174-E177 HydrophobicContact CG-CB 4.02Å; P174-E177 PolarHBondContact O-N 2.78Å
175	Q	87.3	Confident	84.3	Confident	63 Å²	63	40.2 Å²	40.2	29%	0.294	23%	0.231	S	C	.	.	H	α-helix	trans	-58	-26.9	-180	-157	-173	-1.8	0	0	113.2	V163 V167 W178 F179	V163-Q175 HydrophobicContact CG1-CG 3.64Å; V163-Q175 PolarHBondContact O-NE2 2.74Å; V167-Q175 HydrophobicContact CG1-CB 4.46Å; Q175-W178 PolarHBondContact O-N 2.88Å; Q175-F179 HydrophobicContact CG-CD2 4.24Å; Q175-F179 HydrophobicContact CG-CE2 3.73Å; Q175-F179 VanDerWaalsContact O-CD2 3.25Å; Q175-F179 WeakPolarHBondContact O-CD2 3.5Å; Q175-F179 PolarHBondContact O-N 2.84Å
176	S	87.9	Confident	84.5	Confident	95 Å²	95	37.3 Å²	37.3	66%	0.664	22%	0.215	S	C	*	.	H	α-helix	trans	-71.5	-24.9	176.9	48.4	0	0	0	0	114.7	P174 W178	P174-S176 PolarHBondContact O-N 2.75Å; P174-S176 VanDerWaalsContact O-N 3.1Å; S176-W178 VanDerWaalsContact C-N 3.26Å
177	E	86.1	Confident	85	Confident	77 Å²	77	36.5 Å²	36.5	36%	0.36	21%	0.209	S	C	.	.	H	α-helix	trans	-73.6	-23.6	173.9	-172.3	-176.1	157.5	0	0	111.2	Q173 P174	Q173-E177 PolarHBondContact NE2-OE1 2.88Å; P174-E177 WeakPolarHBondContact CD-OE2 3.46Å; P174-E177 HydrophobicContact CG-CB 4.02Å; P174-E177 PolarHBondContact O-N 2.78Å
178	W	86.3	Confident	85.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-86.7	-40.2	-178.5	-80.1	66.6	0	0	0	112.9	F149 V160 V163 V167 L171 Q175 S176 G180 S181 L183 Q186 M241	F149-W178 AromaticContact CE2-CH2 3.9Å; F149-W178 HydrophobicContact CE2-CH2 3.9Å; F149-W178 HydrophobicContact CE2-CZ2 4.49Å; F149-W178 AromaticContact CE2-CZ3 3.96Å; F149-W178 HydrophobicContact CE2-CZ3 3.96Å; F149-W178 AromaticContact CZ-CH2 3.77Å; F149-W178 HydrophobicContact CZ-CH2 3.77Å; F149-W178 HydrophobicContact CZ-CZ2 4.26Å; F149-W178 HydrophobicContact CZ-CZ3 4.29Å; V160-W178 WeakPolarHBondContact CB-O 3.25Å; V160-W178 HydrophobicContact CG2-CE3 4.21Å; V163-W178 HydrophobicContact CB-CB 4.39Å; V163-W178 HydrophobicContact CB-CE3 4.48Å; V163-W178 HydrophobicContact CG1-CB 3.66Å; V163-W178 HydrophobicContact CG1-CG 4.4Å; V163-W178 HydrophobicContact CG2-CD2 4.3Å; V163-W178 HydrophobicContact CG2-CE3 4.18Å; V163-W178 HydrophobicContact CG2-CG 4.45Å; V167-W178 HydrophobicContact CG2-CD2 4.21Å; V167-W178 HydrophobicContact CG2-CZ2 3.97Å; L171-W178 HydrophobicContact CD1-CH2 4.18Å; L171-W178 HydrophobicContact CD1-CZ2 3.73Å; Q175-W178 PolarHBondContact O-N 2.88Å; S176-W178 VanDerWaalsContact C-N 3.26Å; W178-G180 PolarHBondContact O-N 2.96Å; W178-S181 PolarHBondContact O-N 3.07Å; W178-S181 PolarHBondContact O-OG 3.18Å; W178-L183 HydrophobicContact CZ3-CD1 4.09Å; W178-Q186 HydrophobicContact CD2-CG 4.48Å; W178-Q186 HydrophobicContact CH2-CB 4.05Å; W178-Q186 HydrophobicContact CH2-CG 4.27Å; W178-Q186 HydrophobicContact CZ2-CB 4.11Å; W178-Q186 HydrophobicContact CZ2-CG 4.14Å; W178-Q186 HydrophobicContact CZ3-CG 4.48Å; W178-M241 HydrophobicContact CH2-CE 3.59Å; W178-M241 HydrophobicContact CH2-SD 3.89Å; W178-M241 HydrophobicContact CZ3-CE 4.16Å
179	F	84.2	Confident	85.6	Confident	100 Å²	100	40.6 Å²	40.6	44%	0.439	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	121.4	179.9	-81.3	-64.6	0	0	0	111.5	V163 Q175 S181	V163-F179 HydrophobicContact CG1-CE2 4.33Å; V163-F179 HydrophobicContact CG1-CZ 4.39Å; Q175-F179 HydrophobicContact CG-CD2 4.24Å; Q175-F179 HydrophobicContact CG-CE2 3.73Å; Q175-F179 VanDerWaalsContact O-CD2 3.25Å; Q175-F179 WeakPolarHBondContact O-CD2 3.5Å; Q175-F179 PolarHBondContact O-N 2.84Å; F179-S181 VanDerWaalsContact C-N 3.32Å; F179-S181 PolarHBondContact O-N 2.87Å
180	G	73.1	Confident	86.3	Confident	45 Å²	45	41.9 Å²	41.9	46%	0.464	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	-22.2	-179.1	0	0	0	0	0	115.3	W178	W178-G180 PolarHBondContact O-N 2.96Å
181	S	86.8	Confident	86.9	Confident	14 Å²	14	41.8 Å²	41.8	10%	0.098	24%	0.235	C	C	.	.	S	Bend	trans	-66.8	162.7	173.1	73.4	0	0	0	0	112.3	V160 W178 F179	V160-S181 PolarHBondContact N-O 2.93Å; W178-S181 PolarHBondContact O-N 3.07Å; W178-S181 PolarHBondContact O-OG 3.18Å; F179-S181 VanDerWaalsContact C-N 3.32Å; F179-S181 PolarHBondContact O-N 2.87Å
182	T	90.6	Very high	87.4	Confident	37 Å²	37	43.2 Å²	43.2	23%	0.227	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-91.4	147.2	165.6	77.9	0	0	0	0	111.4	Y184 E185	T182-Y184 PolarHBondContact O-N 3.01Å; T182-Y184 VanDerWaalsContact O-N 3.13Å; T182-E185 WeakPolarHBondContact CA-OE1 3.42Å; T182-E185 WeakPolarHBondContact CB-OE1 3.49Å; T182-E185 WeakPolarHBondContact CG2-OE1 3.29Å; T182-E185 PolarHBondContact N-OE1 3.25Å; T182-E185 PolarHBondContact O-N 3.36Å; T182-E185 VanDerWaalsContact O-N 3.13Å; T182-E185 PolarHBondContact OG1-OE1 3.4Å
183	L	90.4	Very high	87.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.4	175.1	-169.3	66.1	0	0	0	112.6	F151 V153 G158 W178 E185 Q186 V187 L195 L199 M241	F151-L183 HydrophobicContact CE2-CD1 4.33Å; F151-L183 HydrophobicContact CE2-CD2 4Å; V153-L183 HydrophobicContact CG1-CB 4.11Å; V153-L183 HydrophobicContact CG1-CD1 4.47Å; V153-L183 HydrophobicContact CG1-CD2 4.19Å; V153-L183 HydrophobicContact CG2-CD2 4.16Å; G158-L183 PolarHBondContact O-N 2.88Å; W178-L183 HydrophobicContact CZ3-CD1 4.09Å; L183-E185 VanDerWaalsContact C-N 3.3Å; L183-E185 PolarHBondContact O-N 3.34Å; L183-Q186 PolarHBondContact O-N 3.03Å; L183-V187 PolarHBondContact O-N 2.85Å; L183-L195 HydrophobicContact CB-CD2 4.3Å; L183-L195 HydrophobicContact CD2-CD1 3.71Å; L183-L195 HydrophobicContact CD2-CD2 3.78Å; L183-L195 HydrophobicContact CD2-CG 4.32Å; L183-L195 HydrophobicContact CG-CD2 3.78Å; L183-L199 HydrophobicContact CD2-CD1 4.48Å; L183-M241 HydrophobicContact CD1-CE 3.41Å; L183-M241 VanDerWaalsContact CD1-CE 3.41Å; L183-M241 HydrophobicContact CG-CE 4.41Å
184	Y	90.9	Very high	88	Confident	34 Å²	34	53.5 Å²	53.5	13%	0.133	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.9	178.8	-54.5	-64.2	0	0	0	113	T182 V192 L195 R196 L199	T182-Y184 PolarHBondContact O-N 3.01Å; T182-Y184 VanDerWaalsContact O-N 3.13Å; Y184-V192 HydrophobicContact CD1-CG1 3.87Å; Y184-V192 HydrophobicContact CG-CG1 4.42Å; Y184-L195 HydrophobicContact CD1-CD2 3.76Å; Y184-L195 HydrophobicContact CD1-CG 4.3Å; Y184-L195 HydrophobicContact CE1-CD2 4.02Å; Y184-L195 HydrophobicContact CE1-CG 4.09Å; Y184-R196 HydrophobicContact CE1-CB 4.26Å; Y184-L199 HydrophobicContact CE1-CD1 4.17Å
185	E	89.3	Confident	88.1	Confident	110 Å²	110	51.3 Å²	51.3	51%	0.514	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.5	175	-66.2	146.7	-119.7	0	0	112.7	T182 L183	T182-E185 WeakPolarHBondContact CA-OE1 3.42Å; T182-E185 WeakPolarHBondContact CB-OE1 3.49Å; T182-E185 WeakPolarHBondContact CG2-OE1 3.29Å; T182-E185 PolarHBondContact N-OE1 3.25Å; T182-E185 PolarHBondContact O-N 3.36Å; T182-E185 VanDerWaalsContact O-N 3.13Å; T182-E185 PolarHBondContact OG1-OE1 3.4Å; L183-E185 VanDerWaalsContact C-N 3.3Å; L183-E185 PolarHBondContact O-N 3.34Å
186	Q	89.1	Confident	88.1	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.028	28%	0.277	C	S	.	.	S	Bend	trans	-93.4	-4.7	-175.6	-54.3	-62	-3	0	0	113.3	W178 L183 M241 R242	W178-Q186 HydrophobicContact CD2-CG 4.48Å; W178-Q186 HydrophobicContact CH2-CB 4.05Å; W178-Q186 HydrophobicContact CH2-CG 4.27Å; W178-Q186 HydrophobicContact CZ2-CB 4.11Å; W178-Q186 HydrophobicContact CZ2-CG 4.14Å; W178-Q186 HydrophobicContact CZ3-CG 4.48Å; L183-Q186 PolarHBondContact O-N 3.03Å; Q186-M241 WeakPolarHBondContact O-CA 3.49Å; Q186-R242 PolarHBondContact O-N 2.99Å
187	V	90.9	Very high	87.9	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.024	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-110.9	160.6	177.2	-60.7	0	0	0	0	112.3	L183 V192 L195 R240 M241	L183-V187 PolarHBondContact O-N 2.85Å; V187-V192 HydrophobicContact CG2-CG2 3.78Å; V187-L195 HydrophobicContact CG1-CD2 4.09Å; V187-L195 HydrophobicContact CG2-CD2 3.83Å; V187-R240 CarbonylContact C-O 3.58Å; V187-R240 VanDerWaalsContact CA-O 3.25Å; V187-R240 WeakPolarHBondContact CA-O 3.36Å; V187-R240 WeakPolarHBondContact CB-O 3.28Å; V187-M241 HydrophobicContact CG1-CE 3.95Å; V187-M241 HydrophobicContact CG1-CG 3.92Å
188	H	90	Very high	87.8	Confident	42 Å²	42	54 Å²	54	19%	0.194	27%	0.274	C	S	.	.			trans	-66.8	138.8	177.1	-165.7	-75	0	0	0	111.7	D190 D191 V192 R240 Y277	H188-D190 IonicContact CE1-OD1 2.66Å; H188-D190 PolarHBondContact CE1-OD1 3.33Å; H188-D190 IonicContact CE1-OD2 2.71Å; H188-D190 PolarHBondContact CE1-OD2 2.95Å; H188-D190 IonicContact ND1-OD1 3.15Å; H188-D190 PolarHBondContact ND1-OD1 3.01Å; H188-D190 IonicContact ND1-OD2 2.77Å; H188-D190 PolarHBondContact ND1-OD2 3.06Å; H188-D190 PolarHBondContact O-N 2.83Å; H188-D191 WeakPolarHBondContact O-CA 3.43Å; H188-D191 PolarHBondContact O-N 2.73Å; H188-V192 PolarHBondContact O-N 2.88Å; H188-R240 HydrophobicContact CB-CB 3.56Å; H188-R240 HydrophobicContact CB-CG 4.47Å; H188-R240 PolarHBondContact CE1-NH1 3.16Å; H188-R240 PolarHBondContact N-O 2.83Å; H188-R240 PolarHBondContact ND1-NH1 3.06Å; H188-R240 VanDerWaalsContact ND1-NH1 3.14Å; H188-R240 PolarHBondContact NE2-NH1 2.69Å; H188-Y277 HydrophobicContact CB-CD1 3.92Å; H188-Y277 HydrophobicContact CB-CE1 3.82Å; H188-Y277 AromaticContact CD2-CD2 3.68Å; H188-Y277 AromaticContact CD2-CE2 3.66Å; H188-Y277 AromaticContact CD2-CG 3.87Å; H188-Y277 AromaticContact CD2-CZ 3.83Å
189	P	89.3	Confident	87.5	Confident	88 Å²	88	54 Å²	54	57%	0.571	27%	0.274	S	S	*	.	H	α-helix	trans	-46.5	-53.5	-176.2	-34.2	36.9	0	0	0	115.9	D191 V192	P189-D191 PolarHBondContact O-N 2.82Å; P189-D191 VanDerWaalsContact O-N 3.1Å; P189-V192 VanDerWaalsContact O-CB 3.24Å; P189-V192 WeakPolarHBondContact O-CB 3.36Å; P189-V192 WeakPolarHBondContact O-CG2 3.46Å; P189-V192 PolarHBondContact O-N 3.31Å
190	D	90.6	Very high	86.8	Confident	95 Å²	95	51.2 Å²	51.2	51%	0.508	27%	0.266	S	S	.	.	H	α-helix	trans	-70.9	2.1	178.3	31.4	-65	0	0	0	115.4	H188 K194 R240	H188-D190 IonicContact CE1-OD1 2.66Å; H188-D190 PolarHBondContact CE1-OD1 3.33Å; H188-D190 IonicContact CE1-OD2 2.71Å; H188-D190 PolarHBondContact CE1-OD2 2.95Å; H188-D190 IonicContact ND1-OD1 3.15Å; H188-D190 PolarHBondContact ND1-OD1 3.01Å; H188-D190 IonicContact ND1-OD2 2.77Å; H188-D190 PolarHBondContact ND1-OD2 3.06Å; H188-D190 PolarHBondContact O-N 2.83Å; D190-K194 PolarHBondContact O-NZ 2.87Å; D190-R240 IonicContact OD2-CZ 2.76Å; D190-R240 IonicContact OD2-NH1 2.69Å; D190-R240 PolarHBondContact OD2-NH1 3.3Å; D190-R240 IonicContact OD2-NH2 2.64Å; D190-R240 PolarHBondContact OD2-NH2 2.64Å
191	D	92.2	Very high	86.2	Confident	14 Å²	14	53.2 Å²	53.2	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-104.8	-11.1	165.2	-66.2	-19.3	0	0	0	113.5	H188 P189 E193 K194 L195 C239 R240	H188-D191 WeakPolarHBondContact O-CA 3.43Å; H188-D191 PolarHBondContact O-N 2.73Å; P189-D191 PolarHBondContact O-N 2.82Å; P189-D191 VanDerWaalsContact O-N 3.1Å; D191-E193 VanDerWaalsContact C-N 3.31Å; D191-E193 PolarHBondContact O-N 2.93Å; D191-K194 PolarHBondContact O-N 3.21Å; D191-K194 IonicContact OD1-NZ 3.97Å; D191-K194 PolarHBondContact OD1-NZ 3.31Å; D191-L195 PolarHBondContact O-N 2.78Å; D191-C239 HydrophobicContact CB-CB 3.98Å; D191-R240 IonicContact OD1-CZ 3.54Å; D191-R240 IonicContact OD1-NE 3.48Å; D191-R240 IonicContact OD1-NH2 2.68Å; D191-R240 PolarHBondContact OD1-NH2 2.88Å; D191-R240 WeakPolarHBondContact OD2-CB 3.41Å; D191-R240 IonicContact OD2-CZ 2.87Å; D191-R240 PolarHBondContact OD2-N 3.22Å; D191-R240 IonicContact OD2-NE 2.8Å; D191-R240 PolarHBondContact OD2-NE 2.85Å; D191-R240 IonicContact OD2-NH2 3.19Å; D191-R240 PolarHBondContact OD2-NH2 3.37Å
192	V	91.2	Very high	84.4	Confident	29 Å²	29	57 Å²	57	18%	0.176	30%	0.296	C	S	.	.	H	α-helix	trans	-55.3	-43.5	179.8	168.3	0	0	0	0	112	Y184 V187 H188 P189 L195 R196	Y184-V192 HydrophobicContact CD1-CG1 3.87Å; Y184-V192 HydrophobicContact CG-CG1 4.42Å; V187-V192 HydrophobicContact CG2-CG2 3.78Å; H188-V192 PolarHBondContact O-N 2.88Å; P189-V192 VanDerWaalsContact O-CB 3.24Å; P189-V192 WeakPolarHBondContact O-CB 3.36Å; P189-V192 WeakPolarHBondContact O-CG2 3.46Å; P189-V192 PolarHBondContact O-N 3.31Å; V192-L195 WeakPolarHBondContact O-CB 3.18Å; V192-L195 PolarHBondContact O-N 3.26Å; V192-R196 WeakPolarHBondContact O-CB 3.26Å; V192-R196 PolarHBondContact O-N 2.78Å
193	E	87.9	Confident	82.2	Confident	113 Å²	113	59.1 Å²	59.1	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-73.6	-35.9	-177	-160.8	58.2	-161.1	0	0	112.1	D191 L195 R196 E197	D191-E193 VanDerWaalsContact C-N 3.31Å; D191-E193 PolarHBondContact O-N 2.93Å; E193-L195 VanDerWaalsContact C-N 3.31Å; E193-L195 PolarHBondContact O-N 2.57Å; E193-R196 WeakPolarHBondContact O-CB 3.46Å; E193-R196 PolarHBondContact O-N 3.44Å; E193-R196 IonicContact OE1-NE 2.7Å; E193-R196 WeakPolarHBondContact OE2-CD 3.23Å; E193-R196 IonicContact OE2-CZ 3.52Å; E193-R196 IonicContact OE2-NE 3.56Å; E193-R196 PolarHBondContact OE2-NE 3.13Å; E193-E197 PolarHBondContact O-N 3.46Å
194	K	88.2	Confident	79.9	Confident	109 Å²	109	64.3 Å²	64.3	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-39.4	171.7	-53.1	-178.8	-170.3	98.2	0	111.2	D190 D191 Q198	D190-K194 PolarHBondContact O-NZ 2.87Å; D191-K194 PolarHBondContact O-N 3.21Å; D191-K194 IonicContact OD1-NZ 3.97Å; D191-K194 PolarHBondContact OD1-NZ 3.31Å; K194-Q198 WeakPolarHBondContact O-CG 3.4Å; K194-Q198 PolarHBondContact O-N 3.02Å
195	L	89	Confident	77.5	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-64.7	-42.5	173.6	170.9	64.8	0	0	0	111.2	L183 Y184 V187 D191 V192 E193 E197 Q198 L199 F237	L183-L195 HydrophobicContact CB-CD2 4.3Å; L183-L195 HydrophobicContact CD2-CD1 3.71Å; L183-L195 HydrophobicContact CD2-CD2 3.78Å; L183-L195 HydrophobicContact CD2-CG 4.32Å; L183-L195 HydrophobicContact CG-CD2 3.78Å; Y184-L195 HydrophobicContact CD1-CD2 3.76Å; Y184-L195 HydrophobicContact CD1-CG 4.3Å; Y184-L195 HydrophobicContact CE1-CD2 4.02Å; Y184-L195 HydrophobicContact CE1-CG 4.09Å; V187-L195 HydrophobicContact CG1-CD2 4.09Å; V187-L195 HydrophobicContact CG2-CD2 3.83Å; D191-L195 PolarHBondContact O-N 2.78Å; V192-L195 WeakPolarHBondContact O-CB 3.18Å; V192-L195 PolarHBondContact O-N 3.26Å; E193-L195 VanDerWaalsContact C-N 3.31Å; E193-L195 PolarHBondContact O-N 2.57Å; L195-E197 PolarHBondContact O-N 3.13Å; L195-Q198 PolarHBondContact O-N 3.09Å; L195-Q198 VanDerWaalsContact O-N 3.09Å; L195-L199 HydrophobicContact CD1-CD1 3.9Å; L195-L199 HydrophobicContact CD1-CG 4.07Å; L195-L199 HydrophobicContact CG-CD1 3.97Å; L195-L199 HydrophobicContact CG-CG 4.5Å; L195-L199 WeakPolarHBondContact O-CG 3.39Å; L195-L199 PolarHBondContact O-N 3.47Å; L195-L199 VanDerWaalsContact O-N 3.1Å; L195-F237 HydrophobicContact CD1-CE2 3.58Å; L195-F237 HydrophobicContact CD1-CZ 3.58Å
196	R	87.1	Confident	75.1	Confident	88 Å²	88	68.8 Å²	68.8	33%	0.332	37%	0.367	S	S	.	.	H	α-helix	trans	-56.9	-47.5	175.4	-171.9	-177.7	-51.8	-67.2	-3.8	111.1	Y184 V192 E193 Q198 L199 C200	Y184-R196 HydrophobicContact CE1-CB 4.26Å; V192-R196 WeakPolarHBondContact O-CB 3.26Å; V192-R196 PolarHBondContact O-N 2.78Å; E193-R196 WeakPolarHBondContact O-CB 3.46Å; E193-R196 PolarHBondContact O-N 3.44Å; E193-R196 IonicContact OE1-NE 2.7Å; E193-R196 WeakPolarHBondContact OE2-CD 3.23Å; E193-R196 IonicContact OE2-CZ 3.52Å; E193-R196 IonicContact OE2-NE 3.56Å; E193-R196 PolarHBondContact OE2-NE 3.13Å; R196-Q198 PolarHBondContact O-N 3.08Å; R196-L199 PolarHBondContact O-N 2.95Å; R196-C200 VanDerWaalsContact CG-SG 3.57Å; R196-C200 VanDerWaalsContact O-CB 3.29Å; R196-C200 WeakPolarHBondContact O-CB 3.45Å; R196-C200 PolarHBondContact O-N 3.46Å; R196-C200 PolarHBondContact O-SG 3.26Å
197	E	83.9	Confident	73	Confident	146 Å²	146	73.1 Å²	73.1	68%	0.682	39%	0.394	S	S	*	.	H	α-helix	trans	-58.3	-30.6	175.1	-70.7	-175.1	155.5	0	0	114.1	E193 L195	E193-E197 PolarHBondContact O-N 3.46Å; L195-E197 PolarHBondContact O-N 3.13Å
198	Q	83.6	Confident	70.8	Confident	58 Å²	58	75.5 Å²	75.5	27%	0.271	42%	0.419	S	S	.	.	H	α-helix	trans	-79.8	-31	179	-65.9	-66	-45.8	0	0	113.2	K194 L195 R196 R235 F237	K194-Q198 WeakPolarHBondContact O-CG 3.4Å; K194-Q198 PolarHBondContact O-N 3.02Å; L195-Q198 PolarHBondContact O-N 3.09Å; L195-Q198 VanDerWaalsContact O-N 3.09Å; R196-Q198 PolarHBondContact O-N 3.08Å; Q198-R235 WeakPolarHBondContact O-CD 3.3Å; Q198-R235 PolarHBondContact O-NE 3.16Å; Q198-F237 HydrophobicContact CB-CD1 3.84Å; Q198-F237 HydrophobicContact CB-CE1 3.78Å; Q198-F237 HydrophobicContact CB-CG 4.35Å; Q198-F237 HydrophobicContact CB-CZ 4.23Å; Q198-F237 HydrophobicContact CG-CB 4.03Å; Q198-F237 HydrophobicContact CG-CD1 3.63Å; Q198-F237 HydrophobicContact CG-CD2 4.28Å; Q198-F237 HydrophobicContact CG-CE1 4.09Å; Q198-F237 HydrophobicContact CG-CG 3.74Å
199	L	79.4	Confident	68.8	Low	0 Å²	0	80.8 Å²	80.8	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-84.7	-42.5	179.1	-67.9	174.9	0	0	0	112.4	V153 L183 Y184 L195 R196 L311	V153-L199 HydrophobicContact CG2-CD2 3.95Å; L183-L199 HydrophobicContact CD2-CD1 4.48Å; Y184-L199 HydrophobicContact CE1-CD1 4.17Å; L195-L199 HydrophobicContact CD1-CD1 3.9Å; L195-L199 HydrophobicContact CD1-CG 4.07Å; L195-L199 HydrophobicContact CG-CD1 3.97Å; L195-L199 HydrophobicContact CG-CG 4.5Å; L195-L199 WeakPolarHBondContact O-CG 3.39Å; L195-L199 PolarHBondContact O-N 3.47Å; L195-L199 VanDerWaalsContact O-N 3.1Å; R196-L199 PolarHBondContact O-N 2.95Å; L199-L311 HydrophobicContact CD2-CB 4.07Å; L199-L311 HydrophobicContact CD2-CD2 3.77Å
200	C	68.5	Low	67	Low	42 Å²	42	83 Å²	83	28%	0.284	44%	0.443	S	S	.	.			trans	-64.1	142.9	-172.6	-75.5	0	0	0	0	113.9	R196 M229	R196-C200 VanDerWaalsContact CG-SG 3.57Å; R196-C200 VanDerWaalsContact O-CB 3.29Å; R196-C200 WeakPolarHBondContact O-CB 3.45Å; R196-C200 PolarHBondContact O-N 3.46Å; R196-C200 PolarHBondContact O-SG 3.26Å; C200-M229 WeakPolarHBondContact O-CE 3.45Å
201	T	60.6	Low	65.2	Low	86 Å²	86	83 Å²	83	53%	0.528	44%	0.442	S	S	.	.			trans	-90.3	-24.7	179.9	51.9	0	0	0	0	113.3	E203 M229	T201-E203 PolarHBondContact O-N 3.33Å; T201-M229 HydrophobicContact CG2-CE 3.74Å; T201-M229 HydrophobicContact CG2-CG 4.08Å; T201-M229 HydrophobicContact CG2-SD 4.2Å
202	S	50.6	Low	63.4	Low	93 Å²	93	85.5 Å²	85.5	65%	0.65	46%	0.456	S	S	*	.			trans	-76	117	179.9	53.4	0	0	0	0	111.4
203	E	44.5	Very low	61.8	Low	82 Å²	82	92.2 Å²	92.2	38%	0.383	49%	0.49	S	S	.	.			trans	-61.5	140	153.6	-61.1	-158.6	121.9	0	0	109	T201 S205 S225 R228	T201-E203 PolarHBondContact O-N 3.33Å; E203-S205 PolarHBondContact O-N 2.92Å; E203-S225 WeakPolarHBondContact OE1-CB 3.31Å; E203-S225 WeakPolarHBondContact OE2-CB 3.49Å; E203-S225 PolarHBondContact OE2-OG 2.83Å; E203-R228 IonicContact OE1-CZ 3.47Å; E203-R228 IonicContact OE1-NE 3.71Å; E203-R228 IonicContact OE1-NH2 2.94Å; E203-R228 PolarHBondContact OE1-NH2 3.19Å
204	N	41	Very low	60	Low	109 Å²	109	96.1 Å²	96.1	58%	0.583	51%	0.505	S	S	*	.			trans	-61.2	107.2	164.7	179.9	1.2	0	0	0	108	M206 T207	N204-M206 PolarHBondContact O-N 2.97Å; N204-M206 WeakPolarHBondContact OD1-CB 3.5Å; N204-M206 PolarHBondContact OD1-N 2.91Å; N204-T207 PolarHBondContact O-N 3.26Å; N204-T207 VanDerWaalsContact O-N 3.16Å; N204-T207 PolarHBondContact O-OG1 2.96Å
205	S	41.6	Very low	58.6	Low	110 Å²	110	94.9 Å²	94.9	77%	0.769	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	2.2	-171.3	57.6	0	0	0	0	114.9	E203	E203-S205 PolarHBondContact O-N 2.92Å
206	M	38.8	Very low	56.9	Low	128 Å²	128	97.2 Å²	97.2	63%	0.631	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-22.1	179.8	-144.1	63	160.1	0	0	114	N204	N204-M206 PolarHBondContact O-N 2.97Å; N204-M206 WeakPolarHBondContact OD1-CB 3.5Å; N204-M206 PolarHBondContact OD1-N 2.91Å
207	T	45	Very low	55.5	Low	98 Å²	98	97 Å²	97	60%	0.601	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-20.3	-174.4	56.9	0	0	0	0	114.4	N204 R209	N204-T207 PolarHBondContact O-N 3.26Å; N204-T207 VanDerWaalsContact O-N 3.16Å; N204-T207 PolarHBondContact O-OG1 2.96Å; T207-R209 PolarHBondContact O-N 2.72Å
208	G	43.8	Very low	53.9	Low	53 Å²	53	93.9 Å²	93.9	55%	0.546	53%	0.531	S	S	.	.	S	Bend	trans	-70.7	29.7	176	0	0	0	0	0	115.5
209	R	48.1	Very low	52.3	Low	154 Å²	154	99.1 Å²	99.1	58%	0.581	55%	0.552	S	S	*	*			trans	-127.9	62.9	-179.3	-61.8	-170.9	-162.3	-171.8	8.3	110.7	T207 L211 V218	T207-R209 PolarHBondContact O-N 2.72Å; R209-L211 PolarHBondContact O-N 3.35Å; R209-V218 HydrophobicContact CB-CG1 3.8Å; R209-V218 HydrophobicContact CG-CG1 3.96Å
210	I	51	Low	50.8	Low	133 Å²	133	108.2 Å²	108.2	68%	0.682	59%	0.592	S	S	*	*			trans	-65.1	121.8	167.4	-63.5	175.6	0	0	0	107.5
211	L	54.1	Low	49.5	Very low	95 Å²	95	113.4 Å²	113.4	50%	0.497	61%	0.612	S	S	.	*	B	Isolated β-bridge	trans	-87.5	113.4	176.3	-167.5	145.8	0	0	0	107.8	R209 L213 V218	R209-L211 PolarHBondContact O-N 3.35Å; L211-L213 PolarHBondContact O-N 3.23Å; L211-V218 HydrophobicContact CD1-CG2 4.09Å; L211-V218 HydrophobicContact CG-CG2 4.4Å
212	D	53.8	Low	48.7	Very low	68 Å²	68	111.9 Å²	111.9	36%	0.364	61%	0.614	S	S	.	*			trans	-66.7	104.4	178.7	171.1	13	0	0	0	109.4	K214 T215 G216	D212-K214 PolarHBondContact O-N 3.37Å; D212-K214 WeakPolarHBondContact OD1-CB 3.35Å; D212-K214 PolarHBondContact OD1-N 3.2Å; D212-T215 VanDerWaalsContact CG-OG1 3.27Å; D212-T215 PolarHBondContact O-N 3.32Å; D212-T215 WeakPolarHBondContact OD2-CB 3.12Å; D212-T215 WeakPolarHBondContact OD2-CG2 3.31Å; D212-T215 PolarHBondContact OD2-OG1 3.1Å; D212-G216 PolarHBondContact O-N 2.85Å
213	L	57.9	Low	48.6	Very low	169 Å²	169	114.9 Å²	114.9	89%	0.885	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-11.5	-176.8	-160.3	65.7	0	0	0	113.2	L211	L211-L213 PolarHBondContact O-N 3.23Å
214	K	50.1	Low	48.6	Very low	196 Å²	196	118.3 Å²	118.3	85%	0.852	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-18	176	-164.3	172.1	-178.5	177.8	0	113.9	D212	D212-K214 PolarHBondContact O-N 3.37Å; D212-K214 WeakPolarHBondContact OD1-CB 3.35Å; D212-K214 PolarHBondContact OD1-N 3.2Å
215	T	59.2	Low	48.6	Very low	82 Å²	82	115.9 Å²	115.9	50%	0.503	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.5	-10.8	179.5	66.1	0	0	0	0	114.8	D212 T217	D212-T215 VanDerWaalsContact CG-OG1 3.27Å; D212-T215 PolarHBondContact O-N 3.32Å; D212-T215 WeakPolarHBondContact OD2-CB 3.12Å; D212-T215 WeakPolarHBondContact OD2-CG2 3.31Å; D212-T215 PolarHBondContact OD2-OG1 3.1Å; T215-T217 PolarHBondContact O-N 3.09Å; T215-T217 VanDerWaalsContact O-N 3.13Å; T215-T217 PolarHBondContact OG1-OG1 3.33Å; T215-T217 VanDerWaalsContact OG1-OG1 3.11Å
216	G	53.7	Low	48.6	Very low	52 Å²	52	114.5 Å²	114.5	54%	0.536	62%	0.616	S	S	.	*			trans	69.6	0.1	-178.9	0	0	0	0	0	115	D212	D212-G216 PolarHBondContact O-N 2.85Å
217	T	56.5	Low	48.8	Very low	82 Å²	82	114.9 Å²	114.9	50%	0.503	62%	0.617	S	S	.	*			trans	-95.2	134.8	-175.9	61.4	0	0	0	0	112.1	T215 K219	T215-T217 PolarHBondContact O-N 3.09Å; T215-T217 VanDerWaalsContact O-N 3.13Å; T215-T217 PolarHBondContact OG1-OG1 3.33Å; T215-T217 VanDerWaalsContact OG1-OG1 3.11Å; T217-K219 PolarHBondContact O-N 2.91Å; T217-K219 VanDerWaalsContact O-N 3.14Å
218	V	50.7	Low	49	Very low	82 Å²	82	117.2 Å²	117.2	50%	0.497	62%	0.615	S	S	.	*	B	Isolated β-bridge	trans	-78.9	95.9	172.6	179.1	0	0	0	0	108.5	R209 L211	R209-V218 HydrophobicContact CB-CG1 3.8Å; R209-V218 HydrophobicContact CG-CG1 3.96Å; L211-V218 HydrophobicContact CD1-CG2 4.09Å; L211-V218 HydrophobicContact CG-CG2 4.4Å
219	K	48.8	Very low	49.5	Very low	167 Å²	167	116.4 Å²	116.4	73%	0.726	60%	0.598	S	S	*	*			trans	-90.3	111	179.9	-158.3	172.7	-173.4	178.3	0	109.6	T217 E221	T217-K219 PolarHBondContact O-N 2.91Å; T217-K219 VanDerWaalsContact O-N 3.14Å; K219-E221 PolarHBondContact O-N 3.04Å; K219-E221 VanDerWaalsContact O-N 3.08Å
220	K	48.2	Very low	49.8	Very low	192 Å²	192	112.3 Å²	112.3	84%	0.835	59%	0.592	S	S	*	*			trans	-62.9	109.3	173.6	-178.8	-179.3	179.5	-179.9	0	109
221	E	42.4	Very low	50.3	Low	150 Å²	150	113.1 Å²	113.1	70%	0.701	60%	0.595	S	S	*	*			trans	-69.7	144.7	179.6	-165	163.6	-127.6	0	0	111.4	K219	K219-E221 PolarHBondContact O-N 3.04Å; K219-E221 VanDerWaalsContact O-N 3.08Å
222	G	44.1	Very low	50.7	Low	55 Å²	55	110.8 Å²	110.8	57%	0.567	59%	0.593	S	S	*	*			trans	-91.6	120.5	-168.5	0	0	0	0	0	113.6	Q224	G222-Q224 PolarHBondContact O-N 2.87Å
223	Q	46.9	Very low	51.8	Low	156 Å²	156	108.6 Å²	108.6	73%	0.729	58%	0.583	S	S	*	*	S	Bend	trans	61.9	-15.6	151.7	-76.9	-90.2	-83.1	0	0	120	S225 S226	Q223-S225 VanDerWaalsContact C-N 3.3Å; Q223-S225 PolarHBondContact O-N 2.76Å; Q223-S226 WeakPolarHBondContact O-CB 3.28Å; Q223-S226 PolarHBondContact O-N 2.87Å
224	Q	44.2	Very low	53	Low	154 Å²	154	109.4 Å²	109.4	72%	0.72	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-64.7	-31.7	-178.1	-68	-164.7	0.7	0	0	113.5	G222 S226	G222-Q224 PolarHBondContact O-N 2.87Å; Q224-S226 VanDerWaalsContact C-N 3.26Å; Q224-S226 PolarHBondContact O-N 3.32Å
225	S	42.2	Very low	54.7	Low	57 Å²	57	101 Å²	101	40%	0.399	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-69.6	-21.2	177.8	60.9	0	0	0	0	114.7	E203 Q223 M227 R228	E203-S225 WeakPolarHBondContact OE1-CB 3.31Å; E203-S225 WeakPolarHBondContact OE2-CB 3.49Å; E203-S225 PolarHBondContact OE2-OG 2.83Å; Q223-S225 VanDerWaalsContact C-N 3.3Å; Q223-S225 PolarHBondContact O-N 2.76Å; S225-M227 PolarHBondContact O-N 3.46Å; S225-R228 PolarHBondContact O-N 2.91Å
226	S	41.9	Very low	56.1	Low	82 Å²	82	99.8 Å²	99.8	57%	0.573	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-65.6	-11	-178.4	-164.4	0	0	0	0	113.8	Q223 Q224	Q223-S226 WeakPolarHBondContact O-CB 3.28Å; Q223-S226 PolarHBondContact O-N 2.87Å; Q224-S226 VanDerWaalsContact C-N 3.26Å; Q224-S226 PolarHBondContact O-N 3.32Å
227	M	42.1	Very low	57.9	Low	135 Å²	135	98.4 Å²	98.4	67%	0.665	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-81	-11	178.2	-70.3	167.6	54.8	0	0	113.9	S225 M229 C230	S225-M227 PolarHBondContact O-N 3.46Å; M227-M229 PolarHBondContact O-N 3.34Å; M227-M229 VanDerWaalsContact O-N 3.12Å; M227-C230 PolarHBondContact O-N 3.2Å; M227-C230 PolarHBondContact O-SG 2.99Å
228	R	48.9	Very low	59.5	Low	148 Å²	148	98.9 Å²	98.9	56%	0.558	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-62.4	-24.4	-173.4	-151.6	-173.5	-64.7	-121.1	6.2	113.6	E203 S225 S233 R235	E203-R228 IonicContact OE1-CZ 3.47Å; E203-R228 IonicContact OE1-NE 3.71Å; E203-R228 IonicContact OE1-NH2 2.94Å; E203-R228 PolarHBondContact OE1-NH2 3.19Å; S225-R228 PolarHBondContact O-N 2.91Å; R228-S233 WeakPolarHBondContact O-CB 3.35Å; R228-S233 PolarHBondContact O-OG 2.79Å; R228-R235 PolarHBondContact O-NH2 2.98Å
229	M	55.6	Low	61.4	Low	36 Å²	36	95.3 Å²	95.3	18%	0.177	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-123.7	35.9	-179.6	-67.6	-59.2	-173.8	0	0	114.1	C200 T201 M227 R235 I286	C200-M229 WeakPolarHBondContact O-CE 3.45Å; T201-M229 HydrophobicContact CG2-CE 3.74Å; T201-M229 HydrophobicContact CG2-CG 4.08Å; T201-M229 HydrophobicContact CG2-SD 4.2Å; M227-M229 PolarHBondContact O-N 3.34Å; M227-M229 VanDerWaalsContact O-N 3.12Å; M229-R235 PolarHBondContact SD-NH2 3.04Å; M229-I286 HydrophobicContact SD-CG1 4.12Å; M229-I286 HydrophobicContact SD-CG2 4.34Å
230	C	53.6	Low	63.4	Low	68 Å²	68	89.5 Å²	89.5	46%	0.459	46%	0.462	S	S	.	.			trans	-59.1	143.8	159.7	-65.3	0	0	0	0	110.6	M227 G232 S233	M227-C230 PolarHBondContact O-N 3.2Å; M227-C230 PolarHBondContact O-SG 2.99Å; C230-G232 PolarHBondContact O-N 3.33Å; C230-S233 WeakPolarHBondContact O-CB 3.4Å; C230-S233 PolarHBondContact O-N 3.31Å
231	M	60.7	Low	65.3	Low	150 Å²	150	80.3 Å²	80.3	74%	0.739	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	125.9	171.3	-173.8	170.7	66.6	0	0	109.4	A288	M231-A288 HydrophobicContact SD-CB 4.27Å
232	G	62.9	Low	67.4	Low	45 Å²	45	78.1 Å²	78.1	46%	0.464	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	3.4	-169.6	0	0	0	0	0	115.2	C230 R234 I286	C230-G232 PolarHBondContact O-N 3.33Å; G232-R234 PolarHBondContact O-N 3.47Å; G232-I286 WeakPolarHBondContact CA-O 3.27Å; G232-I286 PolarHBondContact N-O 3.24Å
233	S	77.1	Confident	69.4	Low	22 Å²	22	76 Å²	76	15%	0.154	38%	0.384	C	S	.	.			trans	-58.1	120.3	175.7	-178.1	0	0	0	0	111.3	R228 C230 R235 Y285 I286	R228-S233 WeakPolarHBondContact O-CB 3.35Å; R228-S233 PolarHBondContact O-OG 2.79Å; C230-S233 WeakPolarHBondContact O-CB 3.4Å; C230-S233 PolarHBondContact O-N 3.31Å; S233-R235 PolarHBondContact OG-NH1 2.88Å; S233-Y285 CarbonylContact O-C 3.52Å; S233-Y285 VanDerWaalsContact O-CA 3.31Å; S233-Y285 WeakPolarHBondContact O-CA 3.33Å; S233-I286 PolarHBondContact O-N 3.11Å
234	R	82.8	Confident	70.8	Confident	186 Å²	186	69.1 Å²	69.1	70%	0.702	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	147.5	-174	-171.6	174.7	174	169	-3.6	111.9	G232 G284	G232-R234 PolarHBondContact O-N 3.47Å; R234-G284 CarbonylContact C-O 3.59Å; R234-G284 WeakPolarHBondContact CA-O 3.4Å; R234-G284 WeakPolarHBondContact CG-O 3.36Å
235	R	86.4	Confident	71.9	Confident	21 Å²	21	68.9 Å²	68.9	8%	0.079	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.7	167.8	-64.6	-66.8	175.8	-84.7	1.5	109.7	Q198 R228 M229 S233 F237 G284 I286 L311	Q198-R235 WeakPolarHBondContact O-CD 3.3Å; Q198-R235 PolarHBondContact O-NE 3.16Å; R228-R235 PolarHBondContact O-NH2 2.98Å; M229-R235 PolarHBondContact SD-NH2 3.04Å; S233-R235 PolarHBondContact OG-NH1 2.88Å; R235-F237 HydrophobicContact CB-CD1 4.38Å; R235-F237 HydrophobicContact CB-CE1 4.33Å; R235-G284 PolarHBondContact N-O 3.41Å; R235-G284 PolarHBondContact O-N 3.05Å; R235-I286 HydrophobicContact CG-CD1 4.23Å; R235-I286 HydrophobicContact CG-CG1 4.4Å; R235-L311 HydrophobicContact CB-CD1 4.06Å; R235-L311 HydrophobicContact CG-CD1 4.06Å
236	S	89.6	Confident	72.6	Confident	56 Å²	56	67.5 Å²	67.5	39%	0.392	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	116.5	174.8	-138.8	0	0	0	0	108	H281 C282	S236-H281 PolarHBondContact OG-NE2 2.99Å; S236-C282 VanDerWaalsContact CA-O 3.28Å; S236-C282 WeakPolarHBondContact CA-O 3.41Å
237	F	90.4	Very high	73.1	Confident	23 Å²	23	68.4 Å²	68.4	10%	0.101	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	154.2	-178.1	61.1	-88.2	0	0	0	111.7	L195 Q198 R235 H281 C282 L311 W315	L195-F237 HydrophobicContact CD1-CE2 3.58Å; L195-F237 HydrophobicContact CD1-CZ 3.58Å; Q198-F237 HydrophobicContact CB-CD1 3.84Å; Q198-F237 HydrophobicContact CB-CE1 3.78Å; Q198-F237 HydrophobicContact CB-CG 4.35Å; Q198-F237 HydrophobicContact CB-CZ 4.23Å; Q198-F237 HydrophobicContact CG-CB 4.03Å; Q198-F237 HydrophobicContact CG-CD1 3.63Å; Q198-F237 HydrophobicContact CG-CD2 4.28Å; Q198-F237 HydrophobicContact CG-CE1 4.09Å; Q198-F237 HydrophobicContact CG-CG 3.74Å; R235-F237 HydrophobicContact CB-CD1 4.38Å; R235-F237 HydrophobicContact CB-CE1 4.33Å; F237-H281 PolarHBondContact O-CD2 3.34Å; F237-C282 HydrophobicContact CD1-CB 4.18Å; F237-C282 HydrophobicContact CD2-CB 4.3Å; F237-C282 HydrophobicContact CE1-CB 3.87Å; F237-C282 WeakPolarHBondContact CE1-SG 3.13Å; F237-C282 HydrophobicContact CE2-CB 4.02Å; F237-C282 HydrophobicContact CG-CB 4.38Å; F237-C282 HydrophobicContact CZ-CB 3.78Å; F237-C282 PolarHBondContact N-O 3.37Å; F237-C282 VanDerWaalsContact N-O 3.08Å; F237-C282 PolarHBondContact O-N 2.97Å; F237-L311 HydrophobicContact CE1-CD2 4.27Å; F237-L311 HydrophobicContact CZ-CD2 4.44Å; F237-W315 HydrophobicContact CD2-CH2 4.2Å; F237-W315 AromaticContact CE2-CH2 3.51Å; F237-W315 HydrophobicContact CE2-CH2 3.51Å; F237-W315 HydrophobicContact CE2-CZ2 4.17Å; F237-W315 HydrophobicContact CE2-CZ3 4.33Å; F237-W315 HydrophobicContact CZ-CH2 4.1Å; F237-W315 HydrophobicContact CZ-CZ2 4.38Å
238	I	90.8	Very high	73.6	Confident	92 Å²	92	65.4 Å²	65.4	47%	0.472	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.7	-179.3	-57.9	168.6	0	0	0	108.1	V279 V280 H281	I238-V279 HydrophobicContact CG2-CG1 3.39Å; I238-V280 WeakPolarHBondContact CA-O 3.35Å; I238-H281 HydrophobicContact CG1-CB 4.31Å
239	C	90.8	Very high	73.4	Confident	6 Å²	6	64.4 Å²	64.4	4%	0.041	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	174.3	168.3	81.3	0	0	0	0	111.1	D191 V280 W315	D191-C239 HydrophobicContact CB-CB 3.98Å; C239-V280 PolarHBondContact N-O 2.83Å; C239-V280 WeakPolarHBondContact O-CG2 3.3Å; C239-V280 PolarHBondContact O-N 3.45Å; C239-W315 HydrophobicContact CB-CH2 4.49Å; C239-W315 WeakPolarHBondContact SG-CH2 3.4Å
240	R	89.4	Confident	73.1	Confident	45 Å²	45	71.4 Å²	71.4	17%	0.17	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.1	168.2	-71	163.9	-73.2	176.1	-8	110.3	V187 H188 D190 D191 L267 Y277 A278 V279	V187-R240 CarbonylContact C-O 3.58Å; V187-R240 VanDerWaalsContact CA-O 3.25Å; V187-R240 WeakPolarHBondContact CA-O 3.36Å; V187-R240 WeakPolarHBondContact CB-O 3.28Å; H188-R240 HydrophobicContact CB-CB 3.56Å; H188-R240 HydrophobicContact CB-CG 4.47Å; H188-R240 PolarHBondContact CE1-NH1 3.16Å; H188-R240 PolarHBondContact N-O 2.83Å; H188-R240 PolarHBondContact ND1-NH1 3.06Å; H188-R240 VanDerWaalsContact ND1-NH1 3.14Å; H188-R240 PolarHBondContact NE2-NH1 2.69Å; D190-R240 IonicContact OD2-CZ 2.76Å; D190-R240 IonicContact OD2-NH1 2.69Å; D190-R240 PolarHBondContact OD2-NH1 3.3Å; D190-R240 IonicContact OD2-NH2 2.64Å; D190-R240 PolarHBondContact OD2-NH2 2.64Å; D191-R240 IonicContact OD1-CZ 3.54Å; D191-R240 IonicContact OD1-NE 3.48Å; D191-R240 IonicContact OD1-NH2 2.68Å; D191-R240 PolarHBondContact OD1-NH2 2.88Å; D191-R240 WeakPolarHBondContact OD2-CB 3.41Å; D191-R240 IonicContact OD2-CZ 2.87Å; D191-R240 PolarHBondContact OD2-N 3.22Å; D191-R240 IonicContact OD2-NE 2.8Å; D191-R240 PolarHBondContact OD2-NE 2.85Å; D191-R240 IonicContact OD2-NH2 3.19Å; D191-R240 PolarHBondContact OD2-NH2 3.37Å; R240-L267 HydrophobicContact CG-CD1 3.48Å; R240-L267 VanDerWaalsContact CG-CD1 3.48Å; R240-Y277 HydrophobicContact CB-CD1 4.27Å; R240-A278 WeakPolarHBondContact CA-O 3.32Å; R240-V279 HydrophobicContact CG-CG2 4.47Å
241	M	88.7	Confident	72.7	Confident	0 Å²	0	75 Å²	75	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	147.1	170.9	-87.7	-173	154.3	0	0	112	F149 L171 W178 L183 Q186 V187 Y277 A278 V280 W315	F149-M241 HydrophobicContact CZ-SD 4.02Å; L171-M241 HydrophobicContact CD1-CB 4.12Å; L171-M241 HydrophobicContact CD1-SD 3.93Å; L171-M241 HydrophobicContact CD2-CB 4.39Å; W178-M241 HydrophobicContact CH2-CE 3.59Å; W178-M241 HydrophobicContact CH2-SD 3.89Å; W178-M241 HydrophobicContact CZ3-CE 4.16Å; L183-M241 HydrophobicContact CD1-CE 3.41Å; L183-M241 VanDerWaalsContact CD1-CE 3.41Å; L183-M241 HydrophobicContact CG-CE 4.41Å; Q186-M241 WeakPolarHBondContact O-CA 3.49Å; V187-M241 HydrophobicContact CG1-CE 3.95Å; V187-M241 HydrophobicContact CG1-CG 3.92Å; M241-Y277 CarbonylContact O-C 3.14Å; M241-Y277 VanDerWaalsContact O-CA 3.24Å; M241-Y277 WeakPolarHBondContact O-CA 3.12Å; M241-A278 PolarHBondContact N-O 2.97Å; M241-A278 PolarHBondContact O-N 3.43Å; M241-V280 HydrophobicContact CB-CG1 4.36Å; M241-V280 HydrophobicContact CB-CG2 3.74Å; M241-V280 HydrophobicContact CG-CG2 3.55Å; M241-V280 HydrophobicContact SD-CG2 3.8Å; M241-W315 HydrophobicContact CE-CD2 4.18Å; M241-W315 HydrophobicContact CE-CH2 4.36Å; M241-W315 HydrophobicContact CE-CZ2 3.52Å; M241-W315 VanDerWaalsContact CE-NE1 3.32Å; M241-W315 HydrophobicContact SD-CD2 3.93Å; M241-W315 HydrophobicContact SD-CE3 4.49Å; M241-W315 HydrophobicContact SD-CG 4.15Å; M241-W315 HydrophobicContact SD-CZ2 4.21Å
242	R	87.3	Confident	72.1	Confident	104 Å²	104	73 Å²	73	39%	0.392	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.2	176.8	-172.3	178.9	-177.7	-161.9	0.4	110.1	Q186 Y277	Q186-R242 PolarHBondContact O-N 2.99Å; R242-Y277 HydrophobicContact CB-CD1 4.37Å; R242-Y277 HydrophobicContact CB-CE1 4.09Å
243	C	84.3	Confident	71.4	Confident	11 Å²	11	79 Å²	79	7%	0.074	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-89.6	141	166.5	-63.4	0	0	0	0	109.4	L171 Q276	L171-C243 CarbonylContact O-C 3.39Å; L171-C243 WeakPolarHBondContact O-CA 3.46Å; C243-Q276 HydrophobicContact CB-CB 4.13Å; C243-Q276 HydrophobicContact CB-CG 4.19Å; C243-Q276 PolarHBondContact N-O 2.78Å
244	G	76.5	Confident	70.1	Confident	10 Å²	10	83.5 Å²	83.5	10%	0.103	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-93	157.7	177.6	0	0	0	0	0	113.3	L171 N172 Q173	L171-G244 PolarHBondContact O-N 3.26Å; N172-G244 WeakPolarHBondContact CB-O 3.49Å; N172-G244 PolarHBondContact ND2-O 2.87Å; N172-G244 CarbonylContact O-C 3.56Å; N172-G244 VanDerWaalsContact O-CA 3.26Å; N172-G244 WeakPolarHBondContact O-CA 3.28Å; N172-G244 VanDerWaalsContact O-O 3.13Å; Q173-G244 VanDerWaalsContact CG-CA 3.46Å
245	N	67.1	Low	68.5	Low	150 Å²	150	83.6 Å²	83.6	80%	0.802	43%	0.433	S	S	*	.			trans	-100.5	25.3	179.5	-67.7	4.5	0	0	0	112.5
246	A	57.5	Low	66.8	Low	28 Å²	28	87.3 Å²	87.3	23%	0.231	45%	0.453	C	S	.	.			trans	-57.2	129.9	-179.1	0	0	0	0	0	111.5	N172 L248	N172-A246 PolarHBondContact ND2-N 2.89Å; N172-A246 VanDerWaalsContact ND2-N 3.19Å; N172-A246 PolarHBondContact ND2-O 2.92Å; N172-A246 WeakPolarHBondContact O-CB 3.43Å; N172-A246 PolarHBondContact O-N 2.95Å; A246-L248 PolarHBondContact O-N 3.46Å
247	P	52.4	Low	64.8	Low	101 Å²	101	88.5 Å²	88.5	66%	0.656	46%	0.459	S	S	*	.			trans	-66.4	130	171.2	27.9	-32.7	0	0	0	109.4	D249	P247-D249 VanDerWaalsContact C-N 3.27Å; P247-D249 PolarHBondContact O-N 3.32Å; P247-D249 VanDerWaalsContact O-N 3.08Å
248	L	52.5	Low	63	Low	71 Å²	71	89.8 Å²	89.8	37%	0.372	47%	0.468	S	S	.	.			trans	-85.1	72.1	176.3	-71.6	179.9	0	0	0	110.5	A246 H250	A246-L248 PolarHBondContact O-N 3.46Å; L248-H250 PolarHBondContact O-N 3.17Å
249	D	45.6	Very low	61.1	Low	127 Å²	127	88.5 Å²	88.5	68%	0.679	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	120.8	171.7	-68.7	-32.6	0	0	0	110	P247	P247-D249 VanDerWaalsContact C-N 3.27Å; P247-D249 PolarHBondContact O-N 3.32Å; P247-D249 VanDerWaalsContact O-N 3.08Å
250	H	47.8	Very low	59.2	Low	184 Å²	184	94.8 Å²	94.8	85%	0.852	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	69.2	171.6	-55.7	-77.5	0	0	0	118.3	L248	L248-H250 PolarHBondContact O-N 3.17Å
251	L	46.1	Very low	57.5	Low	143 Å²	143	96.5 Å²	96.5	75%	0.749	49%	0.493	S	S	*	.			trans	-130.7	128.5	156.7	-87.8	169.9	0	0	0	112.1
252	P	49.2	Very low	55.9	Low	108 Å²	108	98.6 Å²	98.6	70%	0.701	50%	0.501	S	S	*	.			trans	-84.6	147.1	-170.9	32.6	-35.5	0	0	0	114.8	N254	P252-N254 VanDerWaalsContact C-N 3.26Å; P252-N254 PolarHBondContact O-N 3.46Å
253	L	46.6	Very low	54.2	Low	170 Å²	170	98 Å²	98	89%	0.89	50%	0.501	S	S	*	.	S	Bend	trans	56.2	-37.3	161.6	-150.5	63.7	0	0	0	119.9	R255	L253-R255 PolarHBondContact O-N 3.11Å
254	N	49.6	Very low	52.6	Low	118 Å²	118	104.4 Å²	104.4	63%	0.631	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	5.9	-178	-83.6	-31.5	0	0	0	115.1	P252 I256 T257 T258	P252-N254 VanDerWaalsContact C-N 3.26Å; P252-N254 PolarHBondContact O-N 3.46Å; N254-I256 VanDerWaalsContact C-N 3.31Å; N254-I256 PolarHBondContact O-N 3.21Å; N254-T257 PolarHBondContact O-N 3.38Å; N254-T258 PolarHBondContact O-N 3.39Å; N254-T258 PolarHBondContact O-OG1 3.18Å
255	R	50.7	Low	51.6	Low	187 Å²	187	104.2 Å²	104.2	71%	0.706	52%	0.52	S	S	*	.	H	α-helix	trans	-51.6	-43.6	-172.9	-157.4	179.8	-164.1	-173	6.5	113.2	L253 M259	L253-R255 PolarHBondContact O-N 3.11Å; R255-M259 WeakPolarHBondContact O-CB 3.43Å; R255-M259 WeakPolarHBondContact O-CG 3.2Å; R255-M259 PolarHBondContact O-N 3.11Å; R255-M259 VanDerWaalsContact O-N 3.12Å
256	I	49	Very low	51.2	Low	99 Å²	99	97.2 Å²	97.2	51%	0.508	48%	0.484	S	S	.	.	H	α-helix	trans	-66.5	-43.4	-176.1	-61.8	173.4	0	0	0	111.4	N254 R260 M328	N254-I256 VanDerWaalsContact C-N 3.31Å; N254-I256 PolarHBondContact O-N 3.21Å; I256-R260 WeakPolarHBondContact O-CB 3.42Å; I256-R260 PolarHBondContact O-N 3.34Å; I256-M328 HydrophobicContact CG2-CE 4.41Å
257	T	49	Very low	51.4	Low	82 Å²	82	100.6 Å²	100.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-65.3	-48.1	-177.7	-54.8	0	0	0	0	111.3	N254 M259 R260 K261	N254-T257 PolarHBondContact O-N 3.38Å; T257-M259 PolarHBondContact O-N 3.37Å; T257-R260 PolarHBondContact O-N 3.22Å; T257-K261 WeakPolarHBondContact O-CG 3.38Å; T257-K261 PolarHBondContact O-N 2.95Å
258	T	52.5	Low	51.7	Low	50 Å²	50	97.4 Å²	97.4	31%	0.307	48%	0.482	S	S	.	.	H	α-helix	trans	-67.1	-37.9	-179.2	-47.5	0	0	0	0	112.1	N254 K261 R262	N254-T258 PolarHBondContact O-N 3.39Å; N254-T258 PolarHBondContact O-OG1 3.18Å; T258-K261 PolarHBondContact O-N 2.9Å; T258-R262 PolarHBondContact O-N 3.47Å; T258-R262 VanDerWaalsContact O-N 3.11Å
259	M	49.8	Very low	51.8	Low	65 Å²	65	100.2 Å²	100.2	32%	0.32	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-46.5	173	-66.7	-71.4	-80	0	0	111.1	R255 T257 K261 R262 F263	R255-M259 WeakPolarHBondContact O-CB 3.43Å; R255-M259 WeakPolarHBondContact O-CG 3.2Å; R255-M259 PolarHBondContact O-N 3.11Å; R255-M259 VanDerWaalsContact O-N 3.12Å; T257-M259 PolarHBondContact O-N 3.37Å; M259-K261 VanDerWaalsContact C-N 3.31Å; M259-K261 PolarHBondContact O-N 2.95Å; M259-R262 PolarHBondContact O-N 2.9Å; M259-R262 VanDerWaalsContact O-N 3.09Å; M259-F263 HydrophobicContact CE-CE2 4.25Å; M259-F263 VanDerWaalsContact O-CD2 3.23Å; M259-F263 WeakPolarHBondContact O-CD2 3.46Å; M259-F263 PolarHBondContact O-N 2.87Å
260	R	52.6	Low	52.3	Low	137 Å²	137	97.8 Å²	97.8	52%	0.517	50%	0.495	S	S	.	.	H	α-helix	trans	-65.2	-29.8	178.7	-173.3	174.9	-74.9	171.9	-4.6	113.1	I256 T257	I256-R260 WeakPolarHBondContact O-CB 3.42Å; I256-R260 PolarHBondContact O-N 3.34Å; T257-R260 PolarHBondContact O-N 3.22Å
261	K	52.5	Low	52.8	Low	82 Å²	82	95 Å²	95	36%	0.357	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-46.4	167.8	-72.8	-163	-172.4	-166.9	0	111.5	D147 T257 T258 M259 F263 R264 N265	D147-K261 WeakPolarHBondContact OD1-CD 3.39Å; D147-K261 IonicContact OD1-NZ 3Å; D147-K261 PolarHBondContact OD1-NZ 3.42Å; D147-K261 IonicContact OD2-NZ 3.76Å; D147-K261 PolarHBondContact OD2-NZ 2.78Å; T257-K261 WeakPolarHBondContact O-CG 3.38Å; T257-K261 PolarHBondContact O-N 2.95Å; T258-K261 PolarHBondContact O-N 2.9Å; M259-K261 VanDerWaalsContact C-N 3.31Å; M259-K261 PolarHBondContact O-N 2.95Å; K261-F263 PolarHBondContact O-N 2.89Å; K261-R264 PolarHBondContact O-N 2.96Å; K261-N265 PolarHBondContact O-ND2 3.08Å
262	R	56	Low	53	Low	44 Å²	44	98 Å²	98	17%	0.166	49%	0.49	C	S	.	.	H	α-helix	trans	-59.1	-45.9	178.3	-79.6	-166.5	-86.6	171.9	-23.4	113	N172 T258 M259 R264 N265 G266	N172-R262 VanDerWaalsContact CB-NH1 3.28Å; N172-R262 VanDerWaalsContact OD1-CZ 3.3Å; N172-R262 PolarHBondContact OD1-NH1 2.84Å; N172-R262 VanDerWaalsContact OD1-NH1 3.12Å; N172-R262 PolarHBondContact OD1-NH2 2.93Å; T258-R262 PolarHBondContact O-N 3.47Å; T258-R262 VanDerWaalsContact O-N 3.11Å; M259-R262 PolarHBondContact O-N 2.9Å; M259-R262 VanDerWaalsContact O-N 3.09Å; R262-R264 VanDerWaalsContact C-N 3.31Å; R262-R264 PolarHBondContact O-N 3.29Å; R262-N265 PolarHBondContact O-N 3.44Å; R262-G266 PolarHBondContact O-N 3.02Å
263	F	51.5	Low	53.5	Low	92 Å²	92	96.9 Å²	96.9	40%	0.404	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-29	-179.5	-77.2	-69.2	0	0	0	114.4	M259 K261 N265	M259-F263 HydrophobicContact CE-CE2 4.25Å; M259-F263 VanDerWaalsContact O-CD2 3.23Å; M259-F263 WeakPolarHBondContact O-CD2 3.46Å; M259-F263 PolarHBondContact O-N 2.87Å; K261-F263 PolarHBondContact O-N 2.89Å; F263-N265 VanDerWaalsContact C-N 3.26Å; F263-N265 PolarHBondContact O-N 3Å
264	R	51.2	Low	54.6	Low	145 Å²	145	93.7 Å²	93.7	55%	0.547	48%	0.479	S	S	.	.	H	α-helix	trans	-70.3	-18.8	176.1	-77.7	-175.9	172.9	-160.9	-2.7	114.6	K261 R262 T320	K261-R264 PolarHBondContact O-N 2.96Å; R262-R264 VanDerWaalsContact C-N 3.31Å; R262-R264 PolarHBondContact O-N 3.29Å; R264-T320 PolarHBondContact O-OG1 3.25Å
265	N	54	Low	55.6	Low	6 Å²	6	90.2 Å²	90.2	3%	0.032	47%	0.467	C	S	.	.	H	α-helix	trans	-117.1	-0.8	-163.9	-56.7	-6.4	0	0	0	112.7	K261 R262 F263 A278 V279 L317 V319	K261-N265 PolarHBondContact O-ND2 3.08Å; R262-N265 PolarHBondContact O-N 3.44Å; F263-N265 VanDerWaalsContact C-N 3.26Å; F263-N265 PolarHBondContact O-N 3Å; N265-A278 VanDerWaalsContact O-CA 3.3Å; N265-A278 WeakPolarHBondContact O-CA 3.38Å; N265-A278 WeakPolarHBondContact O-CB 3.38Å; N265-V279 PolarHBondContact O-N 2.92Å; N265-L317 HydrophobicContact CB-CD1 4.39Å; N265-L317 HydrophobicContact CB-CD2 4.01Å; N265-L317 HydrophobicContact CB-CG 3.84Å; N265-L317 VanDerWaalsContact ND2-CD2 3.26Å; N265-L317 WeakPolarHBondContact ND2-CD2 3.49Å; N265-L317 VanDerWaalsContact ND2-CG 3.32Å; N265-L317 WeakPolarHBondContact ND2-CG 3.07Å; N265-V319 WeakPolarHBondContact OD1-CA 3.45Å
266	G	59.1	Low	57	Low	3 Å²	3	83.8 Å²	83.8	3%	0.031	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-86.1	152.2	171.8	0	0	0	0	0	112.7	R262 G268	R262-G266 PolarHBondContact O-N 3.02Å; G266-G268 PolarHBondContact O-N 3.04Å
267	L	62.4	Low	58.6	Low	99 Å²	99	81.5 Å²	81.5	52%	0.518	43%	0.43	S	S	.	.	S	Bend	trans	-82.1	43.9	-175.9	-72.6	175.7	0	0	0	114.9	R240 Y277 V279 T320	R240-L267 HydrophobicContact CG-CD1 3.48Å; R240-L267 VanDerWaalsContact CG-CD1 3.48Å; L267-Y277 PolarHBondContact N-O 3.44Å; L267-V279 HydrophobicContact CD1-CG2 3.97Å; L267-V279 HydrophobicContact CD2-CG2 3.65Å; L267-V279 HydrophobicContact CG-CG2 3.82Å; L267-T320 HydrophobicContact CD2-CG2 4.21Å
268	G	57.9	Low	60.2	Low	33 Å²	33	77.8 Å²	77.8	34%	0.34	41%	0.408	S	S	.	.	S	Bend	trans	101.6	-170.6	180	0	0	0	0	0	113.9	G266	G266-G268 PolarHBondContact O-N 3.04Å
269	P	54.9	Low	61.9	Low	130 Å²	130	76.2 Å²	76.2	84%	0.844	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-68.3	135	-178.2	28.3	-34.2	0	0	0	111.4	K271	P269-K271 PolarHBondContact O-N 3.39Å
270	V	56.8	Low	63.7	Low	77 Å²	77	73.1 Å²	73.1	47%	0.467	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-71	126.2	176.3	-177.9	0	0	0	0	108.9	Q276	V270-Q276 HydrophobicContact CG2-CB 3.7Å; V270-Q276 HydrophobicContact CG2-CG 3.64Å
271	K	57.9	Low	65.5	Low	126 Å²	126	69.3 Å²	69.3	55%	0.548	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-76.6	145.5	168.2	-50.9	-163.5	-147.7	77.2	0	109.4	P269 G273 E274	P269-K271 PolarHBondContact O-N 3.39Å; K271-G273 PolarHBondContact O-N 2.99Å; K271-E274 HydrophobicContact CB-CB 4.32Å; K271-E274 HydrophobicContact CB-CG 4.07Å; K271-E274 WeakPolarHBondContact CG-OE2 3.36Å; K271-E274 IonicContact NZ-OE1 2.97Å; K271-E274 PolarHBondContact NZ-OE1 2.89Å; K271-E274 IonicContact NZ-OE2 3.78Å; K271-E274 PolarHBondContact NZ-OE2 3.12Å; K271-E274 PolarHBondContact O-N 2.76Å
272	E	50.6	Low	67.3	Low	204 Å²	204	65.4 Å²	65.4	95%	0.953	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	121.4	179.9	-168	169.4	-164.6	0	0	111.1
273	G	59.5	Low	68.9	Low	86 Å²	86	64.3 Å²	64.3	89%	0.887	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-11.6	-176.1	0	0	0	0	0	116.6	K271	K271-G273 PolarHBondContact O-N 2.99Å
274	E	68.5	Low	70.7	Confident	103 Å²	103	60.4 Å²	60.4	48%	0.481	34%	0.338	S	S	.	.	S	Bend	trans	-82.8	144.4	175.4	-71.6	-177.8	180	0	0	112.1	K271 Q276	K271-E274 HydrophobicContact CB-CB 4.32Å; K271-E274 HydrophobicContact CB-CG 4.07Å; K271-E274 WeakPolarHBondContact CG-OE2 3.36Å; K271-E274 IonicContact NZ-OE1 2.97Å; K271-E274 PolarHBondContact NZ-OE1 2.89Å; K271-E274 IonicContact NZ-OE2 3.78Å; K271-E274 PolarHBondContact NZ-OE2 3.12Å; K271-E274 PolarHBondContact O-N 2.76Å; E274-Q276 PolarHBondContact O-N 3.46Å
275	A	72.1	Confident	72.4	Confident	45 Å²	45	58.2 Å²	58.2	37%	0.372	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-69.9	127.4	174.1	0	0	0	0	0	110.6	Y277	A275-Y277 HydrophobicContact CB-CE2 3.98Å; A275-Y277 WeakPolarHBondContact O-CD2 3.4Å; A275-Y277 WeakPolarHBondContact O-CE2 3.4Å
276	Q	78.9	Confident	74	Confident	51 Å²	51	58 Å²	58	24%	0.238	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-70.4	136.6	173.7	-176	174.1	12.9	0	0	110.3	C243 V270 E274	C243-Q276 HydrophobicContact CB-CB 4.13Å; C243-Q276 HydrophobicContact CB-CG 4.19Å; C243-Q276 PolarHBondContact N-O 2.78Å; V270-Q276 HydrophobicContact CG2-CB 3.7Å; V270-Q276 HydrophobicContact CG2-CG 3.64Å; E274-Q276 PolarHBondContact O-N 3.46Å
277	Y	82.9	Confident	75.1	Confident	51 Å²	51	62.5 Å²	62.5	20%	0.2	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.1	172.1	-66.7	-93.6	0	0	0	111.4	H188 R240 M241 R242 L267 A275	H188-Y277 HydrophobicContact CB-CD1 3.92Å; H188-Y277 HydrophobicContact CB-CE1 3.82Å; H188-Y277 AromaticContact CD2-CD2 3.68Å; H188-Y277 AromaticContact CD2-CE2 3.66Å; H188-Y277 AromaticContact CD2-CG 3.87Å; H188-Y277 AromaticContact CD2-CZ 3.83Å; R240-Y277 HydrophobicContact CB-CD1 4.27Å; M241-Y277 CarbonylContact O-C 3.14Å; M241-Y277 VanDerWaalsContact O-CA 3.24Å; M241-Y277 WeakPolarHBondContact O-CA 3.12Å; R242-Y277 HydrophobicContact CB-CD1 4.37Å; R242-Y277 HydrophobicContact CB-CE1 4.09Å; L267-Y277 PolarHBondContact N-O 3.44Å; A275-Y277 HydrophobicContact CB-CE2 3.98Å; A275-Y277 WeakPolarHBondContact O-CD2 3.4Å; A275-Y277 WeakPolarHBondContact O-CE2 3.4Å
278	A	83.4	Confident	75.9	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.033	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	151.7	170.7	0	0	0	0	0	111	R240 M241 N265 L317	R240-A278 WeakPolarHBondContact CA-O 3.32Å; M241-A278 PolarHBondContact N-O 2.97Å; M241-A278 PolarHBondContact O-N 3.43Å; N265-A278 VanDerWaalsContact O-CA 3.3Å; N265-A278 WeakPolarHBondContact O-CA 3.38Å; N265-A278 WeakPolarHBondContact O-CB 3.38Å; A278-L317 HydrophobicContact CB-CD1 3.73Å
279	V	86.4	Confident	76.5	Confident	17 Å²	17	62.1 Å²	62.1	10%	0.103	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.2	177.3	-177	0	0	0	0	109.8	I238 R240 N265 L267 Q318 T320	I238-V279 HydrophobicContact CG2-CG1 3.39Å; R240-V279 HydrophobicContact CG-CG2 4.47Å; N265-V279 PolarHBondContact O-N 2.92Å; L267-V279 HydrophobicContact CD1-CG2 3.97Å; L267-V279 HydrophobicContact CD2-CG2 3.65Å; L267-V279 HydrophobicContact CG-CG2 3.82Å; V279-Q318 HydrophobicContact CG1-CB 4.19Å; V279-Q318 PolarHBondContact O-N 3.19Å; V279-T320 HydrophobicContact CB-CG2 3.64Å; V279-T320 HydrophobicContact CG1-CG2 4.46Å; V279-T320 HydrophobicContact CG2-CG2 3.44Å; V279-T320 VanDerWaalsContact CG2-CG2 3.44Å
280	V	88.1	Confident	77.1	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.3	-177.5	-71.2	0	0	0	0	110.7	L171 I238 C239 M241 W315 R316 L317	L171-V280 HydrophobicContact CD2-CG1 4.35Å; I238-V280 WeakPolarHBondContact CA-O 3.35Å; C239-V280 PolarHBondContact N-O 2.83Å; C239-V280 WeakPolarHBondContact O-CG2 3.3Å; C239-V280 PolarHBondContact O-N 3.45Å; M241-V280 HydrophobicContact CB-CG1 4.36Å; M241-V280 HydrophobicContact CB-CG2 3.74Å; M241-V280 HydrophobicContact CG-CG2 3.55Å; M241-V280 HydrophobicContact SD-CG2 3.8Å; V280-W315 HydrophobicContact CB-CD2 4.31Å; V280-W315 HydrophobicContact CB-CE3 3.55Å; V280-W315 HydrophobicContact CB-CZ3 4.06Å; V280-W315 HydrophobicContact CG2-CD2 4.09Å; V280-W315 HydrophobicContact CG2-CE3 3.36Å; V280-W315 HydrophobicContact CG2-CH2 4.27Å; V280-W315 HydrophobicContact CG2-CZ3 3.46Å; V280-W315 VanDerWaalsContact CG2-CZ3 3.46Å; V280-R316 CarbonylContact C-O 3.5Å; V280-R316 WeakPolarHBondContact CA-O 3.23Å; V280-L317 HydrophobicContact CG1-CD1 3.75Å
281	H	89.9	Confident	77.3	Confident	57 Å²	57	57.5 Å²	57.5	26%	0.264	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.7	175.7	179.9	-145.7	0	0	0	109.5	S236 F237 I238 T283 R316	S236-H281 PolarHBondContact OG-NE2 2.99Å; F237-H281 PolarHBondContact O-CD2 3.34Å; I238-H281 HydrophobicContact CG1-CB 4.31Å; H281-T283 VanDerWaalsContact CE1-CG2 3.4Å; H281-T283 WeakPolarHBondContact CE1-CG2 3.26Å; H281-R316 PolarHBondContact N-O 3.26Å; H281-R316 PolarHBondContact O-N 3.38Å
282	C	91.1	Very high	77	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.1	172.2	164.9	0	0	0	0	109.1	S236 F237 W315	S236-C282 VanDerWaalsContact CA-O 3.28Å; S236-C282 WeakPolarHBondContact CA-O 3.41Å; F237-C282 HydrophobicContact CD1-CB 4.18Å; F237-C282 HydrophobicContact CD2-CB 4.3Å; F237-C282 HydrophobicContact CE1-CB 3.87Å; F237-C282 WeakPolarHBondContact CE1-SG 3.13Å; F237-C282 HydrophobicContact CE2-CB 4.02Å; F237-C282 HydrophobicContact CG-CB 4.38Å; F237-C282 HydrophobicContact CZ-CB 3.78Å; F237-C282 PolarHBondContact N-O 3.37Å; F237-C282 VanDerWaalsContact N-O 3.08Å; F237-C282 PolarHBondContact O-N 2.97Å; C282-W315 HydrophobicContact CB-CD2 3.83Å; C282-W315 HydrophobicContact CB-CE3 3.43Å; C282-W315 VanDerWaalsContact CB-CE3 3.43Å; C282-W315 HydrophobicContact CB-CH2 3.51Å; C282-W315 HydrophobicContact CB-CZ2 3.87Å; C282-W315 HydrophobicContact CB-CZ3 3.27Å; C282-W315 VanDerWaalsContact N-CZ3 3.33Å
283	T	90.1	Very high	77.1	Confident	21 Å²	21	51.3 Å²	51.3	13%	0.129	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.3	167.8	65.7	0	0	0	0	109.7	H281 A313 I314 R316	H281-T283 VanDerWaalsContact CE1-CG2 3.4Å; H281-T283 WeakPolarHBondContact CE1-CG2 3.26Å; T283-A313 WeakPolarHBondContact O-CA 3.31Å; T283-I314 PolarHBondContact N-O 3.16Å; T283-I314 PolarHBondContact O-N 2.95Å; T283-R316 PolarHBondContact OG1-NH1 3.21Å
284	G	89.7	Confident	76.7	Confident	11 Å²	11	53.6 Å²	53.6	11%	0.113	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	-162.2	-177.7	0	0	0	0	0	114.5	R234 R235 V312	R234-G284 CarbonylContact C-O 3.59Å; R234-G284 WeakPolarHBondContact CA-O 3.4Å; R234-G284 WeakPolarHBondContact CG-O 3.36Å; R235-G284 PolarHBondContact N-O 3.41Å; R235-G284 PolarHBondContact O-N 3.05Å; G284-V312 CarbonylContact C-O 3.51Å; G284-V312 WeakPolarHBondContact CA-O 3.32Å
285	Y	86.8	Confident	75.7	Confident	99 Å²	99	55.4 Å²	55.4	39%	0.388	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	152.3	-177.8	60.5	-88.1	0	0	0	112.3	S233 K287 V312	S233-Y285 CarbonylContact O-C 3.52Å; S233-Y285 VanDerWaalsContact O-CA 3.31Å; S233-Y285 WeakPolarHBondContact O-CA 3.33Å; Y285-K287 HydrophobicContact CD2-CB 4.39Å; Y285-K287 HydrophobicContact CE2-CB 4.14Å; Y285-K287 HydrophobicContact CE2-CD 4.3Å; Y285-V312 HydrophobicContact CE1-CB 4.27Å; Y285-V312 HydrophobicContact CE1-CG1 4.14Å; Y285-V312 HydrophobicContact CE2-CB 4.1Å; Y285-V312 HydrophobicContact CE2-CG2 4.45Å; Y285-V312 PolarHBondContact N-O 3.5Å; Y285-V312 PolarHBondContact O-N 2.91Å
286	I	86.1	Confident	75	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.7	174.5	-55	-58.9	0	0	0	110	M229 G232 S233 R235 Y309 C310 L311	M229-I286 HydrophobicContact SD-CG1 4.12Å; M229-I286 HydrophobicContact SD-CG2 4.34Å; G232-I286 WeakPolarHBondContact CA-O 3.27Å; G232-I286 PolarHBondContact N-O 3.24Å; S233-I286 PolarHBondContact O-N 3.11Å; R235-I286 HydrophobicContact CG-CD1 4.23Å; R235-I286 HydrophobicContact CG-CG1 4.4Å; I286-Y309 HydrophobicContact CG2-CD1 4.08Å; I286-Y309 HydrophobicContact CG2-CG 4.29Å; I286-C310 WeakPolarHBondContact CA-O 3.48Å; I286-L311 HydrophobicContact CD1-CB 4Å; I286-L311 HydrophobicContact CD1-CD1 3.97Å
287	K	83.1	Confident	73.7	Confident	96 Å²	96	59 Å²	59	42%	0.417	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	156.2	175.1	-166.8	173.1	-179.2	171.9	0	109.8	Y285 Y309 C310 V312	Y285-K287 HydrophobicContact CD2-CB 4.39Å; Y285-K287 HydrophobicContact CE2-CB 4.14Å; Y285-K287 HydrophobicContact CE2-CD 4.3Å; K287-Y309 CarbonylContact O-C 3.57Å; K287-Y309 VanDerWaalsContact O-CA 3.27Å; K287-Y309 WeakPolarHBondContact O-CA 3.46Å; K287-C310 PolarHBondContact N-O 3.09Å; K287-C310 PolarHBondContact O-N 3.11Å; K287-V312 HydrophobicContact CB-CG2 4.21Å
288	A	79	Confident	72.1	Confident	36 Å²	36	65.1 Å²	65.1	30%	0.298	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	147.5	171	0	0	0	0	0	111.4	M231 K308	M231-A288 HydrophobicContact SD-CB 4.27Å; A288-K308 WeakPolarHBondContact CA-O 3.14Å
289	W	70.6	Confident	70.6	Confident	88 Å²	88	74.2 Å²	74.2	33%	0.333	42%	0.423	S	S	.	.	S	Bend	trans	-139.9	136.1	177.5	-174.6	-99.2	0	0	0	110.4	I161 P291 I296 K308 C310	I161-W289 HydrophobicContact CD1-CD2 4.37Å; I161-W289 HydrophobicContact CD1-CG 4.44Å; I161-W289 HydrophobicContact CG2-CH2 4.11Å; I161-W289 HydrophobicContact CG2-CZ2 3.9Å; W289-P291 HydrophobicContact CE3-CG 4.26Å; W289-P291 HydrophobicContact CZ3-CG 4.06Å; W289-I296 HydrophobicContact CZ2-CD1 4.48Å; W289-K308 PolarHBondContact N-O 3.47Å; W289-K308 CarbonylContact O-C 3.55Å; W289-K308 WeakPolarHBondContact O-CA 3.22Å; W289-C310 HydrophobicContact CB-CB 4.2Å
290	P	67.1	Low	68.9	Low	64 Å²	64	77.3 Å²	77.3	42%	0.416	44%	0.439	S	S	.	.	S	Bend	cis	-65.5	164.9	-7.3	-18.4	32.8	0	0	0	113.1	I296	P290-I296 HydrophobicContact CB-CD1 4.48Å; P290-I296 HydrophobicContact CG-CD1 3.89Å; P290-I296 HydrophobicContact CG-CG1 4.35Å
291	P	61	Low	66.9	Low	47 Å²	47	80.2 Å²	80.2	31%	0.305	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-62.6	139.7	168.5	-18.6	33	0	0	0	110.8	W289 G293 M294	W289-P291 HydrophobicContact CE3-CG 4.26Å; W289-P291 HydrophobicContact CZ3-CG 4.06Å; P291-G293 PolarHBondContact O-N 3.32Å; P291-G293 VanDerWaalsContact O-N 3.1Å; P291-M294 HydrophobicContact CB-SD 4.46Å; P291-M294 HydrophobicContact CG-SD 4.12Å; P291-M294 PolarHBondContact O-N 3.35Å; P291-M294 VanDerWaalsContact O-N 3.08Å
292	A	52.1	Low	64.8	Low	113 Å²	113	85.5 Å²	85.5	93%	0.934	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	117.4	-179.7	0	0	0	0	0	111.2
293	G	51.8	Low	62.7	Low	86 Å²	86	90.5 Å²	90.5	89%	0.887	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.2	-5	-177.4	0	0	0	0	0	115.7	P291	P291-G293 PolarHBondContact O-N 3.32Å; P291-G293 VanDerWaalsContact O-N 3.1Å
294	M	51.1	Low	60.5	Low	135 Å²	135	92.2 Å²	92.2	67%	0.665	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-101	116.1	172.7	-81.3	-179.9	155.2	0	0	112	P291	P291-M294 HydrophobicContact CB-SD 4.46Å; P291-M294 HydrophobicContact CG-SD 4.12Å; P291-M294 PolarHBondContact O-N 3.35Å; P291-M294 VanDerWaalsContact O-N 3.08Å
295	T	48.8	Very low	58.5	Low	140 Å²	140	101 Å²	101	86%	0.859	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-85.4	124.3	162.9	48.9	0	0	0	0	109.4
296	I	57.3	Low	56.7	Low	76 Å²	76	97.9 Å²	97.9	39%	0.39	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-76.6	142.7	171.8	-59.7	178.1	0	0	0	108.1	W289 P290 D300	W289-I296 HydrophobicContact CZ2-CD1 4.48Å; P290-I296 HydrophobicContact CB-CD1 4.48Å; P290-I296 HydrophobicContact CG-CD1 3.89Å; P290-I296 HydrophobicContact CG-CG1 4.35Å; I296-D300 HydrophobicContact CG2-CB 3.93Å
297	P	50.8	Low	55.3	Low	97 Å²	97	99.1 Å²	99.1	63%	0.63	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-56.2	145.3	172.5	-24.8	35.2	0	0	0	112.4	E299 D300	P297-E299 PolarHBondContact O-N 3.32Å; P297-E299 VanDerWaalsContact O-N 3.09Å; P297-D300 PolarHBondContact O-N 3.12Å
298	E	50	Low	54.7	Low	179 Å²	179	101.4 Å²	101.4	84%	0.836	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-66.4	-16.2	-169.4	-64.3	-172.9	128.7	0	0	114.3	D300 A301	E298-D300 VanDerWaalsContact C-N 3.27Å; E298-D300 PolarHBondContact O-N 3.05Å; E298-A301 VanDerWaalsContact O-CB 3.27Å; E298-A301 WeakPolarHBondContact O-CB 3.35Å; E298-A301 PolarHBondContact O-N 3.1Å
299	E	51.3	Low	54.9	Low	194 Å²	194	104 Å²	104	91%	0.907	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-65.7	-20.2	175.5	-65.2	-174.3	116.5	0	0	114.5	P297	P297-E299 PolarHBondContact O-N 3.32Å; P297-E299 VanDerWaalsContact O-N 3.09Å
300	D	50.3	Low	55.7	Low	83 Å²	83	99.9 Å²	99.9	44%	0.444	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-99.1	-2.8	171.9	-119.5	-43.3	0	0	0	112.1	R159 I296 P297 E298	R159-D300 IonicContact CZ-OD1 2.67Å; R159-D300 IonicContact NH1-OD1 3Å; R159-D300 PolarHBondContact NH1-OD1 2.87Å; R159-D300 VanDerWaalsContact NH1-OD1 3.11Å; R159-D300 IonicContact NH2-OD1 2.71Å; I296-D300 HydrophobicContact CG2-CB 3.93Å; P297-D300 PolarHBondContact O-N 3.12Å; E298-D300 VanDerWaalsContact C-N 3.27Å; E298-D300 PolarHBondContact O-N 3.05Å
301	A	47.1	Very low	56.8	Low	61 Å²	61	96.9 Å²	96.9	50%	0.504	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-73.7	-30.5	-169.5	0	0	0	0	0	114.1	E298 V303	E298-A301 VanDerWaalsContact O-CB 3.27Å; E298-A301 WeakPolarHBondContact O-CB 3.35Å; E298-A301 PolarHBondContact O-N 3.1Å; A301-V303 PolarHBondContact O-N 2.86Å
302	D	45.2	Very low	58.2	Low	168 Å²	168	95.7 Å²	95.7	90%	0.898	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-71.8	-11.2	-178.1	-110.8	-5.9	0	0	0	113.6
303	V	47.4	Very low	60	Low	105 Å²	105	90.4 Å²	90.4	64%	0.636	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-104.4	6.4	-169.4	-164	0	0	0	0	113.4	A301	A301-V303 PolarHBondContact O-N 2.86Å
304	G	44.2	Very low	61.8	Low	56 Å²	56	87.8 Å²	87.8	58%	0.577	48%	0.482	S	S	*	.			trans	166.7	105.2	162.9	0	0	0	0	0	119.2	G306	G304-G306 PolarHBondContact O-N 2.94Å
305	Q	47.3	Very low	63.6	Low	196 Å²	196	81.4 Å²	81.4	92%	0.916	45%	0.45	S	S	*	.	S	Bend	trans	-71.1	1.4	161.8	-64.9	-174.9	-11	0	0	114.3
306	G	49.2	Very low	65.5	Low	34 Å²	34	78.6 Å²	78.6	35%	0.351	42%	0.424	S	S	.	.			trans	-84.8	-64.7	-168.7	0	0	0	0	0	115.7	E156 G304 K308	E156-G306 WeakPolarHBondContact OE2-CA 3.41Å; G304-G306 PolarHBondContact O-N 2.94Å; G306-K308 VanDerWaalsContact C-N 3.33Å; G306-K308 PolarHBondContact O-N 3.44Å
307	S	56.5	Low	66.6	Low	27 Å²	27	75.9 Å²	75.9	19%	0.189	41%	0.41	C	S	.	.			trans	-78.5	71.7	-157.5	-165.2	0	0	0	0	114.7	A155 E156 Y309	A155-S307 PolarHBondContact N-OG 2.85Å; E156-S307 PolarHBondContact N-OG 3.45Å; E156-S307 PolarHBondContact OE2-N 3.37Å; E156-S307 VanDerWaalsContact OE2-N 3.11Å; S307-Y309 PolarHBondContact O-N 3.03Å; S307-Y309 PolarHBondContact OG-O 2.85Å
308	K	71.3	Confident	68	Low	144 Å²	144	74.7 Å²	74.7	63%	0.626	40%	0.396	S	S	*	.			trans	-57.5	-6.9	173.5	-68.2	169.8	-173.8	173.1	0	115	A288 W289 G306	A288-K308 WeakPolarHBondContact CA-O 3.14Å; W289-K308 PolarHBondContact N-O 3.47Å; W289-K308 CarbonylContact O-C 3.55Å; W289-K308 WeakPolarHBondContact O-CA 3.22Å; G306-K308 VanDerWaalsContact C-N 3.33Å; G306-K308 PolarHBondContact O-N 3.44Å
309	Y	82.2	Confident	68.7	Low	91 Å²	91	70.8 Å²	70.8	36%	0.357	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.9	-177.6	-58.4	-77.1	0	0	0	111.6	A155 I286 K287 S307	A155-Y309 WeakPolarHBondContact CB-O 3.49Å; A155-Y309 PolarHBondContact N-O 3.1Å; I286-Y309 HydrophobicContact CG2-CD1 4.08Å; I286-Y309 HydrophobicContact CG2-CG 4.29Å; K287-Y309 CarbonylContact O-C 3.57Å; K287-Y309 VanDerWaalsContact O-CA 3.27Å; K287-Y309 WeakPolarHBondContact O-CA 3.46Å; S307-Y309 PolarHBondContact O-N 3.03Å; S307-Y309 PolarHBondContact OG-O 2.85Å
310	C	88.3	Confident	69	Low	2 Å²	2	62.6 Å²	62.6	1%	0.014	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152	170.4	64.4	0	0	0	0	110.9	V152 V153 I161 I286 K287 W289	V152-C310 HydrophobicContact CG1-CB 3.83Å; V153-C310 CarbonylContact O-C 3.54Å; V153-C310 WeakPolarHBondContact O-CA 3.44Å; V153-C310 WeakPolarHBondContact O-CB 3.46Å; I161-C310 HydrophobicContact CD1-CB 4.11Å; I286-C310 WeakPolarHBondContact CA-O 3.48Å; K287-C310 PolarHBondContact N-O 3.09Å; K287-C310 PolarHBondContact O-N 3.11Å; W289-C310 HydrophobicContact CB-CB 4.2Å
311	L	89.4	Confident	69	Low	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.5	167.2	172.5	62.6	0	0	0	108.1	F151 V152 V153 L199 R235 F237 I286 A313	F151-L311 HydrophobicContact CZ-CD2 4.21Å; V152-L311 VanDerWaalsContact CA-O 3.3Å; V152-L311 WeakPolarHBondContact CA-O 3.49Å; V153-L311 HydrophobicContact CG2-CB 3.93Å; V153-L311 HydrophobicContact CG2-CD2 4.43Å; V153-L311 PolarHBondContact N-O 2.94Å; V153-L311 VanDerWaalsContact N-O 3.16Å; V153-L311 PolarHBondContact O-N 3.31Å; L199-L311 HydrophobicContact CD2-CB 4.07Å; L199-L311 HydrophobicContact CD2-CD2 3.77Å; R235-L311 HydrophobicContact CB-CD1 4.06Å; R235-L311 HydrophobicContact CG-CD1 4.06Å; F237-L311 HydrophobicContact CE1-CD2 4.27Å; F237-L311 HydrophobicContact CZ-CD2 4.44Å; I286-L311 HydrophobicContact CD1-CB 4Å; I286-L311 HydrophobicContact CD1-CD1 3.97Å; L311-A313 HydrophobicContact CD1-CB 4.04Å; L311-A313 HydrophobicContact CD2-CB 4.3Å; L311-A313 HydrophobicContact CG-CB 3.89Å
312	V	89.8	Confident	69	Low	23 Å²	23	63.7 Å²	63.7	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.5	170	179.4	0	0	0	0	107.7	V152 G284 Y285 K287	V152-V312 HydrophobicContact CG1-CG2 4.08Å; V152-V312 HydrophobicContact CG2-CG1 4.36Å; V152-V312 HydrophobicContact CG2-CG2 4.14Å; G284-V312 CarbonylContact C-O 3.51Å; G284-V312 WeakPolarHBondContact CA-O 3.32Å; Y285-V312 HydrophobicContact CE1-CB 4.27Å; Y285-V312 HydrophobicContact CE1-CG1 4.14Å; Y285-V312 HydrophobicContact CE2-CB 4.1Å; Y285-V312 HydrophobicContact CE2-CG2 4.45Å; Y285-V312 PolarHBondContact N-O 3.5Å; Y285-V312 PolarHBondContact O-N 2.91Å; K287-V312 HydrophobicContact CB-CG2 4.21Å
313	A	90.4	Very high	69.1	Low	2 Å²	2	60.5 Å²	60.5	2%	0.017	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	159.4	-168.6	0	0	0	0	0	114	L150 F151 T283 L311	L150-A313 WeakPolarHBondContact CD1-O 3.34Å; F151-A313 HydrophobicContact CD1-CB 4.06Å; F151-A313 WeakPolarHBondContact CD1-O 3.31Å; F151-A313 HydrophobicContact CE1-CB 3.29Å; F151-A313 HydrophobicContact CZ-CB 3.63Å; F151-A313 PolarHBondContact N-O 3Å; F151-A313 PolarHBondContact O-N 3.37Å; F151-A313 VanDerWaalsContact O-O 3.13Å; T283-A313 WeakPolarHBondContact O-CA 3.31Å; L311-A313 HydrophobicContact CD1-CB 4.04Å; L311-A313 HydrophobicContact CD2-CB 4.3Å; L311-A313 HydrophobicContact CG-CB 3.89Å
314	I	90.3	Very high	68.9	Low	31 Å²	31	59.8 Å²	59.8	16%	0.159	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.7	172.2	-60.9	172.3	0	0	0	107.6	I142 F149 L150 T283 R316	I142-I314 HydrophobicContact CG2-CD1 4.2Å; F149-I314 WeakPolarHBondContact O-CA 3.36Å; L150-I314 HydrophobicContact CD1-CG1 3.8Å; T283-I314 PolarHBondContact N-O 3.16Å; T283-I314 PolarHBondContact O-N 2.95Å; I314-R316 HydrophobicContact CG2-CG 4.11Å
315	W	88.6	Confident	68.8	Low	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128.8	161.6	-73.1	111.8	0	0	0	108.7	G148 F149 F151 F237 C239 M241 V280 C282	G148-W315 CarbonylContact C-O 3.43Å; G148-W315 WeakPolarHBondContact CA-O 3.41Å; F149-W315 HydrophobicContact CD1-CB 3.99Å; F149-W315 HydrophobicContact CE1-CB 3.59Å; F149-W315 HydrophobicContact CE1-CG 4.11Å; F149-W315 HydrophobicContact CE2-CB 4.34Å; F149-W315 AromaticContact CE2-CD1 3.54Å; F149-W315 HydrophobicContact CE2-CG 4.28Å; F149-W315 HydrophobicContact CZ-CB 3.79Å; F149-W315 AromaticContact CZ-CD1 3.39Å; F149-W315 AromaticContact CZ-CG 3.81Å; F149-W315 HydrophobicContact CZ-CG 3.81Å; F149-W315 PolarHBondContact N-O 3.14Å; F149-W315 PolarHBondContact O-N 2.94Å; F151-W315 AromaticContact CD1-CD1 3.17Å; F151-W315 HydrophobicContact CD1-CG 4.08Å; F151-W315 AromaticContact CD1-NE1 3.43Å; F151-W315 AromaticContact CD2-NE1 3.95Å; F151-W315 AromaticContact CE1-CD1 3.13Å; F151-W315 HydrophobicContact CE1-CD2 4.15Å; F151-W315 AromaticContact CE1-CE2 3.72Å; F151-W315 AromaticContact CE1-CG 3.81Å; F151-W315 HydrophobicContact CE1-CG 3.81Å; F151-W315 AromaticContact CE1-NE1 3.02Å; F151-W315 AromaticContact CE2-NE1 3.61Å; F151-W315 AromaticContact CG-CD1 3.85Å; F151-W315 AromaticContact CG-NE1 3.88Å; F151-W315 AromaticContact CZ-CD1 3.78Å; F151-W315 AromaticContact CZ-CE2 3.68Å; F151-W315 HydrophobicContact CZ-CZ2 4.12Å; F151-W315 AromaticContact CZ-NE1 3.13Å; F237-W315 HydrophobicContact CD2-CH2 4.2Å; F237-W315 AromaticContact CE2-CH2 3.51Å; F237-W315 HydrophobicContact CE2-CH2 3.51Å; F237-W315 HydrophobicContact CE2-CZ2 4.17Å; F237-W315 HydrophobicContact CE2-CZ3 4.33Å; F237-W315 HydrophobicContact CZ-CH2 4.1Å; F237-W315 HydrophobicContact CZ-CZ2 4.38Å; C239-W315 HydrophobicContact CB-CH2 4.49Å; C239-W315 WeakPolarHBondContact SG-CH2 3.4Å; M241-W315 HydrophobicContact CE-CD2 4.18Å; M241-W315 HydrophobicContact CE-CH2 4.36Å; M241-W315 HydrophobicContact CE-CZ2 3.52Å; M241-W315 VanDerWaalsContact CE-NE1 3.32Å; M241-W315 HydrophobicContact SD-CD2 3.93Å; M241-W315 HydrophobicContact SD-CE3 4.49Å; M241-W315 HydrophobicContact SD-CG 4.15Å; M241-W315 HydrophobicContact SD-CZ2 4.21Å; V280-W315 HydrophobicContact CB-CD2 4.31Å; V280-W315 HydrophobicContact CB-CE3 3.55Å; V280-W315 HydrophobicContact CB-CZ3 4.06Å; V280-W315 HydrophobicContact CG2-CD2 4.09Å; V280-W315 HydrophobicContact CG2-CE3 3.36Å; V280-W315 HydrophobicContact CG2-CH2 4.27Å; V280-W315 HydrophobicContact CG2-CZ3 3.46Å; V280-W315 VanDerWaalsContact CG2-CZ3 3.46Å; C282-W315 HydrophobicContact CB-CD2 3.83Å; C282-W315 HydrophobicContact CB-CE3 3.43Å; C282-W315 VanDerWaalsContact CB-CE3 3.43Å; C282-W315 HydrophobicContact CB-CH2 3.51Å; C282-W315 HydrophobicContact CB-CZ2 3.87Å; C282-W315 HydrophobicContact CB-CZ3 3.27Å; C282-W315 VanDerWaalsContact N-CZ3 3.33Å
316	R	87.5	Confident	68.7	Low	81 Å²	81	58.7 Å²	58.7	31%	0.306	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.7	166.3	-63.1	-169.3	179.1	70.3	6.2	109.5	A146 V280 H281 T283 I314 Q318	A146-R316 HydrophobicContact CB-CG 4.03Å; A146-R316 VanDerWaalsContact CB-NE 3.31Å; A146-R316 WeakPolarHBondContact O-CB 3.36Å; A146-R316 WeakPolarHBondContact O-CD 3.15Å; A146-R316 VanDerWaalsContact O-CG 3.28Å; A146-R316 WeakPolarHBondContact O-CG 3.19Å; V280-R316 CarbonylContact C-O 3.5Å; V280-R316 WeakPolarHBondContact CA-O 3.23Å; H281-R316 PolarHBondContact N-O 3.26Å; H281-R316 PolarHBondContact O-N 3.38Å; T283-R316 PolarHBondContact OG1-NH1 3.21Å; I314-R316 HydrophobicContact CG2-CG 4.11Å; R316-Q318 PolarHBondContact O-N 2.87Å
317	L	82.3	Confident	68.4	Low	19 Å²	19	59.8 Å²	59.8	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	110.3	175.8	-161.3	65.6	0	0	0	108.4	D147 V170 L171 N265 A278 V280	D147-L317 WeakPolarHBondContact O-CB 3.4Å; D147-L317 PolarHBondContact O-N 3.44Å; V170-L317 HydrophobicContact CG1-CB 4Å; V170-L317 HydrophobicContact CG1-CD1 4.3Å; V170-L317 HydrophobicContact CG1-CD2 4.28Å; V170-L317 HydrophobicContact CG1-CG 4.42Å; L171-L317 HydrophobicContact CD2-CD1 4.2Å; N265-L317 HydrophobicContact CB-CD1 4.39Å; N265-L317 HydrophobicContact CB-CD2 4.01Å; N265-L317 HydrophobicContact CB-CG 3.84Å; N265-L317 VanDerWaalsContact ND2-CD2 3.26Å; N265-L317 WeakPolarHBondContact ND2-CD2 3.49Å; N265-L317 VanDerWaalsContact ND2-CG 3.32Å; N265-L317 WeakPolarHBondContact ND2-CG 3.07Å; A278-L317 HydrophobicContact CB-CD1 3.73Å; V280-L317 HydrophobicContact CG1-CD1 3.75Å
318	Q	78.5	Confident	67.9	Low	72 Å²	72	62.3 Å²	62.3	34%	0.336	34%	0.338	S	S	.	.			trans	-82.6	125.3	-173.7	-177.8	169.5	-18	0	0	109.3	V279 R316 T320	V279-Q318 HydrophobicContact CG1-CB 4.19Å; V279-Q318 PolarHBondContact O-N 3.19Å; R316-Q318 PolarHBondContact O-N 2.87Å; Q318-T320 PolarHBondContact O-N 2.94Å
319	V	66.4	Low	66.3	Low	98 Å²	98	60.4 Å²	60.4	59%	0.594	34%	0.335	S	S	*	.			trans	-65.2	105	170.4	-176.8	0	0	0	0	108.3	N265	N265-V319 WeakPolarHBondContact OD1-CA 3.45Å
320	T	57.4	Low	64.5	Low	22 Å²	22	60.3 Å²	60.3	14%	0.135	36%	0.362	C	S	.	.			trans	-68.3	141.7	169.4	49.8	0	0	0	0	109.1	R264 L267 V279 Q318 S322	R264-T320 PolarHBondContact O-OG1 3.25Å; L267-T320 HydrophobicContact CD2-CG2 4.21Å; V279-T320 HydrophobicContact CB-CG2 3.64Å; V279-T320 HydrophobicContact CG1-CG2 4.46Å; V279-T320 HydrophobicContact CG2-CG2 3.44Å; V279-T320 VanDerWaalsContact CG2-CG2 3.44Å; Q318-T320 PolarHBondContact O-N 2.94Å; T320-S322 PolarHBondContact O-N 2.92Å; T320-S322 WeakPolarHBondContact OG1-CB 3.49Å
321	S	49.1	Very low	62.2	Low	127 Å²	127	67.8 Å²	67.8	89%	0.888	40%	0.398	S	S	*	.			trans	-73.4	35.3	166.2	62.8	0	0	0	0	111.9
322	S	47	Very low	60.4	Low	40 Å²	40	69.3 Å²	69.3	28%	0.28	41%	0.409	S	S	.	.			trans	-63.1	132.8	173.6	-164.9	0	0	0	0	107.6	T320 V324	T320-S322 PolarHBondContact O-N 2.92Å; T320-S322 WeakPolarHBondContact OG1-CB 3.49Å; S322-V324 PolarHBondContact O-N 2.87Å
323	P	47.1	Very low	59	Low	100 Å²	100	72.4 Å²	72.4	65%	0.649	43%	0.428	S	S	*	.			trans	-57.7	128.2	-179.3	24.6	-33.4	0	0	0	109	C325	P323-C325 PolarHBondContact O-N 2.91Å
324	V	44.9	Very low	57.8	Low	90 Å²	90	73.7 Å²	73.7	55%	0.545	44%	0.436	S	S	.	.			trans	-62.5	103.7	-170.2	-179	0	0	0	0	109.9	S322 M326	S322-V324 PolarHBondContact O-N 2.87Å; V324-M326 HydrophobicContact CG1-CE 4.24Å; V324-M326 HydrophobicContact CG1-CG 4.48Å; V324-M326 HydrophobicContact CG1-SD 4.3Å; V324-M326 PolarHBondContact O-N 2.92Å; V324-M326 VanDerWaalsContact O-N 3.11Å
325	C	42.3	Very low	57.4	Low	72 Å²	72	72.7 Å²	72.7	49%	0.486	43%	0.431	S	S	.	.			trans	-66	110.5	162	55.2	0	0	0	0	107.8	P323 D327	P323-C325 PolarHBondContact O-N 2.91Å; C325-D327 PolarHBondContact O-N 2.91Å
326	M	44.5	Very low	57.4	Low	158 Å²	158	75.6 Å²	75.6	78%	0.778	45%	0.445	S	S	*	.			trans	-72.9	-14.7	172.2	-77.2	-69	-176.5	0	0	111.9	V324 M328	V324-M326 HydrophobicContact CG1-CE 4.24Å; V324-M326 HydrophobicContact CG1-CG 4.48Å; V324-M326 HydrophobicContact CG1-SD 4.3Å; V324-M326 PolarHBondContact O-N 2.92Å; V324-M326 VanDerWaalsContact O-N 3.11Å; M326-M328 VanDerWaalsContact C-N 3.34Å; M326-M328 PolarHBondContact O-N 3.19Å
327	D	43	Very low	57.6	Low	56 Å²	56	72 Å²	72	30%	0.299	43%	0.432	S	S	.	.			trans	-73.4	78.4	-171.8	-61.3	-1.2	0	0	0	111.2	C325 N329 S332	C325-D327 PolarHBondContact O-N 2.91Å; D327-N329 PolarHBondContact O-N 2.94Å; D327-N329 VanDerWaalsContact O-N 3.16Å; D327-S332 WeakPolarHBondContact CB-OG 3.39Å
328	M	45	Very low	58.2	Low	80 Å²	80	73.7 Å²	73.7	39%	0.394	44%	0.44	S	S	.	.			trans	-71	-0.9	179.9	-113.8	-169.6	73.4	0	0	114.5	I256 M326	I256-M328 HydrophobicContact CG2-CE 4.41Å; M326-M328 VanDerWaalsContact C-N 3.34Å; M326-M328 PolarHBondContact O-N 3.19Å
329	N	37.9	Very low	59	Low	104 Å²	104	70.5 Å²	70.5	56%	0.556	43%	0.426	S	S	*	.	S	Bend	trans	-122	129.2	173	-92.1	4.9	0	0	0	110	D327 M331 S332	D327-N329 PolarHBondContact O-N 2.94Å; D327-N329 VanDerWaalsContact O-N 3.16Å; N329-M331 PolarHBondContact O-N 2.89Å; N329-S332 PolarHBondContact O-N 2.82Å; N329-S332 PolarHBondContact O-OG 2.85Å; N329-S332 VanDerWaalsContact O-OG 3.06Å
330	G	44.9	Very low	60.5	Low	89 Å²	89	69.8 Å²	69.8	92%	0.918	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	17.5	170.9	0	0	0	0	0	115.6
331	M	41	Very low	62.3	Low	160 Å²	160	68.8 Å²	68.8	79%	0.788	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-11.9	177.3	-85	80.5	83.3	0	0	113.4	N329 V333	N329-M331 PolarHBondContact O-N 2.89Å; M331-V333 PolarHBondContact O-N 2.88Å
332	S	51.4	Low	64.4	Low	31 Å²	31	64.6 Å²	64.6	22%	0.217	37%	0.374	C	S	.	.			trans	-77.2	110.1	176.3	47	0	0	0	0	110.6	D327 N329 Q444	D327-S332 WeakPolarHBondContact CB-OG 3.39Å; N329-S332 PolarHBondContact O-N 2.82Å; N329-S332 PolarHBondContact O-OG 2.85Å; N329-S332 VanDerWaalsContact O-OG 3.06Å; S332-Q444 VanDerWaalsContact CB-NE2 3.35Å
333	V	59.5	Low	66.3	Low	88 Å²	88	66.2 Å²	66.2	53%	0.533	39%	0.385	S	S	.	.			trans	-56.6	131	164.4	-176.8	0	0	0	0	107.9	M331 T335 Q440	M331-V333 PolarHBondContact O-N 2.88Å; V333-T335 PolarHBondContact O-N 2.97Å; V333-Q440 PolarHBondContact O-NE2 3.5Å
334	P	65.5	Low	68.3	Low	30 Å²	30	66.3 Å²	66.3	20%	0.195	38%	0.38	C	S	.	.			trans	-52.7	125.4	-178.6	-29.3	35.5	0	0	0	111.5	R353 V357 Q440	P334-R353 HydrophobicContact CB-CB 4.49Å; P334-R353 HydrophobicContact CB-CG 4.45Å; P334-V357 HydrophobicContact CB-CG2 4.38Å; P334-V357 WeakPolarHBondContact O-CG2 3.45Å; P334-Q440 VanDerWaalsContact C-NE2 3.32Å; P334-Q440 PolarHBondContact O-NE2 2.83Å
335	T	81.6	Confident	70.5	Confident	9 Å²	9	62.1 Å²	62.1	6%	0.055	36%	0.355	C	S	.	.			trans	-92	-15.1	-179.5	54.3	0	0	0	0	112.7	V333 T436 N437 Q440	V333-T335 PolarHBondContact O-N 2.97Å; T335-T436 WeakPolarHBondContact O-CA 3.27Å; T335-N437 PolarHBondContact O-N 3.1Å; T335-Q440 HydrophobicContact CG2-CB 4.26Å; T335-Q440 HydrophobicContact CG2-CG 3.92Å
336	E	89.4	Confident	73	Confident	61 Å²	61	61.2 Å²	61.2	29%	0.285	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	156	-174.2	55.3	144.6	-115.8	0	0	114.1	R353 N435 T436	E336-R353 PolarHBondContact O-NH1 3.34Å; E336-R353 IonicContact OE1-CZ 2.96Å; E336-R353 IonicContact OE1-NH1 3.83Å; E336-R353 PolarHBondContact OE1-NH1 2.87Å; E336-R353 IonicContact OE1-NH2 2.66Å; E336-R353 PolarHBondContact OE1-NH2 3.34Å; E336-N435 CarbonylContact C-O 3.57Å; E336-N435 WeakPolarHBondContact CA-O 3.25Å; E336-N435 WeakPolarHBondContact CB-O 3.22Å; E336-T436 HydrophobicContact CB-CG2 4.22Å
337	F	91.9	Very high	75.5	Confident	7 Å²	7	54 Å²	54	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.9	171.9	70.3	-83.3	0	0	0	111.3	V350 D351 R353 C354 V357 I358 I413 N435	F337-V350 HydrophobicContact CD2-CG1 3.78Å; F337-V350 HydrophobicContact CE2-CG1 3.97Å; F337-D351 HydrophobicContact CB-CB 4.38Å; F337-R353 HydrophobicContact CB-CB 3.88Å; F337-C354 HydrophobicContact CB-CB 4.22Å; F337-C354 HydrophobicContact CD1-CB 4.35Å; F337-C354 HydrophobicContact CD2-CB 3.66Å; F337-C354 HydrophobicContact CE2-CB 4.07Å; F337-C354 HydrophobicContact CG-CB 3.82Å; F337-V357 HydrophobicContact CB-CG2 4.48Å; F337-V357 HydrophobicContact CD1-CB 3.81Å; F337-V357 HydrophobicContact CD1-CG1 3.87Å; F337-V357 HydrophobicContact CD1-CG2 4.05Å; F337-V357 HydrophobicContact CE1-CB 4.33Å; F337-V357 HydrophobicContact CE1-CG1 4.12Å; F337-I358 HydrophobicContact CE1-CD1 3.96Å; F337-I358 HydrophobicContact CE1-CG1 4.19Å; F337-I358 HydrophobicContact CE1-CG2 4Å; F337-I358 HydrophobicContact CE2-CD1 4.19Å; F337-I358 HydrophobicContact CZ-CD1 3.57Å; F337-I358 HydrophobicContact CZ-CG1 4.29Å; F337-I413 HydrophobicContact CE1-CD1 4.44Å; F337-N435 HydrophobicContact CD1-CB 4Å; F337-N435 HydrophobicContact CD2-CB 4.42Å; F337-N435 HydrophobicContact CE1-CB 3.59Å; F337-N435 HydrophobicContact CE2-CB 4.04Å; F337-N435 HydrophobicContact CG-CB 4.4Å; F337-N435 HydrophobicContact CZ-CB 3.6Å; F337-N435 PolarHBondContact N-O 2.91Å; F337-N435 WeakPolarHBondContact O-CB 3.09Å; F337-N435 PolarHBondContact O-N 3.24Å; F337-N435 PolarHBondContact O-ND2 3.27Å
338	L	94.1	Very high	78	Confident	54 Å²	54	54.7 Å²	54.7	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	146.2	174.2	-62.5	168.6	0	0	0	111.2	D351 T434	L338-D351 HydrophobicContact CB-CB 3.99Å; L338-D351 WeakPolarHBondContact O-CB 3.3Å; L338-D351 PolarHBondContact O-N 3.2Å; L338-T434 HydrophobicContact CD2-CG2 4.26Å; L338-T434 WeakPolarHBondContact CD2-OG1 3.35Å
339	S	96.1	Very high	80.4	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.028	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	157.3	164.2	51.7	0	0	0	0	110.6	H341 F349 C433 N435	S339-H341 PolarHBondContact OG-NE2 3.1Å; S339-F349 CarbonylContact C-O 3.58Å; S339-F349 WeakPolarHBondContact CA-O 3.19Å; S339-F349 WeakPolarHBondContact CB-O 3.49Å; S339-C433 PolarHBondContact N-O 3.1Å; S339-C433 PolarHBondContact O-N 3.37Å; S339-N435 PolarHBondContact OG-ND2 3.05Å
340	R	96.3	Very high	83.1	Confident	84 Å²	84	50.3 Å²	50.3	32%	0.317	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146	167.3	-56.9	-178	-74.5	158.1	-0.8	109.6	T348 F349 Y430 I431 I432	R340-T348 PolarHBondContact O-N 2.91Å; R340-T348 PolarHBondContact O-OG1 3.29Å; R340-F349 HydrophobicContact CB-CB 3.95Å; R340-F349 HydrophobicContact CG-CB 4.19Å; R340-F349 HydrophobicContact CG-CD1 4.2Å; R340-F349 PolarHBondContact N-O 3.09Å; R340-F349 PolarHBondContact O-N 3.24Å; R340-Y430 HydrophobicContact CB-CD2 4.36Å; R340-Y430 HydrophobicContact CB-CG 4.44Å; R340-Y430 HydrophobicContact CG-CD2 4.08Å; R340-I431 VanDerWaalsContact CA-O 3.28Å; R340-I431 WeakPolarHBondContact CA-O 3.45Å; R340-I432 HydrophobicContact CG-CG1 4.49Å
341	H	95.6	Very high	85.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.3	-175.3	-55.1	-109.7	0	0	0	108.9	S339 I346 F386 Y430 I431 C433	S339-H341 PolarHBondContact OG-NE2 3.1Å; H341-I346 CarbonylContact C-O 3.51Å; H341-I346 VanDerWaalsContact CA-O 3.22Å; H341-I346 WeakPolarHBondContact CA-O 3.45Å; H341-F386 HydrophobicContact CB-CE1 3.9Å; H341-F386 AromaticContact CG-CE1 3.86Å; H341-F386 AromaticContact ND1-CZ 3.91Å; H341-Y430 CarbonylContact O-C 3.57Å; H341-Y430 VanDerWaalsContact O-CA 3.28Å; H341-Y430 WeakPolarHBondContact O-CA 3.32Å; H341-Y430 VanDerWaalsContact O-CB 3.32Å; H341-Y430 WeakPolarHBondContact O-CB 3.42Å; H341-I431 HydrophobicContact CB-CB 4.41Å; H341-I431 PolarHBondContact N-O 2.87Å; H341-I431 PolarHBondContact O-N 3Å; H341-C433 PolarHBondContact CD2-SG 3.11Å
342	N	92.5	Very high	87.4	Confident	39 Å²	39	43.4 Å²	43.4	21%	0.209	24%	0.24	C	C	.	.			trans	-77.7	-175.5	166.9	82.4	-19.3	0	0	0	111.1	D344 G345 I346 T348	N342-D344 PolarHBondContact ND2-OD2 3.08Å; N342-D344 PolarHBondContact O-N 2.89Å; N342-D344 VanDerWaalsContact O-N 3.15Å; N342-D344 WeakPolarHBondContact OD1-CA 3.3Å; N342-D344 WeakPolarHBondContact OD1-CB 3.37Å; N342-D344 PolarHBondContact OD1-N 3.16Å; N342-G345 PolarHBondContact O-N 3.35Å; N342-G345 PolarHBondContact OD1-N 3.05Å; N342-I346 PolarHBondContact N-O 2.76Å; N342-I346 WeakPolarHBondContact OD1-CB 3.24Å; N342-I346 PolarHBondContact OD1-N 2.97Å; N342-T348 HydrophobicContact CB-CG2 4.16Å
343	S	87.5	Confident	89.1	Confident	74 Å²	74	44.8 Å²	44.8	52%	0.517	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.1	175.4	47.7	0	0	0	0	114.8
344	D	89.1	Confident	90.5	Very high	101 Å²	101	40.6 Å²	40.6	54%	0.54	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-7.5	-166.7	-38.3	-40.7	0	0	0	112.3	N342 I346	N342-D344 PolarHBondContact ND2-OD2 3.08Å; N342-D344 PolarHBondContact O-N 2.89Å; N342-D344 VanDerWaalsContact O-N 3.15Å; N342-D344 WeakPolarHBondContact OD1-CA 3.3Å; N342-D344 WeakPolarHBondContact OD1-CB 3.37Å; N342-D344 PolarHBondContact OD1-N 3.16Å; D344-I346 HydrophobicContact CB-CG1 4.47Å
345	G	90.4	Very high	91.7	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	95.8	8	-175.2	0	0	0	0	0	114.7	N342 I370	N342-G345 PolarHBondContact O-N 3.35Å; N342-G345 PolarHBondContact OD1-N 3.05Å; G345-I370 PolarHBondContact O-N 3.04Å
346	I	95.8	Very high	91.9	Very high	54 Å²	54	45.2 Å²	45.2	28%	0.277	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-77.6	127	176.6	-51.6	-56.4	0	0	0	110.1	H341 N342 D344 T348 K368 D369	H341-I346 CarbonylContact C-O 3.51Å; H341-I346 VanDerWaalsContact CA-O 3.22Å; H341-I346 WeakPolarHBondContact CA-O 3.45Å; N342-I346 PolarHBondContact N-O 2.76Å; N342-I346 WeakPolarHBondContact OD1-CB 3.24Å; N342-I346 PolarHBondContact OD1-N 2.97Å; D344-I346 HydrophobicContact CB-CG1 4.47Å; I346-T348 PolarHBondContact O-N 3.05Å; I346-K368 WeakPolarHBondContact CA-O 3.21Å; I346-D369 HydrophobicContact CD1-CB 3.91Å
347	I	96.8	Very high	91.8	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	113.2	-177.5	-60.2	167.9	0	0	0	110.2	V350 L365 G367 K368 I370 F373	I347-V350 HydrophobicContact CG2-CG2 3.33Å; I347-L365 HydrophobicContact CD1-CB 4.27Å; I347-L365 HydrophobicContact CG2-CB 4.5Å; I347-G367 PolarHBondContact O-N 3.41Å; I347-K368 PolarHBondContact N-O 3.41Å; I347-I370 HydrophobicContact CD1-CD1 4.21Å; I347-F373 HydrophobicContact CD1-CD2 4.47Å; I347-F373 HydrophobicContact CD1-CE2 4.3Å
348	T	95.8	Very high	91.8	Very high	71 Å²	71	42.4 Å²	42.4	44%	0.436	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-17.9	-179	59.2	0	0	0	0	113.7	R340 N342 I346 L366	R340-T348 PolarHBondContact O-N 2.91Å; R340-T348 PolarHBondContact O-OG1 3.29Å; N342-T348 HydrophobicContact CB-CG2 4.16Å; I346-T348 PolarHBondContact O-N 3.05Å; T348-L366 VanDerWaalsContact C-CD2 3.5Å; T348-L366 WeakPolarHBondContact O-CD2 3.29Å
349	F	96.1	Very high	91.6	Very high	83 Å²	83	41.6 Å²	41.6	36%	0.364	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	144.3	175.6	173.5	-95.4	0	0	0	110.7	S339 R340	S339-F349 CarbonylContact C-O 3.58Å; S339-F349 WeakPolarHBondContact CA-O 3.19Å; S339-F349 WeakPolarHBondContact CB-O 3.49Å; R340-F349 HydrophobicContact CB-CB 3.95Å; R340-F349 HydrophobicContact CG-CB 4.19Å; R340-F349 HydrophobicContact CG-CD1 4.2Å; R340-F349 PolarHBondContact N-O 3.09Å; R340-F349 PolarHBondContact O-N 3.24Å
350	V	94.2	Very high	91.5	Very high	8 Å²	8	42.7 Å²	42.7	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	135.6	168.4	-163.5	0	0	0	0	110.4	F337 I347 C354 P362 L365	F337-V350 HydrophobicContact CD2-CG1 3.78Å; F337-V350 HydrophobicContact CE2-CG1 3.97Å; I347-V350 HydrophobicContact CG2-CG2 3.33Å; V350-C354 HydrophobicContact CG1-CB 3.62Å; V350-P362 HydrophobicContact CB-CB 4.46Å; V350-L365 HydrophobicContact CB-CD1 4.47Å; V350-L365 HydrophobicContact CG1-CD1 3.98Å; V350-L365 HydrophobicContact CG2-CB 3.96Å; V350-L365 HydrophobicContact CG2-CD1 4.04Å
351	D	88.3	Confident	91.4	Very high	22 Å²	22	42.2 Å²	42.2	12%	0.118	24%	0.24	C	C	.	.			trans	-67.2	130.3	170.7	179.7	-25.1	0	0	0	110.9	F337 L338 R353 C354	F337-D351 HydrophobicContact CB-CB 4.38Å; L338-D351 HydrophobicContact CB-CB 3.99Å; L338-D351 WeakPolarHBondContact O-CB 3.3Å; L338-D351 PolarHBondContact O-N 3.2Å; D351-R353 PolarHBondContact O-N 3.1Å; D351-R353 WeakPolarHBondContact OD1-CB 3.39Å; D351-R353 WeakPolarHBondContact OD1-CG 2.99Å; D351-R353 PolarHBondContact OD1-N 2.77Å; D351-R353 IonicContact OD1-NE 2.97Å; D351-R353 PolarHBondContact OD1-NE 2.99Å; D351-R353 IonicContact OD2-CZ 2.72Å; D351-R353 IonicContact OD2-NE 3.39Å; D351-R353 PolarHBondContact OD2-NE 2.87Å; D351-R353 IonicContact OD2-NH2 3.04Å; D351-R353 PolarHBondContact OD2-NH2 3.38Å; D351-C354 WeakPolarHBondContact O-CB 3.42Å; D351-C354 PolarHBondContact O-N 3.08Å; D351-C354 PolarHBondContact O-SG 3.03Å
352	P	87.3	Confident	91.3	Very high	83 Å²	83	43.2 Å²	43.2	54%	0.539	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-19.6	177.8	-28.7	36.2	0	0	0	115.9	C354 I355	P352-C354 PolarHBondContact O-N 3.19Å; P352-C354 VanDerWaalsContact O-N 3.07Å; P352-I355 WeakPolarHBondContact O-CB 3.28Å; P352-I355 WeakPolarHBondContact O-CG1 2.92Å; P352-I355 PolarHBondContact O-N 3.12Å; P352-I355 VanDerWaalsContact O-N 3.08Å
353	R	86.5	Confident	91.4	Very high	60 Å²	60	47.6 Å²	47.6	23%	0.226	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-22	170	-71.1	-175	-69.5	158.8	2.6	113.3	P334 E336 F337 D351 I355 S356 V357	P334-R353 HydrophobicContact CB-CB 4.49Å; P334-R353 HydrophobicContact CB-CG 4.45Å; E336-R353 PolarHBondContact O-NH1 3.34Å; E336-R353 IonicContact OE1-CZ 2.96Å; E336-R353 IonicContact OE1-NH1 3.83Å; E336-R353 PolarHBondContact OE1-NH1 2.87Å; E336-R353 IonicContact OE1-NH2 2.66Å; E336-R353 PolarHBondContact OE1-NH2 3.34Å; F337-R353 HydrophobicContact CB-CB 3.88Å; D351-R353 PolarHBondContact O-N 3.1Å; D351-R353 WeakPolarHBondContact OD1-CB 3.39Å; D351-R353 WeakPolarHBondContact OD1-CG 2.99Å; D351-R353 PolarHBondContact OD1-N 2.77Å; D351-R353 IonicContact OD1-NE 2.97Å; D351-R353 PolarHBondContact OD1-NE 2.99Å; D351-R353 IonicContact OD2-CZ 2.72Å; D351-R353 IonicContact OD2-NE 3.39Å; D351-R353 PolarHBondContact OD2-NE 2.87Å; D351-R353 IonicContact OD2-NH2 3.04Å; D351-R353 PolarHBondContact OD2-NH2 3.38Å; R353-I355 PolarHBondContact O-N 3.28Å; R353-I355 VanDerWaalsContact O-N 3.15Å; R353-S356 PolarHBondContact O-N 3.5Å; R353-S356 VanDerWaalsContact O-N 3.07Å; R353-V357 WeakPolarHBondContact O-CG2 3.33Å; R353-V357 PolarHBondContact O-N 3.49Å; R353-V357 VanDerWaalsContact O-N 3.14Å
354	C	89.9	Confident	91.7	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.2	-27.7	174.1	70.1	0	0	0	0	113.6	F337 V350 D351 P352 S356 V357 I358 G359 Y360 L365	F337-C354 HydrophobicContact CB-CB 4.22Å; F337-C354 HydrophobicContact CD1-CB 4.35Å; F337-C354 HydrophobicContact CD2-CB 3.66Å; F337-C354 HydrophobicContact CE2-CB 4.07Å; F337-C354 HydrophobicContact CG-CB 3.82Å; V350-C354 HydrophobicContact CG1-CB 3.62Å; D351-C354 WeakPolarHBondContact O-CB 3.42Å; D351-C354 PolarHBondContact O-N 3.08Å; D351-C354 PolarHBondContact O-SG 3.03Å; P352-C354 PolarHBondContact O-N 3.19Å; P352-C354 VanDerWaalsContact O-N 3.07Å; C354-S356 VanDerWaalsContact C-N 3.34Å; C354-S356 PolarHBondContact O-N 3.5Å; C354-V357 PolarHBondContact O-N 3.35Å; C354-I358 HydrophobicContact CB-CD1 4.2Å; C354-I358 HydrophobicContact CB-CG1 4.07Å; C354-I358 WeakPolarHBondContact O-CG1 3.48Å; C354-I358 PolarHBondContact O-N 3.41Å; C354-G359 PolarHBondContact O-N 2.9Å; C354-Y360 PolarHBondContact SG-O 2.87Å; C354-L365 HydrophobicContact CB-CD1 4.41Å
355	I	89.8	Confident	92	Very high	64 Å²	64	41.4 Å²	41.4	33%	0.328	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-45.4	176.4	-58.7	163.6	0	0	0	110	P352 R353 G359 Y360 Q361	P352-I355 WeakPolarHBondContact O-CB 3.28Å; P352-I355 WeakPolarHBondContact O-CG1 2.92Å; P352-I355 PolarHBondContact O-N 3.12Å; P352-I355 VanDerWaalsContact O-N 3.08Å; R353-I355 PolarHBondContact O-N 3.28Å; R353-I355 VanDerWaalsContact O-N 3.15Å; I355-G359 WeakPolarHBondContact O-CA 3.11Å; I355-G359 PolarHBondContact O-N 3.19Å; I355-G359 VanDerWaalsContact O-N 3.1Å; I355-Y360 VanDerWaalsContact CA-O 3.32Å; I355-Y360 WeakPolarHBondContact CA-O 3.4Å; I355-Y360 WeakPolarHBondContact CG1-O 3.34Å; I355-Y360 PolarHBondContact N-O 2.94Å; I355-Q361 VanDerWaalsContact CD1-OE1 3.29Å
356	S	86.5	Confident	92.3	Very high	71 Å²	71	45 Å²	45	50%	0.497	25%	0.245	S	C	.	.	H	α-helix	trans	-76.5	-31.9	179.6	-52.8	0	0	0	0	113.2	R353 C354	R353-S356 PolarHBondContact O-N 3.5Å; R353-S356 VanDerWaalsContact O-N 3.07Å; C354-S356 VanDerWaalsContact C-N 3.34Å; C354-S356 PolarHBondContact O-N 3.5Å
357	V	87.6	Confident	92.2	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.03	26%	0.261	C	S	.	.	H	α-helix	trans	-84.3	-42.3	-175.8	-173.6	0	0	0	0	112.6	P334 F337 R353 C354 M411 N437	P334-V357 HydrophobicContact CB-CG2 4.38Å; P334-V357 WeakPolarHBondContact O-CG2 3.45Å; F337-V357 HydrophobicContact CB-CG2 4.48Å; F337-V357 HydrophobicContact CD1-CB 3.81Å; F337-V357 HydrophobicContact CD1-CG1 3.87Å; F337-V357 HydrophobicContact CD1-CG2 4.05Å; F337-V357 HydrophobicContact CE1-CB 4.33Å; F337-V357 HydrophobicContact CE1-CG1 4.12Å; R353-V357 WeakPolarHBondContact O-CG2 3.33Å; R353-V357 PolarHBondContact O-N 3.49Å; R353-V357 VanDerWaalsContact O-N 3.14Å; C354-V357 PolarHBondContact O-N 3.35Å; V357-M411 WeakPolarHBondContact O-CE 3.36Å; V357-N437 HydrophobicContact CG1-CB 4.01Å
358	I	91.6	Very high	92.2	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-128.5	-0.6	-172	56.3	170.1	0	0	0	114.8	F337 C354 Y360 L365 F403 T405 K406 M411 I413	F337-I358 HydrophobicContact CE1-CD1 3.96Å; F337-I358 HydrophobicContact CE1-CG1 4.19Å; F337-I358 HydrophobicContact CE1-CG2 4Å; F337-I358 HydrophobicContact CE2-CD1 4.19Å; F337-I358 HydrophobicContact CZ-CD1 3.57Å; F337-I358 HydrophobicContact CZ-CG1 4.29Å; C354-I358 HydrophobicContact CB-CD1 4.2Å; C354-I358 HydrophobicContact CB-CG1 4.07Å; C354-I358 WeakPolarHBondContact O-CG1 3.48Å; C354-I358 PolarHBondContact O-N 3.41Å; I358-Y360 HydrophobicContact CB-CD2 4.3Å; I358-Y360 HydrophobicContact CD1-CD2 4.01Å; I358-Y360 HydrophobicContact CG1-CD2 4.13Å; I358-Y360 WeakPolarHBondContact O-CD2 3.4Å; I358-Y360 PolarHBondContact O-N 2.8Å; I358-L365 HydrophobicContact CD1-CD1 3.94Å; I358-F403 HydrophobicContact CB-CD1 4.43Å; I358-F403 HydrophobicContact CB-CE1 4.02Å; I358-F403 HydrophobicContact CD1-CE1 3.56Å; I358-F403 HydrophobicContact CD1-CE2 4.49Å; I358-F403 HydrophobicContact CD1-CZ 3.54Å; I358-F403 HydrophobicContact CG1-CE1 4.36Å; I358-F403 HydrophobicContact CG2-CD1 3.99Å; I358-F403 HydrophobicContact CG2-CE1 3.99Å; I358-T405 HydrophobicContact CB-CG2 4.06Å; I358-T405 HydrophobicContact CG2-CG2 4.08Å; I358-K406 PolarHBondContact O-N 3.39Å; I358-K406 VanDerWaalsContact O-N 3.08Å; I358-M411 HydrophobicContact CG2-SD 4.23Å; I358-I413 HydrophobicContact CG2-CD1 3.7Å
359	G	90.4	Very high	92.2	Very high	36 Å²	36	46.9 Å²	46.9	37%	0.371	26%	0.264	S	S	.	.	S	Bend	trans	79.4	-7.2	175.9	0	0	0	0	0	115.6	C354 I355 K406	C354-G359 PolarHBondContact O-N 2.9Å; I355-G359 WeakPolarHBondContact O-CA 3.11Å; I355-G359 PolarHBondContact O-N 3.19Å; I355-G359 VanDerWaalsContact O-N 3.1Å; G359-K406 WeakPolarHBondContact O-CD 3.47Å
360	Y	93.9	Very high	92.1	Very high	28 Å²	28	43.3 Å²	43.3	11%	0.11	25%	0.248	C	C	.	.			trans	-83.4	144.5	179.4	-71.9	-78.4	0	0	0	112.4	C354 I355 I358 D364 L365 F373 F403 R404 K406	C354-Y360 PolarHBondContact SG-O 2.87Å; I355-Y360 VanDerWaalsContact CA-O 3.32Å; I355-Y360 WeakPolarHBondContact CA-O 3.4Å; I355-Y360 WeakPolarHBondContact CG1-O 3.34Å; I355-Y360 PolarHBondContact N-O 2.94Å; I358-Y360 HydrophobicContact CB-CD2 4.3Å; I358-Y360 HydrophobicContact CD1-CD2 4.01Å; I358-Y360 HydrophobicContact CG1-CD2 4.13Å; I358-Y360 WeakPolarHBondContact O-CD2 3.4Å; I358-Y360 PolarHBondContact O-N 2.8Å; Y360-D364 HydrophobicContact CD1-CB 3.68Å; Y360-D364 HydrophobicContact CG-CB 4.43Å; Y360-L365 HydrophobicContact CD1-CD2 4.19Å; Y360-L365 HydrophobicContact CD2-CD2 4.01Å; Y360-L365 HydrophobicContact CG-CD2 3.77Å; Y360-L365 HydrophobicContact CG-CG 4.25Å; Y360-F373 HydrophobicContact CE1-CE1 4.01Å; Y360-F373 HydrophobicContact CE2-CD1 4.07Å; Y360-F373 HydrophobicContact CE2-CE1 4.13Å; Y360-F373 AromaticContact CZ-CD1 3.99Å; Y360-F373 AromaticContact CZ-CE1 3.75Å; Y360-F403 HydrophobicContact CD2-CE1 4.25Å; Y360-F403 HydrophobicContact CE2-CE1 4.03Å; Y360-R404 VanDerWaalsContact CE2-O 3.29Å; Y360-R404 WeakPolarHBondContact CE2-O 3.14Å; Y360-R404 PolarHBondContact OH-O 2.9Å; Y360-K406 HydrophobicContact CD1-CB 3.99Å; Y360-K406 HydrophobicContact CD1-CD 4.08Å; Y360-K406 HydrophobicContact CD1-CG 4.05Å; Y360-K406 HydrophobicContact CD2-CB 4.12Å; Y360-K406 HydrophobicContact CE1-CB 3.93Å; Y360-K406 HydrophobicContact CE1-CD 4.48Å; Y360-K406 HydrophobicContact CE1-CG 3.98Å; Y360-K406 HydrophobicContact CE2-CB 4.07Å; Y360-K406 VanDerWaalsContact CE2-N 3.29Å; Y360-K406 HydrophobicContact CG-CB 4.1Å
361	Q	93.8	Very high	92.1	Very high	73 Å²	73	43.3 Å²	43.3	34%	0.341	25%	0.248	S	C	.	.			trans	-77.8	151.1	163.6	-69.2	-70.3	-18.3	0	0	109.5	I355 Q363 D364	I355-Q361 VanDerWaalsContact CD1-OE1 3.29Å; Q361-Q363 VanDerWaalsContact C-N 3.26Å; Q361-Q363 HydrophobicContact CB-CG 4.47Å; Q361-Q363 PolarHBondContact O-N 3.38Å; Q361-D364 PolarHBondContact N-OD2 2.69Å; Q361-D364 VanDerWaalsContact O-CB 3.29Å; Q361-D364 WeakPolarHBondContact O-CB 3.32Å; Q361-D364 PolarHBondContact O-N 2.64Å
362	P	93.6	Very high	92.4	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.143	26%	0.263	C	S	.	.	H	α-helix	trans	-52.7	-41.4	178.2	-29	36.4	0	0	0	113.4	V350 D364 L365 L366	V350-P362 HydrophobicContact CB-CB 4.46Å; P362-D364 PolarHBondContact O-N 2.9Å; P362-L365 PolarHBondContact O-N 3.05Å; P362-L366 WeakPolarHBondContact O-CG 3.43Å; P362-L366 PolarHBondContact O-N 3.38Å
363	Q	94.4	Very high	92.8	Very high	132 Å²	132	43 Å²	43	62%	0.617	24%	0.238	S	C	*	.	H	α-helix	trans	-68.2	-14.4	175.9	69.9	-82.9	11	0	0	115	Q361 L365	Q361-Q363 VanDerWaalsContact C-N 3.26Å; Q361-Q363 HydrophobicContact CB-CG 4.47Å; Q361-Q363 PolarHBondContact O-N 3.38Å; Q363-L365 VanDerWaalsContact C-N 3.27Å
364	D	94.8	Very high	93.3	Very high	41 Å²	41	40.3 Å²	40.3	22%	0.219	23%	0.229	C	C	.	.	H	α-helix	trans	-76	-19.1	171.3	-59.5	-33.5	0	0	0	111.9	Y360 Q361 P362 K368 K406	Y360-D364 HydrophobicContact CD1-CB 3.68Å; Y360-D364 HydrophobicContact CG-CB 4.43Å; Q361-D364 PolarHBondContact N-OD2 2.69Å; Q361-D364 VanDerWaalsContact O-CB 3.29Å; Q361-D364 WeakPolarHBondContact O-CB 3.32Å; Q361-D364 PolarHBondContact O-N 2.64Å; P362-D364 PolarHBondContact O-N 2.9Å; D364-K368 WeakPolarHBondContact O-CE 3.19Å; D364-K368 PolarHBondContact O-NZ 3.42Å; D364-K406 IonicContact OD1-NZ 3.86Å; D364-K406 IonicContact OD2-NZ 2.68Å; D364-K406 PolarHBondContact OD2-NZ 2.84Å
365	L	95.4	Very high	93.6	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-110.3	-35.7	-171.2	-60.2	174.2	0	0	0	113.2	I347 V350 C354 I358 Y360 P362 Q363 K368 F373	I347-L365 HydrophobicContact CD1-CB 4.27Å; I347-L365 HydrophobicContact CG2-CB 4.5Å; V350-L365 HydrophobicContact CB-CD1 4.47Å; V350-L365 HydrophobicContact CG1-CD1 3.98Å; V350-L365 HydrophobicContact CG2-CB 3.96Å; V350-L365 HydrophobicContact CG2-CD1 4.04Å; C354-L365 HydrophobicContact CB-CD1 4.41Å; I358-L365 HydrophobicContact CD1-CD1 3.94Å; Y360-L365 HydrophobicContact CD1-CD2 4.19Å; Y360-L365 HydrophobicContact CD2-CD2 4.01Å; Y360-L365 HydrophobicContact CG-CD2 3.77Å; Y360-L365 HydrophobicContact CG-CG 4.25Å; P362-L365 PolarHBondContact O-N 3.05Å; Q363-L365 VanDerWaalsContact C-N 3.27Å; L365-K368 PolarHBondContact O-N 3.15Å; L365-F373 HydrophobicContact CD2-CD1 4.09Å; L365-F373 HydrophobicContact CD2-CE1 3.49Å; L365-F373 VanDerWaalsContact CD2-CE1 3.49Å; L365-F373 HydrophobicContact CD2-CE2 4.05Å; L365-F373 HydrophobicContact CD2-CZ 3.48Å; L365-F373 VanDerWaalsContact CD2-CZ 3.48Å
366	L	96.3	Very high	93.9	Very high	79 Å²	79	42.9 Å²	42.9	41%	0.414	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	136.5	-178	-73	166.4	0	0	0	112.2	T348 P362 K368	T348-L366 VanDerWaalsContact C-CD2 3.5Å; T348-L366 WeakPolarHBondContact O-CD2 3.29Å; P362-L366 WeakPolarHBondContact O-CG 3.43Å; P362-L366 PolarHBondContact O-N 3.38Å; L366-K368 VanDerWaalsContact C-N 3.33Å; L366-K368 PolarHBondContact O-N 2.86Å
367	G	94.1	Very high	94.3	Very high	60 Å²	60	45.9 Å²	45.9	62%	0.619	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	5.2	177.5	0	0	0	0	0	115.7	I347	I347-G367 PolarHBondContact O-N 3.41Å
368	K	96.3	Very high	94.7	Very high	77 Å²	77	46.9 Å²	46.9	34%	0.335	26%	0.258	S	S	.	.	S	Bend	trans	-106.5	157.2	178.1	-68.7	175.3	-177.4	170.9	0	112.5	I346 I347 D364 L365 L366 E372 F373	I346-K368 WeakPolarHBondContact CA-O 3.21Å; I347-K368 PolarHBondContact N-O 3.41Å; D364-K368 WeakPolarHBondContact O-CE 3.19Å; D364-K368 PolarHBondContact O-NZ 3.42Å; L365-K368 PolarHBondContact O-N 3.15Å; L366-K368 VanDerWaalsContact C-N 3.33Å; L366-K368 PolarHBondContact O-N 2.86Å; K368-E372 WeakPolarHBondContact CB-OE1 3.15Å; K368-F373 HydrophobicContact CB-CE2 4.01Å; K368-F373 HydrophobicContact CD-CE2 4.07Å; K368-F373 HydrophobicContact CD-CZ 3.83Å
369	D	95.5	Very high	94.9	Very high	33 Å²	33	49.9 Å²	49.9	18%	0.176	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-72.8	130.6	171	-175	-18.6	0	0	0	109.2	I346 L371 E372 R383	I346-D369 HydrophobicContact CD1-CB 3.91Å; D369-L371 PolarHBondContact O-N 3.29Å; D369-L371 VanDerWaalsContact O-N 3.08Å; D369-L371 VanDerWaalsContact OD1-CB 3.28Å; D369-L371 WeakPolarHBondContact OD1-CB 3.38Å; D369-L371 VanDerWaalsContact OD1-CG 3.32Å; D369-L371 WeakPolarHBondContact OD1-CG 3.18Å; D369-L371 PolarHBondContact OD1-N 3.18Å; D369-E372 HydrophobicContact CB-CG 4.4Å; D369-E372 PolarHBondContact N-OE1 3.18Å; D369-E372 VanDerWaalsContact O-CB 3.31Å; D369-E372 WeakPolarHBondContact O-CB 3.49Å; D369-E372 PolarHBondContact O-N 3.39Å; D369-R383 IonicContact OD2-NH2 3.97Å
370	I	94.3	Very high	95.1	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.036	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-53.1	-27.5	173.6	-172.3	55.1	0	0	0	112.7	G345 I347 E372 F373 C374 L382 F386 F403	G345-I370 PolarHBondContact O-N 3.04Å; I347-I370 HydrophobicContact CD1-CD1 4.21Å; I370-E372 VanDerWaalsContact C-N 3.29Å; I370-E372 PolarHBondContact O-N 3.06Å; I370-F373 PolarHBondContact O-N 2.75Å; I370-F373 VanDerWaalsContact O-N 3.1Å; I370-C374 PolarHBondContact O-N 2.77Å; I370-L382 HydrophobicContact CG1-CD2 4.37Å; I370-F386 HydrophobicContact CG2-CE2 4.05Å; I370-F386 HydrophobicContact CG2-CZ 4.01Å; I370-F403 HydrophobicContact CD1-CD2 4.43Å; I370-F403 HydrophobicContact CD1-CE2 3.86Å
371	L	94.6	Very high	95.1	Very high	9 Å²	9	55 Å²	55	5%	0.047	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-69.4	-21.3	177.8	-62.1	166.3	0	0	0	113.2	D369 F373 C374 Q379 L382 R383	D369-L371 PolarHBondContact O-N 3.29Å; D369-L371 VanDerWaalsContact O-N 3.08Å; D369-L371 VanDerWaalsContact OD1-CB 3.28Å; D369-L371 WeakPolarHBondContact OD1-CB 3.38Å; D369-L371 VanDerWaalsContact OD1-CG 3.32Å; D369-L371 WeakPolarHBondContact OD1-CG 3.18Å; D369-L371 PolarHBondContact OD1-N 3.18Å; L371-F373 PolarHBondContact O-N 2.71Å; L371-C374 HydrophobicContact CD2-CB 4.29Å; L371-C374 PolarHBondContact O-N 3.08Å; L371-C374 VanDerWaalsContact O-N 3.17Å; L371-Q379 HydrophobicContact CB-CG 4.39Å; L371-Q379 HydrophobicContact CD2-CB 4.01Å; L371-Q379 HydrophobicContact CD2-CG 4.02Å; L371-Q379 WeakPolarHBondContact CD2-O 3.21Å; L371-Q379 PolarHBondContact O-NE2 3.43Å; L371-L382 HydrophobicContact CD2-CB 3.96Å; L371-L382 HydrophobicContact CD2-CD2 3.96Å; L371-L382 HydrophobicContact CD2-CG 4.08Å; L371-R383 HydrophobicContact CD1-CB 4.22Å; L371-R383 HydrophobicContact CD1-CG 4.47Å
372	E	94.9	Very high	95.2	Very high	92 Å²	92	51.6 Å²	51.6	43%	0.43	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-61.3	-23	169.2	-68.1	177.8	-131.3	0	0	112.6	K368 D369 I370 R404	K368-E372 WeakPolarHBondContact CB-OE1 3.15Å; D369-E372 HydrophobicContact CB-CG 4.4Å; D369-E372 PolarHBondContact N-OE1 3.18Å; D369-E372 VanDerWaalsContact O-CB 3.31Å; D369-E372 WeakPolarHBondContact O-CB 3.49Å; D369-E372 PolarHBondContact O-N 3.39Å; I370-E372 VanDerWaalsContact C-N 3.29Å; I370-E372 PolarHBondContact O-N 3.06Å; E372-R404 PolarHBondContact O-NH2 3.28Å
373	F	95.3	Very high	95.2	Very high	6 Å²	6	56.1 Å²	56.1	3%	0.026	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-10	179.3	-55.8	-89.1	0	0	0	112.4	I347 Y360 L365 K368 I370 L371 F403 R404	I347-F373 HydrophobicContact CD1-CD2 4.47Å; I347-F373 HydrophobicContact CD1-CE2 4.3Å; Y360-F373 HydrophobicContact CE1-CE1 4.01Å; Y360-F373 HydrophobicContact CE2-CD1 4.07Å; Y360-F373 HydrophobicContact CE2-CE1 4.13Å; Y360-F373 AromaticContact CZ-CD1 3.99Å; Y360-F373 AromaticContact CZ-CE1 3.75Å; L365-F373 HydrophobicContact CD2-CD1 4.09Å; L365-F373 HydrophobicContact CD2-CE1 3.49Å; L365-F373 VanDerWaalsContact CD2-CE1 3.49Å; L365-F373 HydrophobicContact CD2-CE2 4.05Å; L365-F373 HydrophobicContact CD2-CZ 3.48Å; L365-F373 VanDerWaalsContact CD2-CZ 3.48Å; K368-F373 HydrophobicContact CB-CE2 4.01Å; K368-F373 HydrophobicContact CD-CE2 4.07Å; K368-F373 HydrophobicContact CD-CZ 3.83Å; I370-F373 PolarHBondContact O-N 2.75Å; I370-F373 VanDerWaalsContact O-N 3.1Å; L371-F373 PolarHBondContact O-N 2.71Å; F373-F403 HydrophobicContact CB-CD2 3.91Å; F373-F403 HydrophobicContact CB-CE1 4.13Å; F373-F403 HydrophobicContact CB-CE2 3.44Å; F373-F403 VanDerWaalsContact CB-CE2 3.44Å; F373-F403 HydrophobicContact CB-CG 4.43Å; F373-F403 HydrophobicContact CB-CZ 3.55Å; F373-F403 HydrophobicContact CD1-CE1 4.29Å; F373-F403 AromaticContact CD1-CZ 3.91Å; F373-F403 HydrophobicContact CD1-CZ 3.91Å; F373-F403 HydrophobicContact CG-CE1 4.5Å; F373-F403 HydrophobicContact CG-CE2 4.06Å; F373-F403 AromaticContact CG-CZ 3.8Å; F373-F403 HydrophobicContact CG-CZ 3.8Å; F373-F403 CarbonylContact O-C 3.52Å; F373-F403 WeakPolarHBondContact O-CA 3.46Å; F373-R404 PolarHBondContact O-N 3.09Å
374	C	96.1	Very high	95.2	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.02	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-86.6	140.9	179.3	-172.2	0	0	0	0	111.8	I370 L371 Q379 L382 Y401	I370-C374 PolarHBondContact O-N 2.77Å; L371-C374 HydrophobicContact CD2-CB 4.29Å; L371-C374 PolarHBondContact O-N 3.08Å; L371-C374 VanDerWaalsContact O-N 3.17Å; C374-Q379 HydrophobicContact CB-CG 3.91Å; C374-Q379 PolarHBondContact O-NE2 3.15Å; C374-L382 HydrophobicContact CB-CD2 3.77Å; C374-Y401 HydrophobicContact CB-CD2 4.12Å; C374-Y401 HydrophobicContact CB-CE2 4.31Å; C374-Y401 VanDerWaalsContact SG-CD2 3.54Å
375	H	96.5	Very high	95.1	Very high	31 Å²	31	54 Å²	54	14%	0.144	28%	0.283	C	S	.	.			trans	-61.4	137.2	175.6	-171.3	-91.7	0	0	0	111.1	E377 D378 Q379 R402 W410	H375-E377 VanDerWaalsContact C-N 3.26Å; H375-E377 VanDerWaalsContact CE1-CD 3.42Å; H375-E377 IonicContact CE1-OE1 3.37Å; H375-E377 IonicContact CE1-OE2 3.99Å; H375-E377 PolarHBondContact CE1-OE2 3.04Å; H375-E377 IonicContact ND1-OE2 3.75Å; H375-E377 PolarHBondContact O-N 2.97Å; H375-E377 VanDerWaalsContact O-N 3.08Å; H375-D378 WeakPolarHBondContact O-CA 3.27Å; H375-D378 PolarHBondContact O-N 3.04Å; H375-Q379 PolarHBondContact O-N 3.1Å; H375-R402 HydrophobicContact CB-CB 3.6Å; H375-R402 PolarHBondContact CE1-NH1 3.24Å; H375-R402 PolarHBondContact N-O 2.93Å; H375-R402 VanDerWaalsContact ND1-CZ 3.31Å; H375-R402 PolarHBondContact ND1-NH1 3.02Å; H375-W410 VanDerWaalsContact CA-CZ3 3.44Å; H375-W410 HydrophobicContact CB-CE3 3.95Å; H375-W410 HydrophobicContact CB-CH2 4.03Å; H375-W410 HydrophobicContact CB-CZ3 3.64Å; H375-W410 AromaticContact CD2-CD2 3.75Å; H375-W410 AromaticContact CD2-CE2 3.56Å; H375-W410 AromaticContact CD2-CH2 3.92Å; H375-W410 AromaticContact CD2-CZ2 3.66Å; H375-W410 AromaticContact CD2-NE1 4Å
376	P	95.4	Very high	95	Very high	88 Å²	88	54.5 Å²	54.5	57%	0.571	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-52.8	-37.9	-172.4	-30.6	36.6	0	0	0	115.2	D378 Q379	P376-D378 VanDerWaalsContact C-N 3.29Å; P376-D378 PolarHBondContact O-N 3Å; P376-Q379 PolarHBondContact O-N 3.43Å
377	E	96.5	Very high	94.8	Very high	133 Å²	133	55.7 Å²	55.7	62%	0.621	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-65.2	-27.3	175.7	-64.1	167.7	-176.9	0	0	113.8	H375 R402	H375-E377 VanDerWaalsContact C-N 3.26Å; H375-E377 VanDerWaalsContact CE1-CD 3.42Å; H375-E377 IonicContact CE1-OE1 3.37Å; H375-E377 IonicContact CE1-OE2 3.99Å; H375-E377 PolarHBondContact CE1-OE2 3.04Å; H375-E377 IonicContact ND1-OE2 3.75Å; H375-E377 PolarHBondContact O-N 2.97Å; H375-E377 VanDerWaalsContact O-N 3.08Å; E377-R402 IonicContact OE2-CZ 3.8Å; E377-R402 IonicContact OE2-NH1 3.35Å; E377-R402 PolarHBondContact OE2-NH1 3.41Å; E377-R402 IonicContact OE2-NH2 3.11Å; E377-R402 PolarHBondContact OE2-NH2 3.29Å
378	D	95.9	Very high	94.7	Very high	27 Å²	27	57.4 Å²	57.4	14%	0.144	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-95.1	-10.8	-176.4	-59.6	-18.9	0	0	0	112.2	H375 P376 S380 H381 L382 R402	H375-D378 WeakPolarHBondContact O-CA 3.27Å; H375-D378 PolarHBondContact O-N 3.04Å; P376-D378 VanDerWaalsContact C-N 3.29Å; P376-D378 PolarHBondContact O-N 3Å; D378-S380 PolarHBondContact O-N 2.83Å; D378-H381 PolarHBondContact O-N 2.88Å; D378-L382 WeakPolarHBondContact O-CB 3.25Å; D378-L382 PolarHBondContact O-N 2.83Å; D378-R402 IonicContact OD1-CZ 3.18Å; D378-R402 IonicContact OD1-NE 3.61Å; D378-R402 IonicContact OD1-NH2 2.73Å; D378-R402 PolarHBondContact OD1-NH2 3.49Å; D378-R402 WeakPolarHBondContact OD2-CB 3.16Å; D378-R402 IonicContact OD2-CZ 3.6Å; D378-R402 PolarHBondContact OD2-N 3.17Å; D378-R402 IonicContact OD2-NE 2.66Å; D378-R402 PolarHBondContact OD2-NE 2.87Å; D378-R402 IonicContact OD2-NH2 2.72Å
379	Q	95.3	Very high	94.6	Very high	68 Å²	68	53.7 Å²	53.7	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-36.3	-172.3	-78.3	177.9	9.5	0	0	114	L371 C374 H375 P376 R383	L371-Q379 HydrophobicContact CB-CG 4.39Å; L371-Q379 HydrophobicContact CD2-CB 4.01Å; L371-Q379 HydrophobicContact CD2-CG 4.02Å; L371-Q379 WeakPolarHBondContact CD2-O 3.21Å; L371-Q379 PolarHBondContact O-NE2 3.43Å; C374-Q379 HydrophobicContact CB-CG 3.91Å; C374-Q379 PolarHBondContact O-NE2 3.15Å; H375-Q379 PolarHBondContact O-N 3.1Å; P376-Q379 PolarHBondContact O-N 3.43Å; Q379-R383 WeakPolarHBondContact O-CB 3.48Å; Q379-R383 PolarHBondContact O-N 3.42Å
380	S	94.9	Very high	94.3	Very high	72 Å²	72	54.6 Å²	54.6	50%	0.503	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-53.8	175.6	46.8	0	0	0	0	111	D378 L382 R383 E384	D378-S380 PolarHBondContact O-N 2.83Å; S380-L382 VanDerWaalsContact C-N 3.31Å; S380-L382 PolarHBondContact O-N 3.45Å; S380-R383 PolarHBondContact O-N 3.39Å; S380-R383 VanDerWaalsContact O-N 3.12Å; S380-E384 WeakPolarHBondContact O-CG 3.33Å; S380-E384 PolarHBondContact O-N 2.84Å
381	H	94.4	Very high	94.2	Very high	100 Å²	100	61.9 Å²	61.9	46%	0.463	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-37.3	179.2	-178.1	-136	0	0	0	112.5	D378 S385	D378-H381 PolarHBondContact O-N 2.88Å; H381-S385 WeakPolarHBondContact O-CB 3.36Å; H381-S385 PolarHBondContact O-N 2.95Å; H381-S385 PolarHBondContact O-OG 3.29Å
382	L	94.6	Very high	93.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-68.4	-42.7	174	-172.4	57.8	0	0	0	111.9	I370 L371 C374 D378 S380 S385 F386 V399 Y401	I370-L382 HydrophobicContact CG1-CD2 4.37Å; L371-L382 HydrophobicContact CD2-CB 3.96Å; L371-L382 HydrophobicContact CD2-CD2 3.96Å; L371-L382 HydrophobicContact CD2-CG 4.08Å; C374-L382 HydrophobicContact CB-CD2 3.77Å; D378-L382 WeakPolarHBondContact O-CB 3.25Å; D378-L382 PolarHBondContact O-N 2.83Å; S380-L382 VanDerWaalsContact C-N 3.31Å; S380-L382 PolarHBondContact O-N 3.45Å; L382-S385 WeakPolarHBondContact O-CB 3.22Å; L382-S385 PolarHBondContact O-N 3.48Å; L382-F386 HydrophobicContact CD1-CD2 4Å; L382-F386 HydrophobicContact CD1-CE2 3.87Å; L382-F386 HydrophobicContact CG-CD2 4.25Å; L382-F386 HydrophobicContact CG-CE2 4.26Å; L382-F386 WeakPolarHBondContact O-CD2 3.42Å; L382-F386 PolarHBondContact O-N 2.66Å; L382-V399 HydrophobicContact CD1-CG1 3.64Å; L382-V399 HydrophobicContact CD1-CG2 4.31Å; L382-Y401 HydrophobicContact CD1-CD1 3.91Å; L382-Y401 HydrophobicContact CD1-CE1 3.86Å; L382-Y401 HydrophobicContact CD2-CD1 4.21Å; L382-Y401 HydrophobicContact CD2-CD2 3.9Å; L382-Y401 HydrophobicContact CD2-CE1 4.08Å; L382-Y401 HydrophobicContact CD2-CE2 3.74Å; L382-Y401 HydrophobicContact CD2-CG 4.14Å
383	R	94	Very high	93.5	Very high	118 Å²	118	64.5 Å²	64.5	45%	0.445	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-42.6	176.2	-171.2	-178.8	-66.4	-73.8	8.8	111.8	D369 L371 Q379 S380 F386 Q387	D369-R383 IonicContact OD2-NH2 3.97Å; L371-R383 HydrophobicContact CD1-CB 4.22Å; L371-R383 HydrophobicContact CD1-CG 4.47Å; Q379-R383 WeakPolarHBondContact O-CB 3.48Å; Q379-R383 PolarHBondContact O-N 3.42Å; S380-R383 PolarHBondContact O-N 3.39Å; S380-R383 VanDerWaalsContact O-N 3.12Å; R383-F386 PolarHBondContact O-N 3.04Å; R383-Q387 WeakPolarHBondContact O-CG 3.4Å; R383-Q387 PolarHBondContact O-N 2.97Å; R383-Q387 VanDerWaalsContact O-N 3.07Å
384	E	94.1	Very high	92.9	Very high	119 Å²	119	65.9 Å²	65.9	56%	0.556	33%	0.329	S	S	*	.	H	α-helix	trans	-62.1	-42.4	174.2	-73.4	169.1	-155.5	0	0	111.6	S380 F386 Q387 Q388	S380-E384 WeakPolarHBondContact O-CG 3.33Å; S380-E384 PolarHBondContact O-N 2.84Å; E384-F386 PolarHBondContact O-N 2.8Å; E384-Q387 PolarHBondContact O-N 3.47Å; E384-Q388 WeakPolarHBondContact O-CB 3.22Å; E384-Q388 PolarHBondContact O-N 3.02Å
385	S	93.7	Very high	92.7	Very high	8 Å²	8	72 Å²	72	6%	0.056	36%	0.358	C	S	.	.	H	α-helix	trans	-59.5	-45.4	175.9	-62.4	0	0	0	0	112.2	H381 L382 Q388 V389 L397 V399	H381-S385 WeakPolarHBondContact O-CB 3.36Å; H381-S385 PolarHBondContact O-N 2.95Å; H381-S385 PolarHBondContact O-OG 3.29Å; L382-S385 WeakPolarHBondContact O-CB 3.22Å; L382-S385 PolarHBondContact O-N 3.48Å; S385-Q388 PolarHBondContact O-N 2.61Å; S385-V389 WeakPolarHBondContact O-CG2 3.42Å; S385-V389 PolarHBondContact O-N 3.22Å; S385-L397 WeakPolarHBondContact O-CD2 3.33Å; S385-V399 WeakPolarHBondContact OG-CG2 3.45Å
386	F	91.9	Very high	92.5	Very high	14 Å²	14	75 Å²	75	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-62.3	-43.5	175.2	-92.7	-102	0	0	0	112.1	H341 I370 L382 R383 E384 Q388 V389 V390 I431	H341-F386 HydrophobicContact CB-CE1 3.9Å; H341-F386 AromaticContact CG-CE1 3.86Å; H341-F386 AromaticContact ND1-CZ 3.91Å; I370-F386 HydrophobicContact CG2-CE2 4.05Å; I370-F386 HydrophobicContact CG2-CZ 4.01Å; L382-F386 HydrophobicContact CD1-CD2 4Å; L382-F386 HydrophobicContact CD1-CE2 3.87Å; L382-F386 HydrophobicContact CG-CD2 4.25Å; L382-F386 HydrophobicContact CG-CE2 4.26Å; L382-F386 WeakPolarHBondContact O-CD2 3.42Å; L382-F386 PolarHBondContact O-N 2.66Å; R383-F386 PolarHBondContact O-N 3.04Å; E384-F386 PolarHBondContact O-N 2.8Å; F386-Q388 VanDerWaalsContact C-N 3.25Å; F386-Q388 PolarHBondContact O-N 3.19Å; F386-V389 PolarHBondContact O-N 2.79Å; F386-V390 PolarHBondContact O-N 2.86Å; F386-V390 VanDerWaalsContact O-N 3.16Å; F386-I431 HydrophobicContact CD1-CD1 3.68Å; F386-I431 HydrophobicContact CE1-CD1 4.16Å; F386-I431 HydrophobicContact CE1-CG2 4.33Å
387	Q	92.1	Very high	92.4	Very high	104 Å²	104	72.4 Å²	72.4	49%	0.486	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-27.9	174.6	-70.4	-177.7	8.5	0	0	113.3	R383 E384 K391	R383-Q387 WeakPolarHBondContact O-CG 3.4Å; R383-Q387 PolarHBondContact O-N 2.97Å; R383-Q387 VanDerWaalsContact O-N 3.07Å; E384-Q387 PolarHBondContact O-N 3.47Å; Q387-K391 WeakPolarHBondContact O-CD 3.36Å; Q387-K391 WeakPolarHBondContact O-CE 3.31Å; Q387-K391 WeakPolarHBondContact O-CG 3.26Å
388	Q	93.4	Very high	92.3	Very high	96 Å²	96	69.3 Å²	69.3	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-75.8	-41.5	174.3	-175.5	175.3	-8.2	0	0	111.4	E384 S385 F386 V390 K391 L392 L397	E384-Q388 WeakPolarHBondContact O-CB 3.22Å; E384-Q388 PolarHBondContact O-N 3.02Å; S385-Q388 PolarHBondContact O-N 2.61Å; F386-Q388 VanDerWaalsContact C-N 3.25Å; F386-Q388 PolarHBondContact O-N 3.19Å; Q388-V390 VanDerWaalsContact C-N 3.28Å; Q388-V390 PolarHBondContact O-N 3.02Å; Q388-K391 WeakPolarHBondContact O-CB 3.42Å; Q388-K391 PolarHBondContact O-N 3.34Å; Q388-L392 HydrophobicContact CG-CD1 3.91Å; Q388-L392 HydrophobicContact CG-CG 4.23Å; Q388-L392 WeakPolarHBondContact O-CB 3.39Å; Q388-L392 VanDerWaalsContact O-CG 3.31Å; Q388-L392 WeakPolarHBondContact O-CG 3.44Å; Q388-L392 PolarHBondContact O-N 3.01Å; Q388-L397 HydrophobicContact CB-CD2 3.93Å; Q388-L397 HydrophobicContact CG-CD2 4.03Å
389	V	93.1	Very high	92.3	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57	-39.5	174.3	166.8	0	0	0	0	112.4	S385 F386 K391 L392 L397 T419 I431	S385-V389 WeakPolarHBondContact O-CG2 3.42Å; S385-V389 PolarHBondContact O-N 3.22Å; F386-V389 PolarHBondContact O-N 2.79Å; V389-K391 VanDerWaalsContact C-N 3.29Å; V389-K391 PolarHBondContact O-N 3.36Å; V389-L392 PolarHBondContact O-N 3.39Å; V389-L397 HydrophobicContact CG2-CB 3.52Å; V389-L397 HydrophobicContact CG2-CD2 3.91Å; V389-L397 HydrophobicContact CG2-CG 4.36Å; V389-T419 HydrophobicContact CG1-CG2 4.17Å; V389-T419 PolarHBondContact O-OG1 2.77Å; V389-I431 HydrophobicContact CG1-CD1 4.44Å; V389-I431 HydrophobicContact CG1-CG1 4.34Å; V389-I431 HydrophobicContact CG1-CG2 3.81Å
390	V	89.9	Confident	92.3	Very high	52 Å²	52	68.6 Å²	68.6	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-59.6	-38.6	173.4	169.1	0	0	0	0	112.2	F386 Q388 I428 I431	F386-V390 PolarHBondContact O-N 2.86Å; F386-V390 VanDerWaalsContact O-N 3.16Å; Q388-V390 VanDerWaalsContact C-N 3.28Å; Q388-V390 PolarHBondContact O-N 3.02Å; V390-I428 HydrophobicContact CG1-CD1 3.87Å; V390-I431 HydrophobicContact CG2-CD1 4Å
391	K	90.8	Very high	92.3	Very high	159 Å²	159	65.3 Å²	65.3	69%	0.691	33%	0.326	S	S	*	.	H	α-helix	trans	-79.1	-19.5	179.7	-63.1	163.3	-168.8	167.6	0	113.4	Q387 Q388 V389 K393	Q387-K391 WeakPolarHBondContact O-CD 3.36Å; Q387-K391 WeakPolarHBondContact O-CE 3.31Å; Q387-K391 WeakPolarHBondContact O-CG 3.26Å; Q388-K391 WeakPolarHBondContact O-CB 3.42Å; Q388-K391 PolarHBondContact O-N 3.34Å; V389-K391 VanDerWaalsContact C-N 3.29Å; V389-K391 PolarHBondContact O-N 3.36Å; K391-K393 PolarHBondContact O-N 3.35Å
392	L	90.1	Very high	92.4	Very high	39 Å²	39	64.1 Å²	64.1	20%	0.204	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.4	-172.2	-84.1	173.7	0	0	0	115	Q388 V389 G394 Q395 L397	Q388-L392 HydrophobicContact CG-CD1 3.91Å; Q388-L392 HydrophobicContact CG-CG 4.23Å; Q388-L392 WeakPolarHBondContact O-CB 3.39Å; Q388-L392 VanDerWaalsContact O-CG 3.31Å; Q388-L392 WeakPolarHBondContact O-CG 3.44Å; Q388-L392 PolarHBondContact O-N 3.01Å; V389-L392 PolarHBondContact O-N 3.39Å; L392-G394 PolarHBondContact O-N 2.92Å; L392-Q395 HydrophobicContact CB-CB 4.15Å; L392-Q395 HydrophobicContact CD2-CB 4.26Å; L392-Q395 WeakPolarHBondContact O-CB 2.96Å; L392-Q395 WeakPolarHBondContact O-CG 3.42Å; L392-Q395 PolarHBondContact O-N 3.2Å; L392-L397 HydrophobicContact CD1-CB 4Å; L392-L397 HydrophobicContact CD1-CD1 4.19Å; L392-L397 HydrophobicContact CD1-CG 4.47Å
393	K	84.8	Confident	92.5	Very high	118 Å²	118	64.3 Å²	64.3	51%	0.513	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.3	65.8	175.7	-75.2	-151.4	161.9	-154.2	0	113.8	K391 Q395 D426	K391-K393 PolarHBondContact O-N 3.35Å; K393-Q395 VanDerWaalsContact C-N 3.31Å; K393-Q395 PolarHBondContact O-N 2.9Å; K393-D426 IonicContact NZ-OD1 3.91Å; K393-D426 PolarHBondContact NZ-OD1 2.9Å; K393-D426 IonicContact NZ-OD2 2.77Å; K393-D426 PolarHBondContact NZ-OD2 2.72Å
394	G	84.1	Confident	92.6	Very high	34 Å²	34	63.3 Å²	63.3	35%	0.351	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-8.9	179	0	0	0	0	0	116.5	L392 T419	L392-G394 PolarHBondContact O-N 2.92Å; G394-T419 PolarHBondContact N-OG1 3.04Å
395	Q	90.5	Very high	92.6	Very high	133 Å²	133	58 Å²	58	62%	0.621	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-68.9	137.8	169.4	-61.6	-177.3	1.9	0	0	110.7	L392 K393	L392-Q395 HydrophobicContact CB-CB 4.15Å; L392-Q395 HydrophobicContact CD2-CB 4.26Å; L392-Q395 WeakPolarHBondContact O-CB 2.96Å; L392-Q395 WeakPolarHBondContact O-CG 3.42Å; L392-Q395 PolarHBondContact O-N 3.2Å; K393-Q395 VanDerWaalsContact C-N 3.31Å; K393-Q395 PolarHBondContact O-N 2.9Å
396	V	92.5	Very high	92.6	Very high	92 Å²	92	62.5 Å²	62.5	56%	0.558	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-79.2	122.2	-177.3	-178.7	0	0	0	0	110.8	S417 F418	V396-S417 WeakPolarHBondContact CA-O 3.48Å; V396-F418 HydrophobicContact CG2-CB 4.08Å; V396-F418 HydrophobicContact CG2-CD1 4.05Å; V396-F418 HydrophobicContact CG2-CG 4.26Å
397	L	94.6	Very high	92.6	Very high	35 Å²	35	66.5 Å²	66.5	18%	0.183	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	158.3	163.2	-164.1	62.8	0	0	0	109.5	S385 Q388 V389 L392 S416 S417	S385-L397 WeakPolarHBondContact O-CD2 3.33Å; Q388-L397 HydrophobicContact CB-CD2 3.93Å; Q388-L397 HydrophobicContact CG-CD2 4.03Å; V389-L397 HydrophobicContact CG2-CB 3.52Å; V389-L397 HydrophobicContact CG2-CD2 3.91Å; V389-L397 HydrophobicContact CG2-CG 4.36Å; L392-L397 HydrophobicContact CD1-CB 4Å; L392-L397 HydrophobicContact CD1-CD1 4.19Å; L392-L397 HydrophobicContact CD1-CG 4.47Å; L397-S416 CarbonylContact O-C 3.58Å; L397-S416 WeakPolarHBondContact O-CA 3.12Å; L397-S417 PolarHBondContact N-O 3.23Å; L397-S417 PolarHBondContact O-N 3.07Å
398	S	94.7	Very high	92.5	Very high	68 Å²	68	71.4 Å²	71.4	48%	0.476	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	127.2	171.4	-66.1	0	0	0	0	111	T415 S416	S398-T415 WeakPolarHBondContact CA-O 3.16Å; S398-S416 WeakPolarHBondContact OG-CB 3.29Å; S398-S416 PolarHBondContact OG-OG 3.43Å
399	V	95.3	Very high	92.5	Very high	5 Å²	5	72.8 Å²	72.8	3%	0.03	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147.3	-179.6	61.7	0	0	0	0	109.7	L382 S385 Y401 R414 T415	L382-V399 HydrophobicContact CD1-CG1 3.64Å; L382-V399 HydrophobicContact CD1-CG2 4.31Å; S385-V399 WeakPolarHBondContact OG-CG2 3.45Å; V399-Y401 HydrophobicContact CG1-CD1 4.26Å; V399-Y401 HydrophobicContact CG1-CE1 4.4Å; V399-R414 CarbonylContact O-C 3.57Å; V399-R414 WeakPolarHBondContact O-CA 3.28Å; V399-T415 PolarHBondContact N-O 2.9Å; V399-T415 PolarHBondContact O-N 2.9Å
400	M	94.8	Very high	92.5	Very high	75 Å²	75	77.9 Å²	77.9	37%	0.369	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.7	173.1	-77.9	175	51.4	0	0	109.5	L412 I413 R414 V438	M400-L412 HydrophobicContact CE-CD1 4.32Å; M400-L412 HydrophobicContact CE-CD2 3.77Å; M400-L412 HydrophobicContact CE-CG 4.11Å; M400-I413 WeakPolarHBondContact CA-O 3.39Å; M400-R414 HydrophobicContact CG-CB 3.72Å; M400-R414 HydrophobicContact CG-CG 3.89Å; M400-R414 HydrophobicContact SD-CB 4.4Å; M400-R414 HydrophobicContact SD-CG 4.5Å; M400-R414 PolarHBondContact SD-NE 2.94Å; M400-R414 VanDerWaalsContact SD-NE 3.37Å; M400-R414 PolarHBondContact SD-NH2 2.92Å; M400-V438 HydrophobicContact CE-CG1 4.36Å; M400-V438 HydrophobicContact CE-CG2 4.16Å
401	Y	95.8	Very high	92.6	Very high	3 Å²	3	77.2 Å²	77.2	1%	0.012	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	165.5	-177.4	64.8	-80.1	0	0	0	111.1	C374 L382 V399 F403 I413 T415	C374-Y401 HydrophobicContact CB-CD2 4.12Å; C374-Y401 HydrophobicContact CB-CE2 4.31Å; C374-Y401 VanDerWaalsContact SG-CD2 3.54Å; L382-Y401 HydrophobicContact CD1-CD1 3.91Å; L382-Y401 HydrophobicContact CD1-CE1 3.86Å; L382-Y401 HydrophobicContact CD2-CD1 4.21Å; L382-Y401 HydrophobicContact CD2-CD2 3.9Å; L382-Y401 HydrophobicContact CD2-CE1 4.08Å; L382-Y401 HydrophobicContact CD2-CE2 3.74Å; L382-Y401 HydrophobicContact CD2-CG 4.14Å; V399-Y401 HydrophobicContact CG1-CD1 4.26Å; V399-Y401 HydrophobicContact CG1-CE1 4.4Å; Y401-F403 HydrophobicContact CE2-CB 4.09Å; Y401-F403 AromaticContact CE2-CD2 3.94Å; Y401-F403 HydrophobicContact CE2-CD2 3.94Å; Y401-I413 PolarHBondContact N-O 3.34Å; Y401-I413 VanDerWaalsContact N-O 3.11Å; Y401-I413 PolarHBondContact O-N 3.05Å; Y401-T415 WeakPolarHBondContact CE1-OG1 3.38Å; Y401-T415 PolarHBondContact OH-OG1 3.4Å
402	R	96.3	Very high	92.8	Very high	75 Å²	75	72.8 Å²	72.8	28%	0.283	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	112.8	174.3	-70.8	162.4	-76	-174.8	-9.8	109.9	H375 E377 D378 W410 M411	H375-R402 HydrophobicContact CB-CB 3.6Å; H375-R402 PolarHBondContact CE1-NH1 3.24Å; H375-R402 PolarHBondContact N-O 2.93Å; H375-R402 VanDerWaalsContact ND1-CZ 3.31Å; H375-R402 PolarHBondContact ND1-NH1 3.02Å; E377-R402 IonicContact OE2-CZ 3.8Å; E377-R402 IonicContact OE2-NH1 3.35Å; E377-R402 PolarHBondContact OE2-NH1 3.41Å; E377-R402 IonicContact OE2-NH2 3.11Å; E377-R402 PolarHBondContact OE2-NH2 3.29Å; D378-R402 IonicContact OD1-CZ 3.18Å; D378-R402 IonicContact OD1-NE 3.61Å; D378-R402 IonicContact OD1-NH2 2.73Å; D378-R402 PolarHBondContact OD1-NH2 3.49Å; D378-R402 WeakPolarHBondContact OD2-CB 3.16Å; D378-R402 IonicContact OD2-CZ 3.6Å; D378-R402 PolarHBondContact OD2-N 3.17Å; D378-R402 IonicContact OD2-NE 2.66Å; D378-R402 PolarHBondContact OD2-NE 2.87Å; D378-R402 IonicContact OD2-NH2 2.72Å; R402-W410 HydrophobicContact CB-CB 4.47Å; R402-W410 HydrophobicContact CB-CE3 4.04Å; R402-M411 CarbonylContact C-O 3.52Å; R402-M411 WeakPolarHBondContact CA-O 3.31Å
403	F	96.1	Very high	93	Very high	4 Å²	4	70.9 Å²	70.9	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	135	173	-171.5	-80.2	0	0	0	110	I358 Y360 I370 F373 Y401 M411 I413	I358-F403 HydrophobicContact CB-CD1 4.43Å; I358-F403 HydrophobicContact CB-CE1 4.02Å; I358-F403 HydrophobicContact CD1-CE1 3.56Å; I358-F403 HydrophobicContact CD1-CE2 4.49Å; I358-F403 HydrophobicContact CD1-CZ 3.54Å; I358-F403 HydrophobicContact CG1-CE1 4.36Å; I358-F403 HydrophobicContact CG2-CD1 3.99Å; I358-F403 HydrophobicContact CG2-CE1 3.99Å; Y360-F403 HydrophobicContact CD2-CE1 4.25Å; Y360-F403 HydrophobicContact CE2-CE1 4.03Å; I370-F403 HydrophobicContact CD1-CD2 4.43Å; I370-F403 HydrophobicContact CD1-CE2 3.86Å; F373-F403 HydrophobicContact CB-CD2 3.91Å; F373-F403 HydrophobicContact CB-CE1 4.13Å; F373-F403 HydrophobicContact CB-CE2 3.44Å; F373-F403 VanDerWaalsContact CB-CE2 3.44Å; F373-F403 HydrophobicContact CB-CG 4.43Å; F373-F403 HydrophobicContact CB-CZ 3.55Å; F373-F403 HydrophobicContact CD1-CE1 4.29Å; F373-F403 AromaticContact CD1-CZ 3.91Å; F373-F403 HydrophobicContact CD1-CZ 3.91Å; F373-F403 HydrophobicContact CG-CE1 4.5Å; F373-F403 HydrophobicContact CG-CE2 4.06Å; F373-F403 AromaticContact CG-CZ 3.8Å; F373-F403 HydrophobicContact CG-CZ 3.8Å; F373-F403 CarbonylContact O-C 3.52Å; F373-F403 WeakPolarHBondContact O-CA 3.46Å; Y401-F403 HydrophobicContact CE2-CB 4.09Å; Y401-F403 AromaticContact CE2-CD2 3.94Å; Y401-F403 HydrophobicContact CE2-CD2 3.94Å; F403-M411 PolarHBondContact N-O 3.48Å; F403-M411 PolarHBondContact O-N 2.99Å; F403-I413 HydrophobicContact CB-CB 4.28Å; F403-I413 HydrophobicContact CB-CD1 3.54Å; F403-I413 HydrophobicContact CB-CG1 3.88Å; F403-I413 HydrophobicContact CD1-CD1 4.08Å; F403-I413 HydrophobicContact CD2-CD1 4.17Å; F403-I413 HydrophobicContact CG-CD1 3.68Å
404	R	96.1	Very high	93.5	Very high	97 Å²	97	70.6 Å²	70.6	37%	0.366	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	112.8	176.5	-176.7	169.6	57.4	173.2	-2.8	110.2	Y360 E372 F373 E409 W410	Y360-R404 VanDerWaalsContact CE2-O 3.29Å; Y360-R404 WeakPolarHBondContact CE2-O 3.14Å; Y360-R404 PolarHBondContact OH-O 2.9Å; E372-R404 PolarHBondContact O-NH2 3.28Å; F373-R404 PolarHBondContact O-N 3.09Å; R404-E409 WeakPolarHBondContact CA-O 3.47Å; R404-W410 HydrophobicContact CB-CE3 3.9Å; R404-W410 HydrophobicContact CB-CH2 3.88Å; R404-W410 HydrophobicContact CB-CZ3 3.53Å; R404-W410 HydrophobicContact CG-CH2 4.43Å; R404-W410 HydrophobicContact CG-CZ3 4.45Å
405	T	94.3	Very high	94	Very high	8 Å²	8	69 Å²	69	5%	0.049	32%	0.317	C	S	.	.			trans	-78.2	167.1	177	43.9	0	0	0	0	112.4	I358 N407 R408 E409 M411	I358-T405 HydrophobicContact CB-CG2 4.06Å; I358-T405 HydrophobicContact CG2-CG2 4.08Å; T405-N407 WeakPolarHBondContact CB-OD1 3.38Å; T405-N407 PolarHBondContact O-N 3.24Å; T405-N407 PolarHBondContact OG1-OD1 2.95Å; T405-R408 WeakPolarHBondContact O-CA 3.24Å; T405-R408 PolarHBondContact O-N 3.41Å; T405-E409 PolarHBondContact N-O 2.85Å; T405-E409 PolarHBondContact OG1-O 3.24Å; T405-M411 HydrophobicContact CG2-CB 3.85Å; T405-M411 HydrophobicContact CG2-CE 3.95Å; T405-M411 HydrophobicContact CG2-SD 4.16Å
406	K	92.9	Very high	94.3	Very high	101 Å²	101	64.3 Å²	64.3	44%	0.439	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.5	-173.8	-169.4	169.6	-172.6	163.6	0	114.3	I358 G359 Y360 D364 R408	I358-K406 PolarHBondContact O-N 3.39Å; I358-K406 VanDerWaalsContact O-N 3.08Å; G359-K406 WeakPolarHBondContact O-CD 3.47Å; Y360-K406 HydrophobicContact CD1-CB 3.99Å; Y360-K406 HydrophobicContact CD1-CD 4.08Å; Y360-K406 HydrophobicContact CD1-CG 4.05Å; Y360-K406 HydrophobicContact CD2-CB 4.12Å; Y360-K406 HydrophobicContact CE1-CB 3.93Å; Y360-K406 HydrophobicContact CE1-CD 4.48Å; Y360-K406 HydrophobicContact CE1-CG 3.98Å; Y360-K406 HydrophobicContact CE2-CB 4.07Å; Y360-K406 VanDerWaalsContact CE2-N 3.29Å; Y360-K406 HydrophobicContact CG-CB 4.1Å; D364-K406 IonicContact OD1-NZ 3.86Å; D364-K406 IonicContact OD2-NZ 2.68Å; D364-K406 PolarHBondContact OD2-NZ 2.84Å; K406-R408 PolarHBondContact O-N 2.99Å
407	N	91.9	Very high	94.4	Very high	98 Å²	98	60 Å²	60	52%	0.524	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	3.4	171.1	66.2	-13.5	0	0	0	114.1	T405 E409	T405-N407 WeakPolarHBondContact CB-OD1 3.38Å; T405-N407 PolarHBondContact O-N 3.24Å; T405-N407 PolarHBondContact OG1-OD1 2.95Å; N407-E409 VanDerWaalsContact C-N 3.31Å; N407-E409 PolarHBondContact ND2-OE2 3.27Å; N407-E409 PolarHBondContact O-N 3.23Å; N407-E409 PolarHBondContact OD1-N 2.83Å
408	R	90.5	Very high	94.5	Very high	208 Å²	208	61.2 Å²	61.2	79%	0.785	28%	0.276	S	S	*	.	S	Bend	trans	69.9	13.8	-177.8	-52.2	-178.1	174.8	-160.8	-1.3	115.9	T405 K406	T405-R408 WeakPolarHBondContact O-CA 3.24Å; T405-R408 PolarHBondContact O-N 3.41Å; K406-R408 PolarHBondContact O-N 2.99Å
409	E	93.2	Very high	94.5	Very high	125 Å²	125	58.2 Å²	58.2	58%	0.584	26%	0.255	S	S	*	.			trans	-79	166	170.8	-64.1	179.8	156.1	0	0	111.8	R404 T405 N407	R404-E409 WeakPolarHBondContact CA-O 3.47Å; T405-E409 PolarHBondContact N-O 2.85Å; T405-E409 PolarHBondContact OG1-O 3.24Å; N407-E409 VanDerWaalsContact C-N 3.31Å; N407-E409 PolarHBondContact ND2-OE2 3.27Å; N407-E409 PolarHBondContact O-N 3.23Å; N407-E409 PolarHBondContact OD1-N 2.83Å
410	W	93.7	Very high	94.4	Very high	107 Å²	107	61.1 Å²	61.1	41%	0.405	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112	177.3	-65.5	108.6	0	0	0	110.8	H375 R402 R404	H375-W410 VanDerWaalsContact CA-CZ3 3.44Å; H375-W410 HydrophobicContact CB-CE3 3.95Å; H375-W410 HydrophobicContact CB-CH2 4.03Å; H375-W410 HydrophobicContact CB-CZ3 3.64Å; H375-W410 AromaticContact CD2-CD2 3.75Å; H375-W410 AromaticContact CD2-CE2 3.56Å; H375-W410 AromaticContact CD2-CH2 3.92Å; H375-W410 AromaticContact CD2-CZ2 3.66Å; H375-W410 AromaticContact CD2-NE1 4Å; R402-W410 HydrophobicContact CB-CB 4.47Å; R402-W410 HydrophobicContact CB-CE3 4.04Å; R404-W410 HydrophobicContact CB-CE3 3.9Å; R404-W410 HydrophobicContact CB-CH2 3.88Å; R404-W410 HydrophobicContact CB-CZ3 3.53Å; R404-W410 HydrophobicContact CG-CH2 4.43Å; R404-W410 HydrophobicContact CG-CZ3 4.45Å
411	M	92.6	Very high	94.2	Very high	38 Å²	38	59.5 Å²	59.5	19%	0.187	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.9	177.7	-179.4	177.5	-75.6	0	0	110.5	V357 I358 R402 F403 T405 I413 N437	V357-M411 WeakPolarHBondContact O-CE 3.36Å; I358-M411 HydrophobicContact CG2-SD 4.23Å; R402-M411 CarbonylContact C-O 3.52Å; R402-M411 WeakPolarHBondContact CA-O 3.31Å; F403-M411 PolarHBondContact N-O 3.48Å; F403-M411 PolarHBondContact O-N 2.99Å; T405-M411 HydrophobicContact CG2-CB 3.85Å; T405-M411 HydrophobicContact CG2-CE 3.95Å; T405-M411 HydrophobicContact CG2-SD 4.16Å; M411-I413 HydrophobicContact CG-CG1 4.06Å; M411-I413 PolarHBondContact O-N 2.99Å; M411-I413 HydrophobicContact SD-CD1 4.32Å; M411-I413 HydrophobicContact SD-CG1 4.19Å; M411-N437 WeakPolarHBondContact CE-ND2 3.47Å; M411-N437 HydrophobicContact SD-CB 3.95Å; M411-N437 VanDerWaalsContact SD-CG 3.56Å
412	L	93.9	Very high	93.8	Very high	65 Å²	65	61 Å²	61	34%	0.34	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	109.6	173	-174.6	65	0	0	0	109.5	M400 V438	M400-L412 HydrophobicContact CE-CD1 4.32Å; M400-L412 HydrophobicContact CE-CD2 3.77Å; M400-L412 HydrophobicContact CE-CG 4.11Å; L412-V438 HydrophobicContact CD2-CB 4.34Å; L412-V438 HydrophobicContact CD2-CG1 4.33Å; L412-V438 HydrophobicContact CG-CB 4.33Å; L412-V438 HydrophobicContact CG-CG2 4.24Å; L412-V438 WeakPolarHBondContact O-CG2 3.27Å; L412-V438 PolarHBondContact O-N 3.43Å; L412-V438 VanDerWaalsContact O-N 3.14Å
413	I	94.5	Very high	93.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.2	177.6	-66.6	-170.2	0	0	0	109.4	F337 I358 M400 Y401 F403 M411 N435 T436	F337-I413 HydrophobicContact CE1-CD1 4.44Å; I358-I413 HydrophobicContact CG2-CD1 3.7Å; M400-I413 WeakPolarHBondContact CA-O 3.39Å; Y401-I413 PolarHBondContact N-O 3.34Å; Y401-I413 VanDerWaalsContact N-O 3.11Å; Y401-I413 PolarHBondContact O-N 3.05Å; F403-I413 HydrophobicContact CB-CB 4.28Å; F403-I413 HydrophobicContact CB-CD1 3.54Å; F403-I413 HydrophobicContact CB-CG1 3.88Å; F403-I413 HydrophobicContact CD1-CD1 4.08Å; F403-I413 HydrophobicContact CD2-CD1 4.17Å; F403-I413 HydrophobicContact CG-CD1 3.68Å; M411-I413 HydrophobicContact CG-CG1 4.06Å; M411-I413 PolarHBondContact O-N 2.99Å; M411-I413 HydrophobicContact SD-CD1 4.32Å; M411-I413 HydrophobicContact SD-CG1 4.19Å; I413-N435 HydrophobicContact CG2-CB 4.07Å; I413-T436 WeakPolarHBondContact CA-O 3.41Å
414	R	94.8	Very high	93.2	Very high	112 Å²	112	73.2 Å²	73.2	42%	0.423	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.7	161.7	-178.6	177.7	-67.2	177.5	0	108	V399 M400 T436 V438	V399-R414 CarbonylContact O-C 3.57Å; V399-R414 WeakPolarHBondContact O-CA 3.28Å; M400-R414 HydrophobicContact CG-CB 3.72Å; M400-R414 HydrophobicContact CG-CG 3.89Å; M400-R414 HydrophobicContact SD-CB 4.4Å; M400-R414 HydrophobicContact SD-CG 4.5Å; M400-R414 PolarHBondContact SD-NE 2.94Å; M400-R414 VanDerWaalsContact SD-NE 3.37Å; M400-R414 PolarHBondContact SD-NH2 2.92Å; R414-T436 PolarHBondContact N-O 2.87Å; R414-T436 PolarHBondContact O-N 3.28Å; R414-V438 HydrophobicContact CB-CG2 3.88Å
415	T	95.8	Very high	92.9	Very high	1 Å²	1	71.2 Å²	71.2	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.9	170.4	-65.1	0	0	0	0	108.9	S398 V399 Y401 C433 T434 N435	S398-T415 WeakPolarHBondContact CA-O 3.16Å; V399-T415 PolarHBondContact N-O 2.9Å; V399-T415 PolarHBondContact O-N 2.9Å; Y401-T415 WeakPolarHBondContact CE1-OG1 3.38Å; Y401-T415 PolarHBondContact OH-OG1 3.4Å; T415-C433 HydrophobicContact CG2-CB 3.77Å; T415-T434 CarbonylContact C-O 3.51Å; T415-T434 VanDerWaalsContact CA-O 3.31Å; T415-T434 WeakPolarHBondContact CA-O 3.35Å; T415-N435 VanDerWaalsContact CG2-OD1 3.27Å; T415-N435 WeakPolarHBondContact CG2-OD1 3.39Å; T415-N435 PolarHBondContact OG1-OD1 3.42Å
416	S	95.6	Very high	92.5	Very high	33 Å²	33	75.2 Å²	75.2	23%	0.231	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.4	168.2	-64.1	0	0	0	0	108.7	L397 S398 C433 T434	L397-S416 CarbonylContact O-C 3.58Å; L397-S416 WeakPolarHBondContact O-CA 3.12Å; S398-S416 WeakPolarHBondContact OG-CB 3.29Å; S398-S416 PolarHBondContact OG-OG 3.43Å; S416-C433 WeakPolarHBondContact O-CA 3.25Å; S416-T434 PolarHBondContact N-O 3.49Å; S416-T434 PolarHBondContact O-N 2.93Å
417	S	95.4	Very high	92.3	Very high	1 Å²	1	76.9 Å²	76.9	1%	0.007	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.2	-169.2	53.7	0	0	0	0	114.1	V396 L397 I432 C433	V396-S417 WeakPolarHBondContact CA-O 3.48Å; L397-S417 PolarHBondContact N-O 3.23Å; L397-S417 PolarHBondContact O-N 3.07Å; S417-I432 WeakPolarHBondContact CA-O 3.4Å; S417-I432 WeakPolarHBondContact CB-O 3.34Å; S417-C433 WeakPolarHBondContact CB-SG 3.48Å
418	F	95.4	Very high	92.2	Very high	62 Å²	62	75.1 Å²	75.1	27%	0.272	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156.5	179.6	64.5	-79.9	0	0	0	110.9	V396 I431 I432	V396-F418 HydrophobicContact CG2-CB 4.08Å; V396-F418 HydrophobicContact CG2-CD1 4.05Å; V396-F418 HydrophobicContact CG2-CG 4.26Å; F418-I431 WeakPolarHBondContact O-CA 3.45Å; F418-I432 HydrophobicContact CD1-CB 4.31Å; F418-I432 HydrophobicContact CE1-CB 3.86Å; F418-I432 HydrophobicContact CE1-CD1 4.49Å; F418-I432 HydrophobicContact CE1-CG2 3.87Å; F418-I432 HydrophobicContact CE2-CB 4.38Å; F418-I432 HydrophobicContact CE2-CD1 3.88Å; F418-I432 HydrophobicContact CE2-CG1 4.5Å; F418-I432 HydrophobicContact CZ-CB 3.91Å; F418-I432 HydrophobicContact CZ-CD1 3.68Å; F418-I432 HydrophobicContact CZ-CG1 4.31Å; F418-I432 HydrophobicContact CZ-CG2 4.06Å; F418-I432 PolarHBondContact N-O 3.17Å; F418-I432 PolarHBondContact O-N 3.36Å
419	T	94.6	Very high	92.2	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.025	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	131.9	174.5	30.2	0	0	0	0	111.6	V389 G394 I428 I431	V389-T419 HydrophobicContact CG1-CG2 4.17Å; V389-T419 PolarHBondContact O-OG1 2.77Å; G394-T419 PolarHBondContact N-OG1 3.04Å; T419-I428 HydrophobicContact CG2-CD1 3.78Å; T419-I428 HydrophobicContact CG2-CG1 3.94Å; T419-I428 HydrophobicContact CG2-CG2 3.76Å; T419-I431 HydrophobicContact CG2-CG1 4.02Å
420	F	93.1	Very high	92.2	Very high	67 Å²	67	65.9 Å²	65.9	29%	0.294	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	111.1	160.2	-177.1	-96.7	0	0	0	108.5	E429 Y430 I432	F420-E429 HydrophobicContact CD1-CB 4.28Å; F420-E429 HydrophobicContact CD1-CG 4.48Å; F420-E429 PolarHBondContact O-N 3.24Å; F420-E429 VanDerWaalsContact O-N 3.16Å; F420-Y430 HydrophobicContact CB-CD2 3.79Å; F420-Y430 HydrophobicContact CB-CE2 3.54Å; F420-Y430 AromaticContact CD1-CE1 3.98Å; F420-Y430 HydrophobicContact CD1-CE1 3.98Å; F420-Y430 AromaticContact CD1-CE2 3.81Å; F420-Y430 HydrophobicContact CD1-CE2 3.81Å; F420-Y430 AromaticContact CD1-CZ 3.45Å; F420-Y430 VanDerWaalsContact CD1-CZ 3.45Å; F420-Y430 WeakPolarHBondContact CD1-OH 3.45Å; F420-Y430 WeakPolarHBondContact CE1-OH 3.39Å; F420-Y430 HydrophobicContact CG-CD2 4.4Å; F420-Y430 AromaticContact CG-CE2 3.7Å; F420-Y430 HydrophobicContact CG-CE2 3.7Å; F420-Y430 AromaticContact CG-CZ 3.83Å; F420-Y430 PolarHBondContact N-O 2.71Å; F420-I432 HydrophobicContact CB-CD1 4.21Å; F420-I432 HydrophobicContact CB-CG1 4.38Å
421	Q	90.6	Very high	92.3	Very high	41 Å²	41	60.8 Å²	60.8	19%	0.192	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.9	173.4	-64	-173.5	-96.4	0	0	109.8	P423 D426 E427 I428	Q421-P423 WeakPolarHBondContact O-CD 3.31Å; Q421-D426 PolarHBondContact NE2-O 3.43Å; Q421-D426 PolarHBondContact NE2-OD1 3.28Å; Q421-E427 CarbonylContact C-O 3.54Å; Q421-E427 VanDerWaalsContact CA-O 3.28Å; Q421-E427 WeakPolarHBondContact CA-O 3.04Å; Q421-I428 HydrophobicContact CG-CG1 3.89Å
422	N	88.4	Confident	92.4	Very high	35 Å²	35	60.7 Å²	60.7	19%	0.187	30%	0.295	C	S	.	.			trans	-66.6	122.3	175.9	-176.3	-60.7	0	0	0	109.7	Y424 S425 D426 E427 E429	N422-Y424 PolarHBondContact O-N 3.38Å; N422-Y424 WeakPolarHBondContact OD1-CA 3.35Å; N422-Y424 WeakPolarHBondContact OD1-CB 3.33Å; N422-Y424 PolarHBondContact OD1-N 2.88Å; N422-S425 PolarHBondContact O-N 3.46Å; N422-S425 PolarHBondContact OD1-N 2.87Å; N422-D426 PolarHBondContact O-N 3.47Å; N422-E427 PolarHBondContact N-O 2.77Å; N422-E429 HydrophobicContact CB-CG 4.19Å; N422-E429 PolarHBondContact ND2-OE1 3.3Å
423	P	89.3	Confident	92.5	Very high	111 Å²	111	57.6 Å²	57.6	72%	0.721	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-11.4	-176.6	-25.7	35.8	0	0	0	115.9	Q421	Q421-P423 WeakPolarHBondContact O-CD 3.31Å
424	Y	89.7	Confident	92.5	Very high	223 Å²	223	59.2 Å²	59.2	88%	0.875	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-24.1	-178.9	-58.9	-81.7	0	0	0	113.8	N422	N422-Y424 PolarHBondContact O-N 3.38Å; N422-Y424 WeakPolarHBondContact OD1-CA 3.35Å; N422-Y424 WeakPolarHBondContact OD1-CB 3.33Å; N422-Y424 PolarHBondContact OD1-N 2.88Å
425	S	90.9	Very high	92.5	Very high	55 Å²	55	54 Å²	54	39%	0.385	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-10.3	178.7	69	0	0	0	0	115.8	N422 E427	N422-S425 PolarHBondContact O-N 3.46Å; N422-S425 PolarHBondContact OD1-N 2.87Å; S425-E427 WeakPolarHBondContact CB-OE2 3.47Å; S425-E427 PolarHBondContact O-N 3.04Å; S425-E427 WeakPolarHBondContact OG-CB 3.29Å; S425-E427 PolarHBondContact OG-N 3.02Å; S425-E427 PolarHBondContact OG-OE2 2.67Å
426	D	86.1	Confident	92.4	Very high	92 Å²	92	54.9 Å²	54.9	49%	0.492	28%	0.275	S	S	.	.			trans	60.5	2.1	-170.4	-167.5	47.6	0	0	0	113.9	K393 Q421 N422	K393-D426 IonicContact NZ-OD1 3.91Å; K393-D426 PolarHBondContact NZ-OD1 2.9Å; K393-D426 IonicContact NZ-OD2 2.77Å; K393-D426 PolarHBondContact NZ-OD2 2.72Å; Q421-D426 PolarHBondContact NE2-O 3.43Å; Q421-D426 PolarHBondContact NE2-OD1 3.28Å; N422-D426 PolarHBondContact O-N 3.47Å
427	E	88.9	Confident	92.1	Very high	137 Å²	137	53.8 Å²	53.8	64%	0.64	27%	0.267	S	S	*	.			trans	-73.4	148.5	175.4	-62.8	172.7	134.4	0	0	111.6	Q421 N422 S425 E429	Q421-E427 CarbonylContact C-O 3.54Å; Q421-E427 VanDerWaalsContact CA-O 3.28Å; Q421-E427 WeakPolarHBondContact CA-O 3.04Å; N422-E427 PolarHBondContact N-O 2.77Å; S425-E427 WeakPolarHBondContact CB-OE2 3.47Å; S425-E427 PolarHBondContact O-N 3.04Å; S425-E427 WeakPolarHBondContact OG-CB 3.29Å; S425-E427 PolarHBondContact OG-N 3.02Å; S425-E427 PolarHBondContact OG-OE2 2.67Å; E427-E429 PolarHBondContact O-N 3.26Å
428	I	89.4	Confident	91.6	Very high	61 Å²	61	54.3 Å²	54.3	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	110.9	176.8	-62.6	158.7	0	0	0	108.5	V390 T419 Q421	V390-I428 HydrophobicContact CG1-CD1 3.87Å; T419-I428 HydrophobicContact CG2-CD1 3.78Å; T419-I428 HydrophobicContact CG2-CG1 3.94Å; T419-I428 HydrophobicContact CG2-CG2 3.76Å; Q421-I428 HydrophobicContact CG-CG1 3.89Å
429	E	90.3	Very high	90.7	Very high	95 Å²	95	58.2 Å²	58.2	44%	0.444	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-39.5	174.4	-62.4	-175.9	176.9	0	0	111.5	F420 N422 E427	F420-E429 HydrophobicContact CD1-CB 4.28Å; F420-E429 HydrophobicContact CD1-CG 4.48Å; F420-E429 PolarHBondContact O-N 3.24Å; F420-E429 VanDerWaalsContact O-N 3.16Å; N422-E429 HydrophobicContact CB-CG 4.19Å; N422-E429 PolarHBondContact ND2-OE1 3.3Å; E427-E429 PolarHBondContact O-N 3.26Å
430	Y	93.9	Very high	89.5	Confident	43 Å²	43	59.8 Å²	59.8	17%	0.169	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	158.4	-179.8	42	-92.4	0	0	0	112.1	R340 H341 F420 I432	R340-Y430 HydrophobicContact CB-CD2 4.36Å; R340-Y430 HydrophobicContact CB-CG 4.44Å; R340-Y430 HydrophobicContact CG-CD2 4.08Å; H341-Y430 CarbonylContact O-C 3.57Å; H341-Y430 VanDerWaalsContact O-CA 3.28Å; H341-Y430 WeakPolarHBondContact O-CA 3.32Å; H341-Y430 VanDerWaalsContact O-CB 3.32Å; H341-Y430 WeakPolarHBondContact O-CB 3.42Å; F420-Y430 HydrophobicContact CB-CD2 3.79Å; F420-Y430 HydrophobicContact CB-CE2 3.54Å; F420-Y430 AromaticContact CD1-CE1 3.98Å; F420-Y430 HydrophobicContact CD1-CE1 3.98Å; F420-Y430 AromaticContact CD1-CE2 3.81Å; F420-Y430 HydrophobicContact CD1-CE2 3.81Å; F420-Y430 AromaticContact CD1-CZ 3.45Å; F420-Y430 VanDerWaalsContact CD1-CZ 3.45Å; F420-Y430 WeakPolarHBondContact CD1-OH 3.45Å; F420-Y430 WeakPolarHBondContact CE1-OH 3.39Å; F420-Y430 HydrophobicContact CG-CD2 4.4Å; F420-Y430 AromaticContact CG-CE2 3.7Å; F420-Y430 HydrophobicContact CG-CE2 3.7Å; F420-Y430 AromaticContact CG-CZ 3.83Å; F420-Y430 PolarHBondContact N-O 2.71Å; Y430-I432 HydrophobicContact CD2-CD1 4.42Å; Y430-I432 HydrophobicContact CD2-CG1 3.76Å; Y430-I432 HydrophobicContact CE2-CD1 3.99Å; Y430-I432 HydrophobicContact CE2-CG1 3.84Å
431	I	94.8	Very high	88.3	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.9	165.8	-61	169	0	0	0	107.6	R340 H341 F386 V389 V390 F418 T419	R340-I431 VanDerWaalsContact CA-O 3.28Å; R340-I431 WeakPolarHBondContact CA-O 3.45Å; H341-I431 HydrophobicContact CB-CB 4.41Å; H341-I431 PolarHBondContact N-O 2.87Å; H341-I431 PolarHBondContact O-N 3Å; F386-I431 HydrophobicContact CD1-CD1 3.68Å; F386-I431 HydrophobicContact CE1-CD1 4.16Å; F386-I431 HydrophobicContact CE1-CG2 4.33Å; V389-I431 HydrophobicContact CG1-CD1 4.44Å; V389-I431 HydrophobicContact CG1-CG1 4.34Å; V389-I431 HydrophobicContact CG1-CG2 3.81Å; V390-I431 HydrophobicContact CG2-CD1 4Å; F418-I431 WeakPolarHBondContact O-CA 3.45Å; T419-I431 HydrophobicContact CG2-CG1 4.02Å
432	I	95.4	Very high	87.4	Confident	37 Å²	37	62.8 Å²	62.8	19%	0.19	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.9	172.8	-59.1	178.9	0	0	0	108.1	R340 S417 F418 F420 Y430	R340-I432 HydrophobicContact CG-CG1 4.49Å; S417-I432 WeakPolarHBondContact CA-O 3.4Å; S417-I432 WeakPolarHBondContact CB-O 3.34Å; F418-I432 HydrophobicContact CD1-CB 4.31Å; F418-I432 HydrophobicContact CE1-CB 3.86Å; F418-I432 HydrophobicContact CE1-CD1 4.49Å; F418-I432 HydrophobicContact CE1-CG2 3.87Å; F418-I432 HydrophobicContact CE2-CB 4.38Å; F418-I432 HydrophobicContact CE2-CD1 3.88Å; F418-I432 HydrophobicContact CE2-CG1 4.5Å; F418-I432 HydrophobicContact CZ-CB 3.91Å; F418-I432 HydrophobicContact CZ-CD1 3.68Å; F418-I432 HydrophobicContact CZ-CG1 4.31Å; F418-I432 HydrophobicContact CZ-CG2 4.06Å; F418-I432 PolarHBondContact N-O 3.17Å; F418-I432 PolarHBondContact O-N 3.36Å; F420-I432 HydrophobicContact CB-CD1 4.21Å; F420-I432 HydrophobicContact CB-CG1 4.38Å; Y430-I432 HydrophobicContact CD2-CD1 4.42Å; Y430-I432 HydrophobicContact CD2-CG1 3.76Å; Y430-I432 HydrophobicContact CE2-CD1 3.99Å; Y430-I432 HydrophobicContact CE2-CG1 3.84Å
433	C	95.8	Very high	86.3	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	113.6	-178.5	-70.6	0	0	0	0	110.8	S339 H341 T415 S416 S417 N435	S339-C433 PolarHBondContact N-O 3.1Å; S339-C433 PolarHBondContact O-N 3.37Å; H341-C433 PolarHBondContact CD2-SG 3.11Å; T415-C433 HydrophobicContact CG2-CB 3.77Å; S416-C433 WeakPolarHBondContact O-CA 3.25Å; S417-C433 WeakPolarHBondContact CB-SG 3.48Å; C433-N435 PolarHBondContact O-ND2 3.37Å
434	T	94.9	Very high	85.1	Confident	34 Å²	34	63.6 Å²	63.6	21%	0.209	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	122	166.1	-54.9	0	0	0	0	108.8	L338 T415 S416	L338-T434 HydrophobicContact CD2-CG2 4.26Å; L338-T434 WeakPolarHBondContact CD2-OG1 3.35Å; T415-T434 CarbonylContact C-O 3.51Å; T415-T434 VanDerWaalsContact CA-O 3.31Å; T415-T434 WeakPolarHBondContact CA-O 3.35Å; S416-T434 PolarHBondContact N-O 3.49Å; S416-T434 PolarHBondContact O-N 2.93Å
435	N	94.7	Very high	83.9	Confident	2 Å²	2	58 Å²	58	1%	0.011	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116.7	-171.3	-47	-81.7	0	0	0	108.8	E336 F337 S339 I413 T415 C433	E336-N435 CarbonylContact C-O 3.57Å; E336-N435 WeakPolarHBondContact CA-O 3.25Å; E336-N435 WeakPolarHBondContact CB-O 3.22Å; F337-N435 HydrophobicContact CD1-CB 4Å; F337-N435 HydrophobicContact CD2-CB 4.42Å; F337-N435 HydrophobicContact CE1-CB 3.59Å; F337-N435 HydrophobicContact CE2-CB 4.04Å; F337-N435 HydrophobicContact CG-CB 4.4Å; F337-N435 HydrophobicContact CZ-CB 3.6Å; F337-N435 PolarHBondContact N-O 2.91Å; F337-N435 WeakPolarHBondContact O-CB 3.09Å; F337-N435 PolarHBondContact O-N 3.24Å; F337-N435 PolarHBondContact O-ND2 3.27Å; S339-N435 PolarHBondContact OG-ND2 3.05Å; I413-N435 HydrophobicContact CG2-CB 4.07Å; T415-N435 VanDerWaalsContact CG2-OD1 3.27Å; T415-N435 WeakPolarHBondContact CG2-OD1 3.39Å; T415-N435 PolarHBondContact OG1-OD1 3.42Å; C433-N435 PolarHBondContact O-ND2 3.37Å
436	T	92.4	Very high	82.8	Confident	20 Å²	20	57.9 Å²	57.9	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.6	-173.2	-45.6	0	0	0	0	111.2	T335 E336 I413 R414 V438 L441	T335-T436 WeakPolarHBondContact O-CA 3.27Å; E336-T436 HydrophobicContact CB-CG2 4.22Å; I413-T436 WeakPolarHBondContact CA-O 3.41Å; R414-T436 PolarHBondContact N-O 2.87Å; R414-T436 PolarHBondContact O-N 3.28Å; T436-V438 PolarHBondContact O-N 2.71Å; T436-L441 HydrophobicContact CG2-CB 4.25Å; T436-L441 HydrophobicContact CG2-CD2 4.02Å
437	N	90.3	Very high	81.7	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.053	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	112.3	172.8	177	-5.4	0	0	0	109.9	T335 V357 M411 K439 Q440 L441	T335-N437 PolarHBondContact O-N 3.1Å; V357-N437 HydrophobicContact CG1-CB 4.01Å; M411-N437 WeakPolarHBondContact CE-ND2 3.47Å; M411-N437 HydrophobicContact SD-CB 3.95Å; M411-N437 VanDerWaalsContact SD-CG 3.56Å; N437-K439 PolarHBondContact O-N 2.75Å; N437-K439 PolarHBondContact OD1-N 2.74Å; N437-Q440 HydrophobicContact CB-CB 4.12Å; N437-Q440 WeakPolarHBondContact ND2-CB 3.45Å; N437-Q440 PolarHBondContact ND2-OE1 2.96Å; N437-Q440 PolarHBondContact OD1-N 2.94Å; N437-L441 WeakPolarHBondContact O-CB 3.25Å; N437-L441 PolarHBondContact O-N 3.41Å; N437-L441 VanDerWaalsContact O-N 3.08Å
438	V	84.6	Confident	80.3	Confident	12 Å²	12	56.5 Å²	56.5	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-38.9	-171.8	179.6	0	0	0	0	112	M400 L412 R414 T436 Q442	M400-V438 HydrophobicContact CE-CG1 4.36Å; M400-V438 HydrophobicContact CE-CG2 4.16Å; L412-V438 HydrophobicContact CD2-CB 4.34Å; L412-V438 HydrophobicContact CD2-CG1 4.33Å; L412-V438 HydrophobicContact CG-CB 4.33Å; L412-V438 HydrophobicContact CG-CG2 4.24Å; L412-V438 WeakPolarHBondContact O-CG2 3.27Å; L412-V438 PolarHBondContact O-N 3.43Å; L412-V438 VanDerWaalsContact O-N 3.14Å; R414-V438 HydrophobicContact CB-CG2 3.88Å; T436-V438 PolarHBondContact O-N 2.71Å; V438-Q442 WeakPolarHBondContact O-CB 3.32Å; V438-Q442 VanDerWaalsContact O-CG 3.3Å; V438-Q442 WeakPolarHBondContact O-CG 3.4Å; V438-Q442 PolarHBondContact O-N 3.27Å; V438-Q442 VanDerWaalsContact O-N 3.09Å
439	K	75.9	Confident	78.9	Confident	143 Å²	143	58.7 Å²	58.7	62%	0.622	29%	0.289	S	S	*	.	H	α-helix	trans	-64.9	-47.3	-179.6	-68.9	-177.2	176.4	179.5	0	111.5	N437 Q442 Q443	N437-K439 PolarHBondContact O-N 2.75Å; N437-K439 PolarHBondContact OD1-N 2.74Å; K439-Q442 PolarHBondContact O-N 2.92Å; K439-Q443 PolarHBondContact O-N 2.97Å
440	Q	70.3	Confident	77.3	Confident	38 Å²	38	57.9 Å²	57.9	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-71.9	-34.9	-175	-162.7	-172.7	-34.5	0	0	111.6	V333 P334 T335 N437 Q444	V333-Q440 PolarHBondContact O-NE2 3.5Å; P334-Q440 VanDerWaalsContact C-NE2 3.32Å; P334-Q440 PolarHBondContact O-NE2 2.83Å; T335-Q440 HydrophobicContact CG2-CB 4.26Å; T335-Q440 HydrophobicContact CG2-CG 3.92Å; N437-Q440 HydrophobicContact CB-CB 4.12Å; N437-Q440 WeakPolarHBondContact ND2-CB 3.45Å; N437-Q440 PolarHBondContact ND2-OE1 2.96Å; N437-Q440 PolarHBondContact OD1-N 2.94Å; Q440-Q444 VanDerWaalsContact O-CB 3.3Å; Q440-Q444 WeakPolarHBondContact O-CB 3.31Å; Q440-Q444 PolarHBondContact O-N 2.94Å
441	L	68	Low	75.4	Confident	50 Å²	50	62.6 Å²	62.6	26%	0.262	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-45	170.2	-176.5	70.8	0	0	0	111.8	T436 N437 Q444 Q445	T436-L441 HydrophobicContact CG2-CB 4.25Å; T436-L441 HydrophobicContact CG2-CD2 4.02Å; N437-L441 WeakPolarHBondContact O-CB 3.25Å; N437-L441 PolarHBondContact O-N 3.41Å; N437-L441 VanDerWaalsContact O-N 3.08Å; L441-Q444 PolarHBondContact O-N 3.34Å; L441-Q445 WeakPolarHBondContact O-CB 3.37Å; L441-Q445 VanDerWaalsContact O-CG 3.31Å; L441-Q445 WeakPolarHBondContact O-CG 3.33Å; L441-Q445 PolarHBondContact O-N 3.19Å
442	Q	71.4	Confident	73.3	Confident	121 Å²	121	69.9 Å²	69.9	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-64.8	-42.6	178.4	-76.4	175.9	-31.4	0	0	112.2	V438 K439 Q445 A446	V438-Q442 WeakPolarHBondContact O-CB 3.32Å; V438-Q442 VanDerWaalsContact O-CG 3.3Å; V438-Q442 WeakPolarHBondContact O-CG 3.4Å; V438-Q442 PolarHBondContact O-N 3.27Å; V438-Q442 VanDerWaalsContact O-N 3.09Å; K439-Q442 PolarHBondContact O-N 2.92Å; Q442-Q445 PolarHBondContact O-N 2.86Å; Q442-A446 PolarHBondContact O-N 2.78Å
443	Q	65.9	Low	70.9	Confident	118 Å²	118	75.4 Å²	75.4	55%	0.551	37%	0.366	S	S	*	.	H	α-helix	trans	-60.4	-48.4	174.9	177.3	172.7	-8.6	0	0	111.4	K439 Q445 A446 E447	K439-Q443 PolarHBondContact O-N 2.97Å; Q443-Q445 VanDerWaalsContact C-N 3.31Å; Q443-Q445 PolarHBondContact O-N 3.22Å; Q443-A446 PolarHBondContact O-N 2.9Å; Q443-A446 VanDerWaalsContact O-N 3.16Å; Q443-E447 HydrophobicContact CG-CG 4.41Å; Q443-E447 WeakPolarHBondContact CG-OE1 3.46Å; Q443-E447 PolarHBondContact NE2-OE1 2.83Å; Q443-E447 WeakPolarHBondContact O-CG 3.12Å; Q443-E447 PolarHBondContact O-N 3.19Å
444	Q	63.7	Low	68.4	Low	45 Å²	45	79.9 Å²	79.9	21%	0.21	39%	0.391	C	S	.	.	H	α-helix	trans	-62	-37	178.8	-174.1	175	95.3	0	0	112.5	S332 Q440 L441 L448	S332-Q444 VanDerWaalsContact CB-NE2 3.35Å; Q440-Q444 VanDerWaalsContact O-CB 3.3Å; Q440-Q444 WeakPolarHBondContact O-CB 3.31Å; Q440-Q444 PolarHBondContact O-N 2.94Å; L441-Q444 PolarHBondContact O-N 3.34Å; Q444-L448 HydrophobicContact CG-CD1 4.36Å; Q444-L448 WeakPolarHBondContact O-CB 3.43Å; Q444-L448 WeakPolarHBondContact O-CD1 3.21Å; Q444-L448 VanDerWaalsContact O-CG 3.23Å; Q444-L448 WeakPolarHBondContact O-CG 3.49Å; Q444-L448 PolarHBondContact O-N 3.44Å
445	Q	64.9	Low	65.7	Low	105 Å²	105	81.4 Å²	81.4	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-42.8	173.5	-74.4	173.6	0.6	0	0	112	L441 Q442 Q443 L448 E449	L441-Q445 WeakPolarHBondContact O-CB 3.37Å; L441-Q445 VanDerWaalsContact O-CG 3.31Å; L441-Q445 WeakPolarHBondContact O-CG 3.33Å; L441-Q445 PolarHBondContact O-N 3.19Å; Q442-Q445 PolarHBondContact O-N 2.86Å; Q443-Q445 VanDerWaalsContact C-N 3.31Å; Q443-Q445 PolarHBondContact O-N 3.22Å; Q445-L448 PolarHBondContact O-N 2.94Å; Q445-E449 WeakPolarHBondContact O-CB 3.32Å; Q445-E449 PolarHBondContact O-N 2.96Å
446	A	66.8	Low	63.2	Low	52 Å²	52	87.2 Å²	87.2	43%	0.43	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-42.3	175.8	0	0	0	0	0	112.3	Q442 Q443 L448 E449 V450	Q442-A446 PolarHBondContact O-N 2.78Å; Q443-A446 PolarHBondContact O-N 2.9Å; Q443-A446 VanDerWaalsContact O-N 3.16Å; A446-L448 PolarHBondContact O-N 3.42Å; A446-E449 WeakPolarHBondContact O-CB 3.39Å; A446-E449 PolarHBondContact O-N 3.45Å; A446-V450 WeakPolarHBondContact O-CG2 3.42Å; A446-V450 PolarHBondContact O-N 3.25Å
447	E	62.4	Low	60.4	Low	92 Å²	92	90.1 Å²	90.1	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-41.8	176.2	-73.5	168.6	-175.2	0	0	111.7	Q443 V450 H451	Q443-E447 HydrophobicContact CG-CG 4.41Å; Q443-E447 WeakPolarHBondContact CG-OE1 3.46Å; Q443-E447 PolarHBondContact NE2-OE1 2.83Å; Q443-E447 WeakPolarHBondContact O-CG 3.12Å; Q443-E447 PolarHBondContact O-N 3.19Å; E447-V450 PolarHBondContact O-N 2.85Å; E447-H451 PolarHBondContact O-N 3.14Å; E447-H451 VanDerWaalsContact O-N 3.1Å; E447-H451 PolarHBondContact O-ND1 3.15Å
448	L	61	Low	57.7	Low	109 Å²	109	94.9 Å²	94.9	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-64.2	-38.7	173.4	-73	166.8	0	0	0	112.2	Q444 Q445 A446 V450 Q452	Q444-L448 HydrophobicContact CG-CD1 4.36Å; Q444-L448 WeakPolarHBondContact O-CB 3.43Å; Q444-L448 WeakPolarHBondContact O-CD1 3.21Å; Q444-L448 VanDerWaalsContact O-CG 3.23Å; Q444-L448 WeakPolarHBondContact O-CG 3.49Å; Q444-L448 PolarHBondContact O-N 3.44Å; Q445-L448 PolarHBondContact O-N 2.94Å; A446-L448 PolarHBondContact O-N 3.42Å; L448-V450 VanDerWaalsContact C-N 3.34Å; L448-Q452 WeakPolarHBondContact O-CB 3.22Å; L448-Q452 PolarHBondContact O-N 2.94Å
449	E	58.4	Low	55.2	Low	106 Å²	106	103.5 Å²	103.5	50%	0.495	53%	0.531	S	S	.	.	H	α-helix	trans	-66.9	-29.6	175.8	-101.2	-157.1	-124.7	0	0	113.8	Q445 A446 R453	Q445-E449 WeakPolarHBondContact O-CB 3.32Å; Q445-E449 PolarHBondContact O-N 2.96Å; A446-E449 WeakPolarHBondContact O-CB 3.39Å; A446-E449 PolarHBondContact O-N 3.45Å; E449-R453 WeakPolarHBondContact O-CG 3.42Å; E449-R453 PolarHBondContact O-NH1 3.35Å; E449-R453 IonicContact OE2-CZ 3.31Å; E449-R453 IonicContact OE2-NH1 2.81Å; E449-R453 PolarHBondContact OE2-NH1 3.03Å; E449-R453 IonicContact OE2-NH2 2.79Å; E449-R453 PolarHBondContact OE2-NH2 3.39Å
450	V	57.2	Low	53	Low	78 Å²	78	104.5 Å²	104.5	47%	0.473	54%	0.543	S	S	.	.	H	α-helix	trans	-74.5	-50.5	173.9	171.2	0	0	0	0	110.3	A446 E447 L448 Q452 R453 D454	A446-V450 WeakPolarHBondContact O-CG2 3.42Å; A446-V450 PolarHBondContact O-N 3.25Å; E447-V450 PolarHBondContact O-N 2.85Å; L448-V450 VanDerWaalsContact C-N 3.34Å; V450-Q452 PolarHBondContact O-N 3.49Å; V450-Q452 VanDerWaalsContact O-N 3.16Å; V450-R453 WeakPolarHBondContact O-CA 3.15Å; V450-R453 WeakPolarHBondContact O-CB 3.36Å; V450-R453 PolarHBondContact O-N 2.85Å; V450-D454 PolarHBondContact O-N 3.02Å
451	H	53.9	Low	51.3	Low	143 Å²	143	109.8 Å²	109.8	66%	0.662	57%	0.572	S	S	*	*	H	α-helix	trans	-59.5	-30.4	177.9	-73.2	83.2	0	0	0	113	E447 R453 G455	E447-H451 PolarHBondContact O-N 3.14Å; E447-H451 VanDerWaalsContact O-N 3.1Å; E447-H451 PolarHBondContact O-ND1 3.15Å; H451-R453 VanDerWaalsContact C-N 3.33Å; H451-G455 PolarHBondContact O-N 3.43Å; H451-G455 VanDerWaalsContact O-N 3.11Å
452	Q	50.8	Low	49.6	Very low	153 Å²	153	112.1 Å²	112.1	72%	0.715	59%	0.592	S	S	*	*	H	α-helix	trans	-72.5	-22.3	174.6	-169.5	168.5	108.2	0	0	113.7	L448 V450	L448-Q452 WeakPolarHBondContact O-CB 3.22Å; L448-Q452 PolarHBondContact O-N 2.94Å; V450-Q452 PolarHBondContact O-N 3.49Å; V450-Q452 VanDerWaalsContact O-N 3.16Å
453	R	45.7	Very low	47.6	Very low	152 Å²	152	115 Å²	115	57%	0.574	61%	0.606	S	S	*	*	H	α-helix	trans	-84.2	-45	173.8	-71.5	176.2	176.5	92.3	-6.1	111.5	E449 V450 H451 G455 L456	E449-R453 WeakPolarHBondContact O-CG 3.42Å; E449-R453 PolarHBondContact O-NH1 3.35Å; E449-R453 IonicContact OE2-CZ 3.31Å; E449-R453 IonicContact OE2-NH1 2.81Å; E449-R453 PolarHBondContact OE2-NH1 3.03Å; E449-R453 IonicContact OE2-NH2 2.79Å; E449-R453 PolarHBondContact OE2-NH2 3.39Å; V450-R453 WeakPolarHBondContact O-CA 3.15Å; V450-R453 WeakPolarHBondContact O-CB 3.36Å; V450-R453 PolarHBondContact O-N 2.85Å; H451-R453 VanDerWaalsContact C-N 3.33Å; R453-G455 VanDerWaalsContact C-N 3.28Å; R453-G455 PolarHBondContact O-N 3.25Å; R453-L456 PolarHBondContact O-N 3.47Å
454	D	42.6	Very low	45.9	Very low	95 Å²	95	115.4 Å²	115.4	51%	0.508	62%	0.616	S	S	.	*	H	α-helix	trans	-69.1	-26.6	179.5	-66	-34.6	0	0	0	112.9	V450 L456 S457	V450-D454 PolarHBondContact O-N 3.02Å; D454-L456 PolarHBondContact O-N 2.92Å; D454-S457 PolarHBondContact O-N 2.59Å; D454-S457 PolarHBondContact O-OG 2.92Å
455	G	38.6	Very low	44.3	Very low	65 Å²	65	119 Å²	119	67%	0.67	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-3.9	171.2	0	0	0	0	0	115.6	H451 R453	H451-G455 PolarHBondContact O-N 3.43Å; H451-G455 VanDerWaalsContact O-N 3.11Å; R453-G455 VanDerWaalsContact C-N 3.28Å; R453-G455 PolarHBondContact O-N 3.25Å
456	L	42.6	Very low	42.6	Very low	125 Å²	125	119.9 Å²	119.9	65%	0.654	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-2.6	178.7	-67.8	174.8	0	0	0	114.2	R453 D454 Y459	R453-L456 PolarHBondContact O-N 3.47Å; D454-L456 PolarHBondContact O-N 2.92Å; L456-Y459 WeakPolarHBondContact O-CE1 3.44Å
457	S	32.9	Very low	40.8	Very low	80 Å²	80	123 Å²	123	56%	0.559	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-20.1	-177.3	58.1	0	0	0	0	114.2	D454 Y459	D454-S457 PolarHBondContact O-N 2.59Å; D454-S457 PolarHBondContact O-OG 2.92Å; S457-Y459 PolarHBondContact O-N 3.09Å
458	S	33.4	Very low	39.2	Very low	111 Å²	111	126.3 Å²	126.3	78%	0.776	69%	0.692	S	S	*	*			trans	-85.2	68.8	-175.7	-173.5	0	0	0	0	113.8
459	Y	33.5	Very low	37.6	Very low	193 Å²	193	128.6 Å²	128.6	76%	0.757	70%	0.704	S	S	*	*			trans	-138.1	57.1	160.9	46.4	-98.3	0	0	0	111.5	L456 S457	L456-Y459 WeakPolarHBondContact O-CE1 3.44Å; S457-Y459 PolarHBondContact O-N 3.09Å
460	D	28.1	Very low	36.3	Very low	163 Å²	163	129.6 Å²	129.6	87%	0.872	72%	0.72	S	S	*	*			trans	-68.8	149.9	168	-161.7	10.5	0	0	0	111.1
461	L	34.6	Very low	35	Very low	150 Å²	150	130.9 Å²	130.9	79%	0.785	74%	0.738	S	S	*	*			trans	-118	139.8	-165.2	-174.8	68.2	0	0	0	111.4
462	S	32.2	Very low	33.7	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	74%	0.739	S	S	*	*			trans	73.8	145.6	-169.8	87.4	0	0	0	0	112.4
463	Q	30.2	Very low	32.7	Very low	182 Å²	182	125.9 Å²	125.9	85%	0.85	74%	0.741	S	S	*	*			cis	-130.2	157.2	44.5	-65.4	169.2	6.8	0	0	114
464	V	30	Very low	31.9	Very low	126 Å²	126	126.1 Å²	126.1	76%	0.764	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-86.3	131.3	175	-178.4	0	0	0	0	109.5	V466	V464-V466 PolarHBondContact O-N 2.86Å
465	P	30.3	Very low	31.2	Very low	121 Å²	121	129.2 Å²	129.2	79%	0.786	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-67.3	120.2	176.9	-19.8	32.5	0	0	0	112.2
466	V	28.7	Very low	30.7	Very low	123 Å²	123	130.9 Å²	130.9	75%	0.745	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-99.4	128.6	167.1	-176.3	0	0	0	0	108.4	V464 N468	V464-V466 PolarHBondContact O-N 2.86Å; V466-N468 PolarHBondContact O-N 3.18Å
467	P	30.4	Very low	30.1	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-69.5	125.3	179.1	-19	32.2	0	0	0	112.2
468	N	29	Very low	29.9	Very low	161 Å²	161	134.2 Å²	134.2	86%	0.861	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-86.9	141	172.1	-102.2	-2.5	0	0	0	111.8	V466	V466-N468 PolarHBondContact O-N 3.18Å
469	L	26.8	Very low	29.7	Very low	156 Å²	156	134.3 Å²	134.3	82%	0.817	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78.8	156.4	161.5	-77.7	95.3	0	0	0	110.5
470	P	30.8	Very low	29.4	Very low	128 Å²	128	130.7 Å²	130.7	83%	0.831	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74	134.7	-175.1	29.2	-35.2	0	0	0	112.9
471	A	29.9	Very low	29.4	Very low	104 Å²	104	131 Å²	131	86%	0.86	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-89.2	143.5	164.5	0	0	0	0	0	110.4
472	G	26.9	Very low	29.1	Very low	66 Å²	66	132.3 Å²	132.3	68%	0.68	78%	0.78	S	S	*	*			trans	-110.6	125.2	-172.9	0	0	0	0	0	115.2
473	V	28.5	Very low	28.9	Very low	125 Å²	125	131.8 Å²	131.8	76%	0.758	78%	0.782	S	S	*	*			trans	69.2	146.7	144.4	-135	0	0	0	0	120.5
474	H	29.7	Very low	28.6	Very low	158 Å²	158	130.4 Å²	130.4	73%	0.731	78%	0.78	S	S	*	*			trans	69.2	145	164.8	-65.3	-74.3	0	0	0	119.2
475	E	27.9	Very low	28.6	Very low	159 Å²	159	127.9 Å²	127.9	74%	0.743	77%	0.773	S	S	*	*			cis	-165.9	157.5	-30.3	-149.4	-179.7	143.9	0	0	110.3
476	A	28.9	Very low	28.5	Very low	101 Å²	101	129.3 Å²	129.3	84%	0.835	77%	0.772	S	S	*	*			trans	61.6	159.7	164.6	0	0	0	0	0	118.1
477	G	29	Very low	28.5	Very low	69 Å²	69	132.3 Å²	132.3	71%	0.711	78%	0.776	S	S	*	*			cis	176.2	107.2	-12.6	0	0	0	0	0	115.5
478	K	29.8	Very low	28.2	Very low	205 Å²	205	132.2 Å²	132.2	89%	0.891	78%	0.778	S	S	*	*			trans	57.2	146.1	155.7	-66	-174.7	177.3	179.7	0	121.6
479	S	27.8	Very low	28.2	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	77%	0.771	S	S	*	*			trans	79.1	152	148.5	86.1	0	0	0	0	117.4
480	V	28.9	Very low	28.1	Very low	117 Å²	117	129.9 Å²	129.9	71%	0.709	76%	0.758	S	S	*	*			cis	-163.8	150.6	-15.2	117.1	0	0	0	0	109.6
481	E	26.6	Very low	27.8	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.794	76%	0.756	S	S	*	*			trans	58.3	175.1	164.4	-77.3	175.4	149	0	0	119.7
482	K	28.1	Very low	27.8	Very low	177 Å²	177	135.4 Å²	135.4	77%	0.77	75%	0.75	S	S	*	*				-177.1	123.8	-50.7	175.1	-174.7	176.6	-172.1	0	110.4
483	A	28.7	Very low	28.6	Very low	88 Å²	88	136 Å²	136	73%	0.727	74%	0.742	S	S	*	*			trans	62.7	167.9	170.4	0	0	0	0	0	115.3
484	D	24.8	Very low	28.4	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	75%	0.746	S	S	*	*			cis	-151.9	-177.6	-2.1	-137.4	-35.7	0	0	0	111.6
485	A	28.9	Very low	28.3	Very low	74 Å²	74	142.9 Å²	142.9	61%	0.612	75%	0.754	S	S	*	*			trans	-18	157.6	158.3	0	0	0	0	0	119.8
486	I	28.4	Very low	28.2	Very low	150 Å²	150	138.7 Å²	138.7	77%	0.769	75%	0.746	S	S	*	*			cis	-170.5	158.8	6.5	-118.5	170.4	0	0	0	112
487	F	29	Very low	28.3	Very low	186 Å²	186	142.2 Å²	142.2	82%	0.816	75%	0.745	S	S	*	*			trans	45.1	134.5	159.7	-91.6	-113.7	0	0	0	124.8
488	S	24.7	Very low	28.1	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	75%	0.748	S	S	*	*			trans	-172.5	121.6	130.5	-76.5	0	0	0	0	107.6
489	Q	28	Very low	28.2	Very low	155 Å²	155	145.7 Å²	145.7	72%	0.724	75%	0.745	S	S	*	*				86.4	104.9	60.5	-169.6	163.4	23.6	0	0	115.2
490	E	24.6	Very low	28.2	Very low	114 Å²	114	145 Å²	145	53%	0.533	75%	0.746	S	S	.	*			trans	34.2	135.3	142.6	-62	-174.5	98.5	0	0	124.1
491	R	25.6	Very low	28	Very low	212 Å²	212	143 Å²	143	80%	0.8	75%	0.749	S	S	*	*			trans	70.9	151.8	132.9	-76.1	-165	-123.3	-157.1	5.7	119.6
492	D	29.6	Very low	28.1	Very low	136 Å²	136	142.7 Å²	142.7	73%	0.727	75%	0.752	S	S	*	*			cis	-157.2	-118.3	-13.3	-174.6	26.3	0	0	0	111.9
493	P	42.5	Very low	28.1	Very low	79 Å²	79	139.1 Å²	139.1	51%	0.513	75%	0.749	S	S	.	*				-115.1	173	-112.6	33.3	-20.1	0	0	0	118
494	R	26	Very low	28.2	Very low	225 Å²	225	139.5 Å²	139.5	85%	0.849	75%	0.752	S	S	*	*			trans	88.2	106.1	160	-57.3	171	-66.8	-175.6	0.1	117.3
495	F	25.8	Very low	28.5	Very low	202 Å²	202	137.6 Å²	137.6	89%	0.886	75%	0.751	S	S	*	*				-128.7	144.4	105.8	-147.8	-93.1	0	0	0	109.3
496	A	27.1	Very low	28.3	Very low	70 Å²	70	140.7 Å²	140.7	58%	0.579	75%	0.752	S	S	*	*			trans	-131.1	173.2	179.9	0	0	0	0	0	109.4
497	E	30	Very low	28.3	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.822	76%	0.758	S	S	*	*			trans	66.5	107.2	173.4	-52	-168.6	120.2	0	0	117
498	M	25.9	Very low	28.3	Very low	156 Å²	156	142 Å²	142	77%	0.768	75%	0.752	S	S	*	*				-158.3	131	107.6	-120.9	171.7	-78.5	0	0	112.1
499	F	30.7	Very low	28.5	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.833	75%	0.749	S	S	*	*			trans	60.8	121.2	175.4	-54.1	-77.2	0	0	0	116.9
500	A	27.9	Very low	28.5	Very low	98 Å²	98	144.1 Å²	144.1	81%	0.81	75%	0.753	S	S	*	*			cis	107.1	124.6	13.2	0	0	0	0	0	115.1
501	G	24.9	Very low	28.5	Very low	75 Å²	75	143.6 Å²	143.6	77%	0.773	76%	0.762	S	S	*	*			trans	92.5	137.8	-175.4	0	0	0	0	0	112.9
502	I	28.2	Very low	28.6	Very low	165 Å²	165	139.2 Å²	139.2	85%	0.846	76%	0.764	S	S	*	*			cis	-137.7	159.5	5	-64.2	176.9	0	0	0	109.6
503	S	28.8	Very low	28.5	Very low	101 Å²	101	138 Å²	138	71%	0.706	77%	0.772	S	S	*	*			trans	-46.4	137.4	178.9	47.2	0	0	0	0	115.3
504	A	31.8	Very low	27.9	Very low	96 Å²	96	139.8 Å²	139.8	79%	0.793	79%	0.787	S	S	*	*				64.8	145.7	71.2	0	0	0	0	0	113.9
505	S	29.1	Very low	28	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	79%	0.789	S	S	*	*			cis	-142.8	-174.4	6.7	62.6	0	0	0	0	109.9
506	E	26.6	Very low	28.1	Very low	139 Å²	139	129.9 Å²	129.9	65%	0.65	79%	0.79	S	S	*	*			cis	-152.3	166.2	3.9	-156.5	-115.1	35.2	0	0	109.8	K508	E506-K508 PolarHBondContact OE1-N 2.75Å
507	K	28.6	Very low	28.1	Very low	205 Å²	205	130.1 Å²	130.1	89%	0.891	80%	0.8	S	S	*	*			trans	-151.1	133.4	155.5	-95.9	-173	-177.5	175.1	0	109.5
508	K	28.6	Very low	28	Very low	160 Å²	160	128.3 Å²	128.3	70%	0.696	80%	0.801	S	S	*	*			trans	-113.4	113.4	177.6	-168	161.4	-175.9	175.6	0	111.6	E506	E506-K508 PolarHBondContact OE1-N 2.75Å
509	M	28.1	Very low	28.2	Very low	151 Å²	151	129.2 Å²	129.2	74%	0.744	80%	0.803	S	S	*	*				46.5	148.2	124.8	-61.7	175.2	160.8	0	0	120
510	M	27.9	Very low	28.2	Very low	164 Å²	164	128 Å²	128	81%	0.808	80%	0.8	S	S	*	*			cis	-154.9	-169.5	5.6	-127.4	164.1	84.4	0	0	113.5
511	S	25.6	Very low	28.3	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	80%	0.802	S	S	*	*			trans	-91.7	173.6	-166	51.8	0	0	0	0	116.5
512	S	26.1	Very low	28.3	Very low	120 Å²	120	136.9 Å²	136.9	84%	0.839	80%	0.801	S	S	*	*			trans	-60.5	152.5	177.7	-36.6	0	0	0	0	115.8
513	A	28.9	Very low	28.3	Very low	109 Å²	109	134.5 Å²	134.5	90%	0.901	80%	0.799	S	S	*	*			trans	-161.2	160.6	147.2	0	0	0	0	0	111.5
514	S	29.1	Very low	28.3	Very low	118 Å²	118	138.7 Å²	138.7	83%	0.825	81%	0.808	S	S	*	*			trans	-117.2	143.1	-177.7	54.9	0	0	0	0	112.6
515	A	28.2	Very low	28.2	Very low	107 Å²	107	137.8 Å²	137.8	88%	0.884	81%	0.808	S	S	*	*			trans	-158.8	160.7	161.2	0	0	0	0	0	111.5
516	A	28.6	Very low	28.4	Very low	111 Å²	111	137.5 Å²	137.5	92%	0.917	81%	0.806	S	S	*	*			trans	-97.6	159.8	177.7	0	0	0	0	0	112.6
517	G	26.1	Very low	29.2	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	81%	0.814	S	S	*	*			trans	-163.2	148.6	176.1	0	0	0	0	0	111.3
518	T	27.8	Very low	29.3	Very low	138 Å²	138	136.3 Å²	136.3	85%	0.847	81%	0.812	S	S	*	*			trans	-123	164.8	-165.5	-40.3	0	0	0	0	112.1
519	Q	29.9	Very low	30	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	81%	0.813	S	S	*	*			trans	79.7	122.7	172	-60.4	-171.4	-1.2	0	0	114.8
520	Q	30.8	Very low	30	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.762	82%	0.82	S	S	*	*				85.8	116.1	53.7	-82.9	-99	-15.8	0	0	113.4
521	I	30.2	Very low	29.8	Very low	166 Å²	166	128 Å²	128	85%	0.851	81%	0.812	S	S	*	*			trans	178.9	153.9	133.4	-92.4	155.1	0	0	0	109.8
522	Y	25.7	Very low	29.9	Very low	195 Å²	195	132 Å²	132	77%	0.765	82%	0.819	S	S	*	*			trans	-68.3	158.9	-176.4	-90.3	-106.2	0	0	0	113.6
523	S	27.9	Very low	30.1	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	82%	0.82	S	S	*	*				-169.1	148.5	80.1	-66.6	0	0	0	0	117.2
524	Q	29.1	Very low	30	Very low	189 Å²	189	130.6 Å²	130.6	88%	0.883	81%	0.814	S	S	*	*			trans	-10.2	142.9	157.7	-70.2	-76.1	1.9	0	0	120.5
525	G	29	Very low	30.1	Very low	78 Å²	78	135 Å²	135	80%	0.804	82%	0.818	S	S	*	*			trans	150.4	108.2	153.9	0	0	0	0	0	116.2
526	S	33.1	Very low	30	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	81%	0.811	S	S	*	*			trans	-134.9	153.9	162.7	85.4	0	0	0	0	109.1
527	P	44.2	Very low	29.8	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	81%	0.811	S	S	*	*				-141.6	172.4	73.6	34.3	-14.8	0	0	0	117.1
528	F	30	Very low	29.8	Very low	192 Å²	192	140.8 Å²	140.8	84%	0.842	81%	0.813	S	S	*	*			trans	-73.6	-179.9	175.1	-79.7	-78.2	0	0	0	114.5
529	P	44.7	Very low	29.8	Very low	110 Å²	110	139.8 Å²	139.8	71%	0.714	81%	0.812	S	S	*	*			cis	-134.7	149.5	-16.9	24.6	-3.2	0	0	0	116.2
530	S	26.7	Very low	29.5	Very low	129 Å²	129	137 Å²	137	90%	0.902	81%	0.812	S	S	*	*			trans	156.7	151.5	143.8	46.9	0	0	0	0	109.6
531	G	24.7	Very low	29.4	Very low	61 Å²	61	135.9 Å²	135.9	63%	0.629	82%	0.816	S	S	*	*			cis	-178.3	-174.7	-5.9	0	0	0	0	0	111.2
532	H	27	Very low	29.4	Very low	189 Å²	189	134.3 Å²	134.3	88%	0.875	81%	0.814	S	S	*	*			trans	77.2	140.5	172.1	-58.2	-80.7	0	0	0	121.2
533	S	30.1	Very low	29.3	Very low	123 Å²	123	133.1 Å²	133.1	86%	0.86	82%	0.815	S	S	*	*			trans	65.8	135.8	163.6	73.6	0	0	0	0	117.9
534	G	27.5	Very low	29.4	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	81%	0.812	S	S	*	*			cis	125.3	76.2	-5.4	0	0	0	0	0	113.5
535	K	30.3	Very low	29.4	Very low	210 Å²	210	130 Å²	130	91%	0.913	81%	0.806	S	S	*	*			trans	-134.5	122.4	160.1	-71.6	-169.6	176.6	-177.9	0	108.6
536	A	26.3	Very low	29.3	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	80%	0.8	S	S	*	*			trans	-87	148.8	176.5	0	0	0	0	0	110.5
537	F	25.6	Very low	29.2	Very low	208 Å²	208	131.2 Å²	131.2	91%	0.912	81%	0.806	S	S	*	*			trans	-126.8	114.2	154	-100.6	-84.8	0	0	0	107.5
538	S	25.6	Very low	28.5	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	81%	0.805	S	S	*	*			trans	-86.6	138.9	171.3	-58.8	0	0	0	0	109.2
539	S	26.6	Very low	28.2	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	81%	0.805	S	S	*	*			trans	-132.5	135.8	164.2	-170.4	0	0	0	0	108.8
540	S	25.4	Very low	27.5	Very low	118 Å²	118	133 Å²	133	83%	0.825	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85.3	123.3	-165	-56.9	0	0	0	0	112
541	V	28.5	Very low	27.4	Very low	139 Å²	139	135.9 Å²	135.9	84%	0.842	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.6	128.2	170.1	175.8	0	0	0	0	109.3
542	V	29	Very low	27.5	Very low	133 Å²	133	138.2 Å²	138.2	81%	0.806	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-74.8	131.9	174	177.5	0	0	0	0	109.6	V544	V542-V544 PolarHBondContact O-N 2.84Å
543	H	25.1	Very low	27.4	Very low	170 Å²	170	134.9 Å²	134.9	79%	0.787	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.5	121	-171.5	-157.8	-47.9	0	0	0	112
544	V	30.1	Very low	27.2	Very low	120 Å²	120	134 Å²	134	73%	0.727	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.2	131.4	165.8	-179.1	0	0	0	0	108.3	V542 G546	V542-V544 PolarHBondContact O-N 2.84Å; V544-G546 PolarHBondContact O-N 3.24Å
545	P	28.6	Very low	27.2	Very low	117 Å²	117	136 Å²	136	76%	0.76	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65.4	128.4	174.6	-21.7	34	0	0	0	111.3
546	G	27.6	Very low	27.1	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-71.1	155.9	177	0	0	0	0	0	112.9	V544	V544-G546 PolarHBondContact O-N 3.24Å
547	V	30.6	Very low	27.1	Very low	145 Å²	145	132 Å²	132	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.7	130	167.2	-176.4	0	0	0	0	107.9
548	N	28.6	Very low	27.4	Very low	148 Å²	148	130.6 Å²	130.6	79%	0.791	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.7	132.9	176.7	-84.8	-5.9	0	0	0	111.3
549	D	24.9	Very low	27.4	Very low	160 Å²	160	132.6 Å²	132.6	86%	0.856	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-58	137.7	165.8	-69.6	-71.3	0	0	0	111.8
550	I	28.8	Very low	27.4	Very low	158 Å²	158	135.5 Å²	135.5	81%	0.81	81%	0.808	S	S	*	*			trans	-106.1	108.6	164.7	-64.7	179.2	0	0	0	107.9	S552	I550-S552 PolarHBondContact O-N 2.87Å; I550-S552 VanDerWaalsContact O-N 3.1Å
551	Q	24.4	Very low	27.6	Very low	190 Å²	190	134.7 Å²	134.7	89%	0.888	80%	0.802	S	S	*	*			trans	-68.8	103.2	169.2	-72.8	-174.8	-29.8	0	0	110.2
552	S	27.1	Very low	27.5	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	80%	0.8	S	S	*	*			trans	-91.4	116.6	164.7	56.4	0	0	0	0	110.3	I550	I550-S552 PolarHBondContact O-N 2.87Å; I550-S552 VanDerWaalsContact O-N 3.1Å
553	S	25	Very low	27.5	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	80%	0.8	S	S	*	*			trans	-105.3	112	-176.3	46.5	0	0	0	0	112.7
554	S	26	Very low	27.5	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	79%	0.794	S	S	*	*			trans	-159.9	132.7	165.2	51.9	0	0	0	0	114.3
555	S	27.4	Very low	27.4	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	80%	0.799	S	S	*	*			trans	48	91.6	152.4	58.2	0	0	0	0	119.6	G557	S555-G557 PolarHBondContact O-N 2.79Å
556	T	27.7	Very low	27.4	Very low	150 Å²	150	141.6 Å²	141.6	92%	0.92	80%	0.803	S	S	*	*			trans	-73.6	112.8	158.6	-46.7	0	0	0	0	110.5
557	G	27.2	Very low	27.3	Very low	67 Å²	67	145.7 Å²	145.7	69%	0.691	81%	0.808	S	S	*	*			trans	-80	141.8	170.7	0	0	0	0	0	112.6	S555	S555-G557 PolarHBondContact O-N 2.79Å
558	Q	31.8	Very low	27.1	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	80%	0.798	S	S	*	*			trans	-52.2	138.2	-179.7	-60.1	161.7	-18.7	0	0	114.3
559	N	26	Very low	27	Very low	158 Å²	158	145.6 Å²	145.6	85%	0.845	80%	0.798	S	S	*	*				-165.3	165.5	98.2	-115	-61.8	0	0	0	115
560	M	26.1	Very low	27	Very low	178 Å²	178	144 Å²	144	88%	0.877	80%	0.799	S	S	*	*			trans	-136.9	119.9	-177.3	-137.4	-129.2	-52.6	0	0	111.7
561	S	29	Very low	27	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	80%	0.804	S	S	*	*			trans	-170.1	142.6	165.5	53.2	0	0	0	0	108.2
562	Q	27.9	Very low	27.1	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	81%	0.805	S	S	*	*			cis	-162.6	173.5	2.4	-124.5	173.3	24.5	0	0	110.1
563	I	27.2	Very low	27	Very low	156 Å²	156	142 Å²	142	80%	0.8	80%	0.796	S	S	*	*			trans	76.9	139.4	164.9	-58.2	140.1	0	0	0	116.3
564	S	25.7	Very low	27.1	Very low	94 Å²	94	148 Å²	148	66%	0.657	80%	0.801	S	S	*	*			cis	167.6	130.6	-42.6	167.8	0	0	0	0	108.9
565	R	29.1	Very low	27.2	Very low	224 Å²	224	149.5 Å²	149.5	85%	0.845	81%	0.806	S	S	*	*			trans	163.4	149.4	134.8	-90.5	160.7	-169.5	-106.8	-0.5	114
566	Q	27.5	Very low	27.1	Very low	180 Å²	180	147.1 Å²	147.1	84%	0.841	80%	0.799	S	S	*	*			trans	64.9	150.8	161.2	-69.5	170.1	-36.1	0	0	119.1
567	L	26.1	Very low	27.2	Very low	151 Å²	151	145.8 Å²	145.8	79%	0.791	80%	0.796	S	S	*	*			cis	-164.2	146.4	-39.6	-151.6	79.9	0	0	0	109.3
568	N	26.1	Very low	27.2	Very low	124 Å²	124	154.1 Å²	154.1	66%	0.663	81%	0.806	S	S	*	*			trans	45.2	115.1	162.5	-93.3	24.5	0	0	0	120.6
569	Q	25.6	Very low	27.6	Very low	167 Å²	167	150.7 Å²	150.7	78%	0.78	80%	0.8	S	S	*	*				91.4	115.5	72.8	-88	-168.5	-13.6	0	0	115.2
570	S	25.7	Very low	29	Very low	128 Å²	128	147.7 Å²	147.7	90%	0.895	79%	0.789	S	S	*	*			trans	-165.2	149.7	138.5	2.1	0	0	0	0	110.2
571	Q	28	Very low	29.3	Very low	192 Å²	192	148.5 Å²	148.5	90%	0.897	79%	0.788	S	S	*	*			trans	-114.6	146.6	176	-55.9	166.4	-74.7	0	0	110.4
572	V	26.8	Very low	30.1	Very low	153 Å²	153	149.7 Å²	149.7	93%	0.927	79%	0.793	S	S	*	*			trans	-147.7	153.2	144.5	-168.7	0	0	0	0	108
573	A	25	Very low	30.2	Very low	69 Å²	69	144.7 Å²	144.7	57%	0.57	79%	0.788	S	S	*	*			trans	-150.7	176.1	-178.9	0	0	0	0	0	112.9
574	W	28	Very low	30.5	Very low	247 Å²	247	145.6 Å²	145.6	94%	0.936	79%	0.788	S	S	*	*			trans	75.9	153.4	176.6	-46	99.6	0	0	0	115.1
575	T	26.6	Very low	30.7	Very low	136 Å²	136	148 Å²	148	83%	0.834	79%	0.789	S	S	*	*			cis	-125.4	170.9	11.9	51.8	0	0	0	0	110.8
576	G	26.9	Very low	30.6	Very low	65 Å²	65	144.6 Å²	144.6	67%	0.67	79%	0.786	S	S	*	*				92.4	136.1	51.7	0	0	0	0	0	111.3
577	S	28.2	Very low	31.3	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	78%	0.779	S	S	*	*			cis	-170.1	179.8	2.1	-72.6	0	0	0	0	111.8
578	R	28.4	Very low	31.5	Very low	241 Å²	241	138.6 Å²	138.6	91%	0.909	77%	0.774	S	S	*	*			trans	98.3	152.4	160.6	-86.3	-151.9	154.7	-148.1	-5.3	121.7
579	P	40.9	Very low	31.8	Very low	108 Å²	108	141.2 Å²	141.2	70%	0.701	78%	0.782	S	S	*	*			trans	-137.1	-127.7	-134.9	33.5	-4.2	0	0	0	117.7
580	P	54.3	Low	31.9	Very low	95 Å²	95	138.3 Å²	138.3	62%	0.617	78%	0.78	S	S	*	*				-139.1	-175.1	-101.6	45.5	-27.2	0	0	0	119.9
581	F	32.2	Very low	32	Very low	195 Å²	195	136.9 Å²	136.9	86%	0.855	77%	0.77	S	S	*	*			trans	72	161	159.4	-71.1	-54.8	0	0	0	120.3
582	P	46.8	Very low	32	Very low	127 Å²	127	137.9 Å²	137.9	83%	0.825	77%	0.772	S	S	*	*			cis	-119.2	-165.8	-6	38.1	-20.5	0	0	0	113.1
583	G	29.9	Very low	32	Very low	65 Å²	65	136.2 Å²	136.2	67%	0.67	76%	0.762	S	S	*	*			cis	148.5	150.2	-14.8	0	0	0	0	0	115.3
584	Q	32.3	Very low	32.2	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	77%	0.774	S	S	*	*			trans	74.3	149.2	167.5	-58.1	-174.6	5.4	0	0	118.9
585	Q	29.8	Very low	32.3	Very low	145 Å²	145	134.5 Å²	134.5	68%	0.678	76%	0.764	S	S	*	*			cis	-158.4	143.6	-12	-101.3	158.8	3.4	0	0	107.2
586	I	28	Very low	32.4	Very low	151 Å²	151	132.5 Å²	132.5	77%	0.774	76%	0.756	S	S	*	*				69.4	139.3	62.2	-63.3	175.2	0	0	0	112.7
587	P	42.5	Very low	33.6	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	76%	0.758	S	S	*	*			cis	-108.6	-167.2	7.4	33.7	-13.9	0	0	0	112.4
588	S	29.8	Very low	33.7	Very low	98 Å²	98	137.9 Å²	137.9	69%	0.685	76%	0.757	S	S	*	*			cis	74.4	151.6	18.1	103.4	0	0	0	0	116.9
589	Q	31.6	Very low	33.7	Very low	178 Å²	178	129.9 Å²	129.9	83%	0.832	75%	0.75	S	S	*	*			cis	-108.2	-151.8	-2.5	-57.4	-175.2	28.3	0	0	109.8
590	S	28.2	Very low	33.4	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	76%	0.757	S	S	*	*			cis	-165.2	-172.3	3.3	61.9	0	0	0	0	108.5
591	S	27.8	Very low	32.1	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	76%	0.764	S	S	*	*				-168.9	128.7	-65.5	63.3	0	0	0	0	109.6
592	K	27.8	Very low	32	Very low	214 Å²	214	128.4 Å²	128.4	93%	0.93	76%	0.76	S	S	*	*			trans	-164.2	137	144.9	-115.8	174.4	-173.8	179.7	0	112.7
593	T	28	Very low	31.2	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.724	75%	0.752	S	S	*	*			trans	-86.6	176.9	177.4	52.6	0	0	0	0	110.7
594	Q	29.2	Very low	31.1	Very low	173 Å²	173	132.5 Å²	132.5	81%	0.808	76%	0.761	S	S	*	*			cis	-151.6	-173	11.5	-142.3	132.9	-27	0	0	107.4
595	S	28.4	Very low	30.9	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	75%	0.754	S	S	*	*			cis	-154.8	-154.1	12.3	66.4	0	0	0	0	112.2
596	S	29.9	Very low	30.8	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	76%	0.762	S	S	*	*			trans	-151.6	-160.5	167.6	-141.9	0	0	0	0	105.7
597	P	52.1	Low	31.6	Very low	108 Å²	108	131.7 Å²	131.7	70%	0.701	77%	0.765	S	S	*	*			cis	-141.8	166.4	5.8	40.8	-20	0	0	0	119.3
598	F	31	Very low	30.9	Very low	192 Å²	192	130.6 Å²	130.6	84%	0.842	77%	0.765	S	S	*	*			trans	19.1	147.3	142.4	-70.5	-93.9	0	0	0	125
599	G	27.6	Very low	30.7	Very low	73 Å²	73	133.3 Å²	133.3	75%	0.753	77%	0.772	S	S	*	*			trans	-168	143.6	153.4	0	0	0	0	0	112.9
600	I	33.8	Very low	31.4	Very low	167 Å²	167	129.7 Å²	129.7	86%	0.856	76%	0.764	S	S	*	*			trans	-136.7	142.8	-179.8	-66.9	174.5	0	0	0	109.3
601	G	28.1	Very low	31.5	Very low	74 Å²	74	129.4 Å²	129.4	76%	0.763	76%	0.762	S	S	*	*			trans	-165.3	149.5	176.2	0	0	0	0	0	114.1
602	T	30.3	Very low	31.5	Very low	126 Å²	126	129.3 Å²	129.3	77%	0.773	76%	0.761	S	S	*	*			trans	-113.6	152.8	-161	48.7	0	0	0	0	116.1
603	S	28.3	Very low	31.5	Very low	94 Å²	94	130.1 Å²	130.1	66%	0.657	76%	0.76	S	S	*	*			trans	57.3	131.8	142.6	62.3	0	0	0	0	122.6
604	H	29.3	Very low	31.6	Very low	183 Å²	183	129.6 Å²	129.6	85%	0.847	76%	0.761	S	S	*	*			trans	-171.3	-173.9	131.2	-98	-57.3	0	0	0	112
605	T	27.8	Very low	32.4	Very low	110 Å²	110	126.2 Å²	126.2	68%	0.675	75%	0.754	S	S	*	*			trans	-146.9	125.7	-137	-49.9	0	0	0	0	117.2
606	Y	27.9	Very low	32.5	Very low	215 Å²	215	128.8 Å²	128.8	84%	0.843	76%	0.759	S	S	*	*			trans	57.9	172.7	159.5	-80.2	-53.4	0	0	0	118.9
607	P	43.8	Very low	32.5	Very low	130 Å²	130	129.7 Å²	129.7	84%	0.844	77%	0.765	S	S	*	*			cis	-121.6	-149.3	11.4	43.7	-26.5	0	0	0	115.6
608	A	29.2	Very low	31.6	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	77%	0.768	S	S	*	*			trans	-140.7	167.2	-154.4	0	0	0	0	0	117.1
609	D	24.6	Very low	32.2	Very low	155 Å²	155	126.7 Å²	126.7	83%	0.829	77%	0.767	S	S	*	*			trans	68.2	166.9	150.4	-102.4	-6.5	0	0	0	120.5
610	P	46.4	Very low	32.3	Very low	102 Å²	102	127.1 Å²	127.1	66%	0.662	76%	0.764	S	S	*	*			cis	-137.2	167.8	-10.5	36.8	-18.1	0	0	0	117.8
611	S	30.3	Very low	32	Very low	101 Å²	101	126 Å²	126	71%	0.706	77%	0.765	S	S	*	*			trans	62.1	138.5	142.6	76.6	0	0	0	0	124.5
612	S	28.7	Very low	32.1	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	77%	0.765	S	S	*	*				152.6	126.4	106.8	-76.3	0	0	0	0	117.6
613	Y	27.7	Very low	32.3	Very low	231 Å²	231	127.1 Å²	127.1	91%	0.906	77%	0.766	S	S	*	*			trans	63.7	137.4	146.6	-82.3	-94.6	0	0	0	124.9
614	S	29.5	Very low	33.1	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	78%	0.775	S	S	*	*			trans	-90.2	-161.1	170.4	-39.9	0	0	0	0	110.9
615	P	46.5	Very low	33.2	Very low	102 Å²	102	126.2 Å²	126.2	66%	0.662	78%	0.777	S	S	*	*			cis	-143.6	-179.9	-2.5	44.4	-26	0	0	0	117.9
616	L	29.7	Very low	33.4	Very low	160 Å²	160	124.3 Å²	124.3	84%	0.838	78%	0.78	S	S	*	*			trans	63.8	158.1	153.6	-70	157.1	0	0	0	118
617	S	30.7	Very low	33.6	Very low	113 Å²	113	122 Å²	122	79%	0.79	78%	0.782	S	S	*	*			cis	-152.9	161.6	27.9	-51.3	0	0	0	0	114.4
618	S	33.4	Very low	32.9	Very low	111 Å²	111	119.9 Å²	119.9	78%	0.776	78%	0.775	S	S	*	*			trans	-88.9	166.7	156.9	-42	0	0	0	0	110.2
619	P	42.7	Very low	32.8	Very low	126 Å²	126	126.6 Å²	126.6	82%	0.818	78%	0.784	S	S	*	*				-130.3	171.2	54.9	13.3	13.4	0	0	0	113.3
620	A	28.7	Very low	33	Very low	82 Å²	82	125 Å²	125	68%	0.678	79%	0.786	S	S	*	*			cis	107.1	134.2	26.9	0	0	0	0	0	114.5
621	T	29.2	Very low	32.2	Very low	145 Å²	145	125 Å²	125	89%	0.89	79%	0.788	S	S	*	*			trans	69.8	158.4	-179.7	85.7	0	0	0	0	115.3
622	S	29.9	Very low	32.3	Very low	108 Å²	108	128.1 Å²	128.1	76%	0.755	80%	0.796	S	S	*	*			cis	-150	165	1.8	51.6	0	0	0	0	111.5
623	S	33.9	Very low	32.3	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	80%	0.798	S	S	*	*			trans	-75.9	166	167.2	-49.1	0	0	0	0	112
624	P	44.7	Very low	32.4	Very low	131 Å²	131	124 Å²	124	85%	0.851	79%	0.794	S	S	*	*				-142.4	168.9	111.6	39.4	-28.3	0	0	0	115.1
625	S	33	Very low	32.4	Very low	127 Å²	127	130.5 Å²	130.5	89%	0.888	80%	0.802	S	S	*	*			trans	-115.8	150.4	167.9	49.5	0	0	0	0	110.2
626	G	30.5	Very low	31.7	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	81%	0.806	S	S	*	*			trans	167.6	89.5	176.1	0	0	0	0	0	118.7
627	N	31.7	Very low	32.2	Very low	165 Å²	165	130 Å²	130	88%	0.882	81%	0.806	S	S	*	*			trans	50.6	140.6	136.4	-66.7	-6.4	0	0	0	125.2
628	A	29.2	Very low	32.1	Very low	86 Å²	86	127.5 Å²	127.5	71%	0.711	80%	0.799	S	S	*	*			trans	96.7	123.5	133.8	0	0	0	0	0	122
629	Y	27.3	Very low	31.7	Very low	225 Å²	225	132.6 Å²	132.6	88%	0.882	81%	0.807	S	S	*	*			trans	37.3	129.4	145.7	-70.3	-93	0	0	0	119.9
630	S	28.6	Very low	31	Very low	122 Å²	122	130.6 Å²	130.6	85%	0.853	80%	0.802	S	S	*	*				-172.7	-173.4	71.5	41.5	0	0	0	0	112.9
631	S	30.9	Very low	31	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	81%	0.81	S	S	*	*			trans	-111.9	-176.8	-162.5	56	0	0	0	0	115.4
632	L	31.5	Very low	30.9	Very low	165 Å²	165	134 Å²	134	86%	0.864	81%	0.805	S	S	*	*			trans	95.9	149.4	-179.2	-75.1	77.7	0	0	0	115.5
633	A	29.7	Very low	30.7	Very low	86 Å²	86	132.6 Å²	132.6	71%	0.711	81%	0.808	S	S	*	*			cis	-170	164.8	-24.4	0	0	0	0	0	110
634	N	30.3	Very low	30.5	Very low	154 Å²	154	136 Å²	136	82%	0.824	81%	0.812	S	S	*	*			trans	-17.3	136.6	170	-67.4	-15.1	0	0	0	119
635	R	29.1	Very low	29.7	Very low	244 Å²	244	134.9 Å²	134.9	92%	0.921	81%	0.807	S	S	*	*				-156	105.3	128.8	-114	169.4	-165.4	-127.4	1.1	113.4
636	T	31.1	Very low	29.4	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	80%	0.804	S	S	*	*			trans	-68	158.7	151.9	-16.3	0	0	0	0	109.1
637	P	40.3	Very low	29.3	Very low	128 Å²	128	135 Å²	135	83%	0.831	81%	0.809	S	S	*	*				-129.5	143.7	111.8	36	-30.6	0	0	0	111.9
638	G	28.5	Very low	29.1	Very low	62 Å²	62	136.4 Å²	136.4	64%	0.639	81%	0.81	S	S	*	*			trans	-99.9	157	162.7	0	0	0	0	0	110.2
639	F	25.7	Very low	28.9	Very low	218 Å²	218	142.1 Å²	142.1	96%	0.956	82%	0.82	S	S	*	*			trans	-141.3	150	155.9	-123.8	-87.7	0	0	0	108.1
640	A	28.5	Very low	28.9	Very low	84 Å²	84	140.6 Å²	140.6	69%	0.694	82%	0.821	S	S	*	*			trans	-142.6	155.7	-173.1	0	0	0	0	0	110.5
641	E	27.1	Very low	28.8	Very low	185 Å²	185	138.5 Å²	138.5	86%	0.864	82%	0.819	S	S	*	*			trans	152.8	109.7	161.2	-89.7	-173.6	142.6	0	0	105.8
642	S	27.4	Very low	28.7	Very low	112 Å²	112	145.3 Å²	145.3	78%	0.783	83%	0.829	S	S	*	*				83	116	65.3	75.6	0	0	0	0	113.6
643	G	26.5	Very low	29.3	Very low	79 Å²	79	142.4 Å²	142.4	81%	0.814	82%	0.82	S	S	*	*			trans	-171.3	138.8	174.3	0	0	0	0	0	110.1
644	Q	30.1	Very low	29.1	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.874	83%	0.825	S	S	*	*			trans	-113.8	168.3	-171.7	-67.4	-178.1	-12.9	0	0	113.1
645	S	27.3	Very low	29.1	Very low	106 Å²	106	144.3 Å²	144.3	74%	0.741	82%	0.822	S	S	*	*			trans	97.4	129.6	143.9	78.4	0	0	0	0	120.9
646	S	26.4	Very low	29	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	81%	0.812	S	S	*	*			trans	50.2	122	143.8	55.5	0	0	0	0	122.1
647	G	27.7	Very low	28.7	Very low	81 Å²	81	144.3 Å²	144.3	84%	0.835	82%	0.821	S	S	*	*			trans	-166.4	86.3	160.3	0	0	0	0	0	111.6
648	Q	28.8	Very low	28.2	Very low	194 Å²	194	143.5 Å²	143.5	91%	0.907	82%	0.819	S	S	*	*			trans	-76.2	144.2	171.7	-70.8	177.3	-48.1	0	0	110.6
649	F	24.7	Very low	28.2	Very low	206 Å²	206	148.9 Å²	148.9	90%	0.904	83%	0.827	S	S	*	*			trans	-149.2	126.9	143.5	-121.3	-81.2	0	0	0	110.7
650	Q	27.8	Very low	28.2	Very low	193 Å²	193	147.7 Å²	147.7	90%	0.902	82%	0.816	S	S	*	*			trans	-113.3	137.5	163.5	-78.7	-172.7	-16.9	0	0	108.4
651	G	25.4	Very low	28.1	Very low	79 Å²	79	151.1 Å²	151.1	81%	0.814	82%	0.818	S	S	*	*			trans	-145.6	122.7	170.2	0	0	0	0	0	107.9
652	R	29.1	Very low	28.1	Very low	246 Å²	246	147.7 Å²	147.7	93%	0.928	81%	0.814	S	S	*	*			trans	-113.2	-173.6	-169.2	-130.2	-167.8	-172.3	-161	5.1	110.7
653	P	44.3	Very low	28.2	Very low	104 Å²	104	151 Å²	151	68%	0.675	82%	0.818	S	S	*	*				-107.3	-169.5	-123.5	43	-31.4	0	0	0	113.5
654	S	26	Very low	28.3	Very low	117 Å²	117	155.4 Å²	155.4	82%	0.818	82%	0.817	S	S	*	*			trans	-120.3	129.9	152.8	-168.4	0	0	0	0	110.3
655	E	28.9	Very low	28.3	Very low	162 Å²	162	156 Å²	156	76%	0.757	82%	0.819	S	S	*	*			trans	-81.6	-168.2	159.6	-61	161.3	157	0	0	107.1
656	V	27.3	Very low	28.3	Very low	120 Å²	120	154.2 Å²	154.2	73%	0.727	82%	0.817	S	S	*	*			cis	-155.3	135.8	18.7	175.7	0	0	0	0	108.6
657	W	24.4	Very low	28.5	Very low	247 Å²	247	158.1 Å²	158.1	94%	0.936	82%	0.822	S	S	*	*				-168	141.1	124.7	-117.1	-5.9	0	0	0	113.5
658	S	29.9	Very low	28.6	Very low	112 Å²	112	163.4 Å²	163.4	78%	0.783	83%	0.825	S	S	*	*			trans	-169.9	126	179.1	-74	0	0	0	0	109.6
659	Q	28.2	Very low	28.5	Very low	174 Å²	174	159.9 Å²	159.9	81%	0.813	82%	0.822	S	S	*	*			trans	165.8	153.2	169.3	-106.1	176.5	17.6	0	0	109.2
660	W	26.1	Very low	28.7	Very low	193 Å²	193	153.4 Å²	153.4	73%	0.731	81%	0.813	S	S	*	*			cis	-128.5	150	-14.5	-91.8	82.2	0	0	0	105.5
661	Q	27.6	Very low	28.7	Very low	156 Å²	156	152.2 Å²	152.2	73%	0.729	81%	0.807	S	S	*	*			cis	87.8	103.7	32.5	-151.8	-172.8	48.8	0	0	116
662	S	26.7	Very low	28.9	Very low	113 Å²	113	155.3 Å²	155.3	79%	0.79	80%	0.801	S	S	*	*			trans	171	149	159.2	-81.1	0	0	0	0	110.3
663	Q	28.8	Very low	29	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	79%	0.794	S	S	*	*			cis	-157	-172.7	-27.1	-140.4	-179	22.5	0	0	109.4
664	H	29	Very low	28.2	Very low	171 Å²	171	152.5 Å²	152.5	79%	0.792	80%	0.802	S	S	*	*			trans	-99.8	150.1	-164.3	-68.7	-106.7	0	0	0	116.7
665	H	30.1	Very low	28.3	Very low	200 Å²	200	155.4 Å²	155.4	93%	0.926	80%	0.802	S	S	*	*			trans	177.6	150.8	131.3	-84	-46.1	0	0	0	109.4
666	G	28.2	Very low	28.2	Very low	68 Å²	68	156.8 Å²	156.8	70%	0.701	81%	0.809	S	S	*	*			cis	137.4	93	-17.2	0	0	0	0	0	116
667	Q	29.6	Very low	28.3	Very low	201 Å²	201	159.3 Å²	159.3	94%	0.939	81%	0.812	S	S	*	*			trans	-162.5	170.4	155.5	-121.6	174.2	7.9	0	0	113.7
668	Q	29.5	Very low	30.1	Very low	192 Å²	192	153 Å²	153	90%	0.897	80%	0.803	S	S	*	*			trans	-134.2	151.2	-164.7	-57.6	168.2	-73.8	0	0	114.3
669	S	27.9	Very low	30	Very low	121 Å²	121	150.7 Å²	150.7	85%	0.846	80%	0.797	S	S	*	*			trans	-160.2	145.2	140.6	41	0	0	0	0	106.5
670	G	28.6	Very low	30.1	Very low	69 Å²	69	151.5 Å²	151.5	71%	0.711	80%	0.801	S	S	*	*			cis	97.2	116.3	27.4	0	0	0	0	0	107.8
671	E	27.3	Very low	30.3	Very low	168 Å²	168	147.4 Å²	147.4	79%	0.785	80%	0.798	S	S	*	*			cis	-146.4	137.8	20	-68.5	-174.2	93.6	0	0	110.9
672	Q	30.2	Very low	30.4	Very low	144 Å²	144	148.6 Å²	148.6	67%	0.673	80%	0.803	S	S	*	*				88.8	120.9	93.6	-69.8	-166.3	45.3	0	0	118.2
673	H	30.3	Very low	30.5	Very low	172 Å²	172	148.5 Å²	148.5	80%	0.796	80%	0.798	S	S	*	*			trans	59.5	156	145.5	-63.8	-55.3	0	0	0	120.9
674	S	26.8	Very low	30.5	Very low	119 Å²	119	148.6 Å²	148.6	83%	0.832	80%	0.795	S	S	*	*			cis	-139.9	167.3	12.1	59.2	0	0	0	0	114.1
675	H	29.8	Very low	30.5	Very low	178 Å²	178	148.7 Å²	148.7	82%	0.824	80%	0.796	S	S	*	*			trans	-97.3	150.3	176.1	-112.6	-45.5	0	0	0	111.3
676	Q	26.9	Very low	30.5	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	79%	0.786	S	S	*	*			trans	-159.8	164.2	131.7	-113.4	170.5	22.8	0	0	113.3
677	Q	29.5	Very low	30.7	Very low	173 Å²	173	148.6 Å²	148.6	81%	0.808	79%	0.791	S	S	*	*			trans	-165.3	176.7	-168.6	-129.5	-152.4	16.4	0	0	107.4
678	P	60.8	Low	30.7	Very low	115 Å²	115	150.9 Å²	150.9	75%	0.747	79%	0.79	S	S	*	*				-121.8	-177.8	-61.5	35.2	-18.3	0	0	0	113.1
679	G	27.7	Very low	31	Very low	63 Å²	63	145.5 Å²	145.5	65%	0.649	78%	0.779	S	S	*	*			trans	-164	133.6	160.7	0	0	0	0	0	110
680	Q	30.5	Very low	31.3	Very low	192 Å²	192	144.5 Å²	144.5	90%	0.897	77%	0.772	S	S	*	*				71.2	129.1	61.6	-77.8	-148.1	9.9	0	0	113.4
681	T	30.1	Very low	31.7	Very low	107 Å²	107	148 Å²	148	66%	0.656	78%	0.779	S	S	*	*			cis	-156.6	-173.9	-5.4	-65.4	0	0	0	0	108.4
682	E	29.6	Very low	32.3	Very low	180 Å²	180	144.1 Å²	144.1	84%	0.841	78%	0.777	S	S	*	*			trans	90.5	157.2	159.5	-56.3	-165.4	138.3	0	0	118.9
683	V	29.7	Very low	32.8	Very low	112 Å²	112	147.2 Å²	147.2	68%	0.679	79%	0.788	S	S	*	*				178.6	124	-54	139.5	0	0	0	0	107.9
684	F	28.2	Very low	33.5	Very low	184 Å²	184	148 Å²	148	81%	0.807	81%	0.813	S	S	*	*			trans	65	168.7	173.7	-76.4	-134.8	0	0	0	113.9
685	Q	29.7	Very low	33.8	Very low	173 Å²	173	149.5 Å²	149.5	81%	0.808	81%	0.812	S	S	*	*			cis	-144.1	142.2	14.7	-162.3	169.2	18.4	0	0	115.1
686	V	30	Very low	34	Very low	117 Å²	117	147.9 Å²	147.9	71%	0.709	81%	0.811	S	S	*	*			trans	-4.9	113.4	157	-172.2	0	0	0	0	119
687	N	33	Very low	34.4	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	81%	0.807	S	S	*	*				34.8	123	119.9	-146.4	8.6	0	0	0	119.6
688	R	29	Very low	34.7	Very low	248 Å²	248	143.9 Å²	143.9	94%	0.936	81%	0.807	S	S	*	*			trans	-145	123.6	155.5	-152.6	175.4	-165.6	176.1	4.9	111.7
689	A	36.6	Very low	33.1	Very low	79 Å²	79	145.8 Å²	145.8	65%	0.653	81%	0.811	S	S	*	*			trans	-90.4	157.9	174.5	0	0	0	0	0	111.7
690	S	34.1	Very low	33.4	Very low	101 Å²	101	151.3 Å²	151.3	71%	0.706	82%	0.821	S	S	*	*				157.2	134.2	117.8	-73.1	0	0	0	0	113.4
691	T	35.5	Very low	33.6	Very low	141 Å²	141	148.4 Å²	148.4	87%	0.865	82%	0.816	S	S	*	*			trans	63.8	159.8	152.2	55.4	0	0	0	0	117.4
692	A	40.5	Very low	33.9	Very low	88 Å²	88	151.5 Å²	151.5	73%	0.727	83%	0.828	S	S	*	*			cis	-140.5	174.4	12.6	0	0	0	0	0	113.7
693	F	41.2	Very low	34.3	Very low	209 Å²	209	149.2 Å²	149.2	92%	0.917	83%	0.827	S	S	*	*			trans	-42.6	141.9	168.6	-69.9	-103.6	0	0	0	114.6
694	S	43.9	Very low	34.7	Very low	188 Å²	188	152.5 Å²	152.5	100%	1.315	84%	0.84	S	S	*	*				-152.4	0	96.3	-166	0	0	0	0	111.9

Retrieved 694 of 694 residues in 792.2 ms (Link to these results)

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