A0A3Q0KBP2_SCHMA Loading...

Putative cell division cycle 20 (Cdc20) (Fizzy)

AlphaFold DB , UniProt , Accession A0A3Q0KBP2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 500 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	36.2	Very low	34.8	Very low	239 Å²	239	155.7 Å²	155.7	100%	1.177	85%	0.845	S	S	*	*				0	119.1	0	-153.2	179.4	-127.5	0	0	105.8
2	V	39.2	Very low	34.6	Very low	150 Å²	150	154.8 Å²	154.8	91%	0.909	84%	0.838	S	S	*	*			trans	72.2	116.5	-178.1	-157.8	0	0	0	0	116.9
3	L	30.3	Very low	34.9	Very low	159 Å²	159	156.3 Å²	156.3	83%	0.832	84%	0.843	S	S	*	*			trans	-100.9	173	-177.6	-89.5	153.1	0	0	0	110.9
4	S	34.2	Very low	35.1	Very low	119 Å²	119	152 Å²	152	83%	0.832	83%	0.831	S	S	*	*			trans	79.2	132.8	158.4	74.8	0	0	0	0	115.9
5	G	33.7	Very low	35.3	Very low	62 Å²	62	150.9 Å²	150.9	64%	0.639	84%	0.837	S	S	*	*			cis	125.8	137.8	21.6	0	0	0	0	0	107.4
6	F	36.4	Very low	35.3	Very low	220 Å²	220	146.3 Å²	146.3	97%	0.965	83%	0.834	S	S	*	*			trans	174.7	125.2	142.5	-95.6	-67.3	0	0	0	111.8
7	S	30.8	Very low	35.4	Very low	94 Å²	94	148.1 Å²	148.1	66%	0.657	84%	0.841	S	S	*	*			trans	-82.5	151.8	170.3	162.4	0	0	0	0	111.4
8	R	37.1	Very low	35.5	Very low	252 Å²	252	143.9 Å²	143.9	95%	0.951	84%	0.835	S	S	*	*			trans	-147.5	141.6	148.3	-74.5	-162.7	177.2	173.8	-0.7	112
9	T	35	Very low	35.7	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	83%	0.831	S	S	*	*			trans	-113.8	150.9	-169.4	42.5	0	0	0	0	113.8
10	F	32.2	Very low	35.6	Very low	190 Å²	190	143.1 Å²	143.1	83%	0.833	83%	0.832	S	S	*	*			trans	42.9	128.7	141.7	-92.9	-94.3	0	0	0	123.5
11	S	37.3	Very low	35.5	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	83%	0.834	S	S	*	*				-175.1	120.2	122.3	23.7	0	0	0	0	114.2
12	D	33	Very low	35.4	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	82%	0.822	S	S	*	*			trans	31.1	120.2	143.7	-55.6	-25.4	0	0	0	123.5
13	I	38.8	Very low	35	Very low	175 Å²	175	140.8 Å²	140.8	90%	0.897	82%	0.816	S	S	*	*			trans	-138.7	136.9	134.9	-61.8	-174.9	0	0	0	109.6
14	S	37.2	Very low	35.1	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	82%	0.82	S	S	*	*			trans	-87.2	152.2	-162.4	56	0	0	0	0	117
15	C	37.4	Very low	35	Very low	136 Å²	136	144.6 Å²	144.6	92%	0.919	82%	0.822	S	S	*	*			trans	73.1	119.4	144.7	-64.6	0	0	0	0	120.4
16	G	36.4	Very low	34.8	Very low	77 Å²	77	149.5 Å²	149.5	79%	0.794	83%	0.833	S	S	*	*			trans	171.9	92.5	162.2	0	0	0	0	0	111.4
17	D	37.1	Very low	34.8	Very low	177 Å²	177	144.1 Å²	144.1	95%	0.947	82%	0.823	S	S	*	*			trans	-56.3	147	-172.9	-65.7	-50.5	0	0	0	116.3
18	G	37.1	Very low	35	Very low	72 Å²	72	147 Å²	147	74%	0.742	83%	0.831	S	S	*	*			trans	156.9	79.6	158.7	0	0	0	0	0	117.2
19	S	39.7	Very low	34.8	Very low	109 Å²	109	143.7 Å²	143.7	76%	0.762	83%	0.826	S	S	*	*			trans	38.2	127.9	132.2	159.5	0	0	0	0	119
20	L	31.9	Very low	34.8	Very low	163 Å²	163	145.2 Å²	145.2	85%	0.853	83%	0.83	S	S	*	*			cis	-176.9	112.3	19.6	-96.6	163.6	0	0	0	106.5
21	S	35.1	Very low	35	Very low	124 Å²	124	141.6 Å²	141.6	87%	0.867	83%	0.827	S	S	*	*			trans	-168.8	77.3	155.9	52.4	0	0	0	0	111.1
22	R	33	Very low	34.9	Very low	247 Å²	247	140.9 Å²	140.9	93%	0.932	82%	0.822	S	S	*	*			trans	-137.7	110.8	159.7	-86.8	-170.3	179	-169.9	0.6	108.7
23	S	31.8	Very low	34.9	Very low	112 Å²	112	141.9 Å²	141.9	78%	0.783	82%	0.824	S	S	*	*			trans	154.7	107.5	134.8	63.2	0	0	0	0	109
24	L	31.4	Very low	34.9	Very low	175 Å²	175	141.1 Å²	141.1	92%	0.916	82%	0.822	S	S	*	*			trans	173.5	57.7	145.9	-92.5	158.1	0	0	0	110
25	Q	33.1	Very low	34.7	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	83%	0.834	S	S	*	*	S	Bend	trans	-134.3	141.4	149.6	-90.1	175.9	-11.8	0	0	105.1
26	D	29.7	Very low	34.7	Very low	165 Å²	165	145.5 Å²	145.5	88%	0.882	82%	0.821	S	S	*	*			trans	85.7	80.8	-173.7	-56.2	-24.1	0	0	0	116.9
27	S	35.4	Very low	34.8	Very low	106 Å²	106	151.8 Å²	151.8	74%	0.741	83%	0.827	S	S	*	*				-166	133.8	128.9	50.7	0	0	0	0	111.6
28	N	34.4	Very low	34.6	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	81%	0.813	S	S	*	*			trans	95.5	60	161.6	-55.5	-19.9	0	0	0	118.2
29	Q	33.4	Very low	34.7	Very low	183 Å²	183	151.5 Å²	151.5	86%	0.855	82%	0.821	S	S	*	*				-72.4	117.4	125.9	-68	-174.5	2.2	0	0	108.6
30	N	35.6	Very low	34.5	Very low	147 Å²	147	150.4 Å²	150.4	79%	0.786	81%	0.814	S	S	*	*				176.2	132.6	129.6	-97.7	-26.5	0	0	0	114.2
31	C	35.6	Very low	34.7	Very low	114 Å²	114	154.5 Å²	154.5	77%	0.77	82%	0.818	S	S	*	*			trans	71	138.7	152.9	-56.3	0	0	0	0	118.5
32	S	35.9	Very low	34.7	Very low	98 Å²	98	152 Å²	152	69%	0.685	81%	0.812	S	S	*	*			cis	-178.8	136.3	-16.3	48.1	0	0	0	0	106.1
33	M	33.4	Very low	34.8	Very low	165 Å²	165	150.5 Å²	150.5	81%	0.813	81%	0.812	S	S	*	*			trans	38.6	117.6	149.8	-57	-153.6	-64.8	0	0	120.5
34	N	38.3	Very low	35.3	Very low	158 Å²	158	151.2 Å²	151.2	85%	0.845	82%	0.817	S	S	*	*				-170.7	124.5	98.3	-92.6	-29.8	0	0	0	112.6
35	R	33.1	Very low	35.5	Very low	246 Å²	246	150.6 Å²	150.6	93%	0.928	82%	0.815	S	S	*	*			trans	-72.9	154.3	165.3	-74.5	174.6	168.7	172.8	-3.4	110.2
36	A	38.3	Very low	35.9	Very low	78 Å²	78	147.3 Å²	147.3	65%	0.645	81%	0.812	S	S	*	*				168.4	123.9	126.6	0	0	0	0	0	114.4
37	F	36.7	Very low	36.3	Very low	209 Å²	209	148.6 Å²	148.6	92%	0.917	81%	0.809	S	S	*	*			trans	49.8	123	140.3	-55.6	-75.4	0	0	0	119.1
38	G	33	Very low	36.5	Very low	63 Å²	63	149.4 Å²	149.4	65%	0.649	81%	0.81	S	S	*	*			cis	84	106.3	43.9	0	0	0	0	0	110.6
39	I	39.8	Very low	37.1	Very low	180 Å²	180	146.9 Å²	146.9	92%	0.923	80%	0.802	S	S	*	*			trans	-176.4	145.8	147.8	-89.1	148.2	0	0	0	110.9
40	S	34.8	Very low	37.5	Very low	87 Å²	87	144.1 Å²	144.1	61%	0.608	80%	0.798	S	S	*	*			trans	-93.7	176.2	-164.1	65.4	0	0	0	0	117.4
41	R	37.5	Very low	37.6	Very low	249 Å²	249	147.8 Å²	147.8	94%	0.94	80%	0.801	S	S	*	*			trans	77.9	142.9	154.9	-64.7	167.9	176.1	-169.5	-1	115.5
42	G	35.2	Very low	37.9	Very low	72 Å²	72	148.4 Å²	148.4	74%	0.742	80%	0.802	S	S	*	*			cis	159.6	135.3	3.3	0	0	0	0	0	109.4
43	K	35.1	Very low	38.2	Very low	215 Å²	215	149.3 Å²	149.3	94%	0.935	81%	0.805	S	S	*	*			trans	42.7	128.2	156.8	-65.9	-178.5	177	178.4	0	121.6
44	S	40.8	Very low	38.4	Very low	126 Å²	126	146.7 Å²	146.7	88%	0.881	80%	0.803	S	S	*	*				-166.2	151.4	120.8	61.1	0	0	0	0	113.4
45	N	36.2	Very low	38.3	Very low	163 Å²	163	150.9 Å²	150.9	87%	0.872	81%	0.807	S	S	*	*			trans	-88	158	-172	-83.7	-34.5	0	0	0	114.3
46	S	41.3	Very low	38.4	Very low	115 Å²	115	143 Å²	143	80%	0.804	80%	0.803	S	S	*	*				169.9	111.4	125.2	43.3	0	0	0	0	110.3
47	K	39	Very low	38.2	Very low	191 Å²	191	142.6 Å²	142.6	83%	0.83	81%	0.806	S	S	*	*				62.5	94.8	89.3	-82.8	-169.7	179.1	-178	0	114.8
48	T	38.4	Very low	38.4	Very low	124 Å²	124	140.9 Å²	140.9	76%	0.761	81%	0.805	S	S	*	*				85.6	167.6	96.8	47.5	0	0	0	0	115.1
49	P	47.9	Very low	38.8	Very low	101 Å²	101	144.1 Å²	144.1	66%	0.656	81%	0.812	S	S	*	*				-142.2	-166.3	-51.6	40.7	-21.9	0	0	0	113.9
50	T	40.7	Very low	39	Very low	126 Å²	126	139.7 Å²	139.7	77%	0.773	80%	0.797	S	S	*	*			trans	79.6	146.5	158	60.2	0	0	0	0	118.6
51	R	38.5	Very low	39.4	Very low	224 Å²	224	142.3 Å²	142.3	85%	0.845	80%	0.804	S	S	*	*			cis	-170.4	145.8	22.4	-128.4	165	90.6	-168.2	9.9	110.1
52	T	42.8	Very low	39.9	Very low	127 Å²	127	137.2 Å²	137.2	78%	0.779	80%	0.796	S	S	*	*			trans	-83.9	162.8	152.3	45.4	0	0	0	0	109.4
53	P	42.5	Very low	40.6	Very low	117 Å²	117	138.5 Å²	138.5	76%	0.76	79%	0.791	S	S	*	*				-161.6	-167.8	75.4	41.2	-15.7	0	0	0	117.5
54	S	36.6	Very low	41.1	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	78%	0.781	S	S	*	*			trans	-79.6	163	-174.4	55.5	0	0	0	0	119.5
55	R	36.8	Very low	41.1	Very low	246 Å²	246	134.7 Å²	134.7	93%	0.928	78%	0.779	S	S	*	*			trans	112.9	131.9	132.6	-151.6	179.2	-168.1	-175.7	3.2	120.2
56	G	35.6	Very low	41.3	Very low	82 Å²	82	130.4 Å²	130.4	85%	0.845	76%	0.762	S	S	*	*			trans	88.6	143	152.8	0	0	0	0	0	116.8
57	G	34.2	Very low	41.4	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	76%	0.761	S	S	*	*			cis	162	163	3.7	0	0	0	0	0	109.6
58	L	40.5	Very low	41.6	Very low	173 Å²	173	133.4 Å²	133.4	91%	0.906	76%	0.761	S	S	*	*			trans	83.9	117.5	166.2	-55.7	155.9	0	0	0	116.6
59	V	40.2	Very low	41.6	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	77%	0.769	S	S	*	*				61	124.5	60.8	-170.3	0	0	0	0	110.7
60	S	44.7	Very low	41.5	Very low	88 Å²	88	141.2 Å²	141.2	62%	0.615	78%	0.779	S	S	*	*			cis	-172.3	165.7	48.4	2.1	0	0	0	0	113.6
61	D	44	Very low	41.6	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	78%	0.778	S	S	*	*			trans	65.7	143.1	140.3	-49.8	-19.6	0	0	0	120
62	D	46.9	Very low	41.6	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	78%	0.782	S	S	*	*			cis	-172.6	-164.3	21.1	-139.5	-0.3	0	0	0	110.9
63	P	50.4	Low	41.6	Very low	98 Å²	98	137 Å²	137	64%	0.636	78%	0.778	S	S	*	*				-133.6	-170.7	-107.3	43.6	-23.2	0	0	0	117.9
64	S	44.9	Very low	41.4	Very low	103 Å²	103	137.3 Å²	137.3	72%	0.72	78%	0.783	S	S	*	*			trans	85	118.9	153.7	78.4	0	0	0	0	120.3
65	N	41	Very low	41.7	Very low	158 Å²	158	139 Å²	139	85%	0.845	78%	0.782	S	S	*	*				-175.6	147.4	93	-121.8	-23.3	0	0	0	113.3
66	S	39.5	Very low	42	Very low	73 Å²	73	136.3 Å²	136.3	51%	0.51	78%	0.777	S	S	.	*			trans	-78.6	154.3	-171.7	50.7	0	0	0	0	115.5
67	F	44.7	Very low	42.2	Very low	179 Å²	179	142.1 Å²	142.1	79%	0.785	78%	0.779	S	S	*	*				169.8	133.2	107.5	-92	-65.3	0	0	0	114.7
68	K	43.9	Very low	42.3	Very low	190 Å²	190	145.8 Å²	145.8	83%	0.826	78%	0.781	S	S	*	*			trans	82.2	116.1	145.3	-66.8	176.9	-173.5	-178.5	0	121.1
69	R	37.5	Very low	42.3	Very low	247 Å²	247	142.8 Å²	142.8	93%	0.932	77%	0.772	S	S	*	*			trans	-68.5	147.2	169.6	-68.1	174	169.4	180	-4	112.7
70	T	46.3	Very low	42.3	Very low	142 Å²	142	142.8 Å²	142.8	87%	0.871	77%	0.772	S	S	*	*			trans	-152.4	154.2	144.5	17.3	0	0	0	0	109.6
71	P	42.4	Very low	42	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	78%	0.783	S	S	*	*			trans	-97.6	159.9	-147.6	37.2	-34.3	0	0	0	115.2
72	N	37.4	Very low	42	Very low	171 Å²	171	146.2 Å²	146.2	91%	0.914	78%	0.783	S	S	*	*			trans	11.9	110.5	159.5	-80.1	-7.5	0	0	0	118
73	S	44.6	Very low	42.2	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	79%	0.788	S	S	*	*			trans	-127	129.4	140.5	81.9	0	0	0	0	109.2	I75	S73-I75 PolarHBondContact O-N 3.01Å
74	S	37.5	Very low	42.3	Very low	123 Å²	123	149.4 Å²	149.4	86%	0.86	80%	0.796	S	S	*	*			trans	-62.2	93	175	47.6	0	0	0	0	110.1	K76	S74-K76 PolarHBondContact O-N 3.3Å
75	I	43.6	Very low	43	Very low	144 Å²	144	151.8 Å²	151.8	74%	0.738	80%	0.801	S	S	*	*			trans	-77.2	110.6	170.5	-66.8	171.5	0	0	0	107.3	S73 K77	S73-I75 PolarHBondContact O-N 3.01Å; I75-K77 PolarHBondContact O-N 3.14Å; I75-K77 VanDerWaalsContact O-N 3.14Å
76	K	41.4	Very low	44.2	Very low	191 Å²	191	145.7 Å²	145.7	83%	0.83	78%	0.776	S	S	*	*			trans	-47.7	118	167.9	-71.3	176.9	176.4	178.2	0	108.6	S74 I78	S74-K76 PolarHBondContact O-N 3.3Å; K76-I78 PolarHBondContact O-N 2.95Å
77	K	40.8	Very low	45.9	Very low	203 Å²	203	145.6 Å²	145.6	88%	0.883	77%	0.77	S	S	*	*			trans	-54.4	109.6	168.2	-81.2	179.8	174.2	179.3	0	108.3	I75	I75-K77 PolarHBondContact O-N 3.14Å; I75-K77 VanDerWaalsContact O-N 3.14Å
78	I	37	Very low	47.6	Very low	147 Å²	147	146.8 Å²	146.8	75%	0.754	77%	0.769	S	S	*	*			trans	-61.5	126.2	161.3	-60.4	165.3	0	0	0	105.6	K76 T80	K76-I78 PolarHBondContact O-N 2.95Å; I78-T80 PolarHBondContact O-N 3.24Å
79	P	40.3	Very low	49.4	Very low	109 Å²	109	145.6 Å²	145.6	71%	0.708	76%	0.764	S	S	*	*			trans	-64.2	114.1	172	-9	23.4	0	0	0	107.2	V81	P79-V81 PolarHBondContact O-N 3.22Å
80	T	39.4	Very low	51.5	Low	131 Å²	131	139.2 Å²	139.2	80%	0.804	75%	0.747	S	S	*	*			trans	-52.8	122.6	164.3	41.7	0	0	0	0	107.9	I78 H82	I78-T80 PolarHBondContact O-N 3.24Å; T80-H82 PolarHBondContact O-N 3.06Å
81	V	38.6	Very low	53.1	Low	137 Å²	137	134.3 Å²	134.3	83%	0.83	72%	0.718	S	S	*	*			trans	-21.6	115.3	173.8	-179.5	0	0	0	0	111.4	P79 E83	P79-V81 PolarHBondContact O-N 3.22Å; V81-E83 PolarHBondContact O-N 3.42Å; V81-E83 VanDerWaalsContact O-N 3.13Å
82	H	44.1	Very low	55	Low	163 Å²	163	130.4 Å²	130.4	76%	0.755	69%	0.69	S	S	*	*			trans	-42.5	120.8	169.1	-94.3	-94.4	0	0	0	109	T80 C84	T80-H82 PolarHBondContact O-N 3.06Å; H82-C84 PolarHBondContact O-N 2.85Å
83	E	50.1	Low	57.1	Low	186 Å²	186	132.6 Å²	132.6	87%	0.869	69%	0.686	S	S	*	*			trans	-43.7	124.5	166.5	-71.7	176.4	135.7	0	0	108.4	V81 D85	V81-E83 PolarHBondContact O-N 3.42Å; V81-E83 VanDerWaalsContact O-N 3.13Å; E83-D85 PolarHBondContact O-N 2.81Å
84	C	54.2	Low	58.7	Low	122 Å²	122	132.8 Å²	132.8	82%	0.824	69%	0.687	S	S	*	*			trans	-35.3	98.1	-174.7	-83.6	0	0	0	0	112.7	H82 G86	H82-C84 PolarHBondContact O-N 2.85Å; C84-G86 PolarHBondContact O-N 3.21Å
85	D	58.7	Low	60.6	Low	153 Å²	153	127.5 Å²	127.5	82%	0.818	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-62.5	126.6	168	-139.8	1	0	0	0	106.3	E83	E83-D85 PolarHBondContact O-N 2.81Å
86	G	65.8	Low	62.4	Low	30 Å²	30	121.1 Å²	121.1	31%	0.309	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-56.2	141.7	-168.9	0	0	0	0	0	112.8	C84 Y141	C84-G86 PolarHBondContact O-N 3.21Å; G86-Y141 WeakPolarHBondContact CA-O 3.4Å
87	D	75.7	Confident	64.3	Low	72 Å²	72	116.2 Å²	116.2	39%	0.385	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-76.8	139	171.9	-177	-9.8	0	0	0	109.8	F89 I90 Y141	D87-F89 VanDerWaalsContact C-N 3.27Å; D87-F89 PolarHBondContact O-N 3.13Å; D87-F89 PolarHBondContact OD1-N 3.34Å; D87-I90 HydrophobicContact CB-CB 4.11Å; D87-I90 WeakPolarHBondContact OD2-CD1 3.3Å; D87-I90 VanDerWaalsContact OD2-CG1 3.3Å; D87-I90 WeakPolarHBondContact OD2-CG1 3.35Å; D87-Y141 WeakPolarHBondContact O-CD1 3.44Å
88	R	80.4	Confident	66.3	Low	203 Å²	203	111.3 Å²	111.3	77%	0.766	58%	0.582	S	S	*	*	S	Bend	trans	-65.6	-27.4	175	-178.4	175.1	-179.8	172.4	0.5	113.1	Y141	R88-Y141 VanDerWaalsContact O-CD1 3.23Å; R88-Y141 WeakPolarHBondContact O-CD1 3.24Å; R88-Y141 VanDerWaalsContact O-CE1 3.24Å; R88-Y141 WeakPolarHBondContact O-CE1 3.23Å
89	F	81.2	Confident	68.5	Low	166 Å²	166	109.3 Å²	109.3	73%	0.728	58%	0.58	S	S	*	*	S	Bend	trans	-104.2	-22.5	-172.9	-59.3	-74.1	0	0	0	113.4	D87	D87-F89 VanDerWaalsContact C-N 3.27Å; D87-F89 PolarHBondContact O-N 3.13Å; D87-F89 PolarHBondContact OD1-N 3.34Å
90	I	81.1	Confident	70.3	Confident	113 Å²	113	106.1 Å²	106.1	58%	0.579	55%	0.554	S	S	*	*	S	Bend	trans	-108.5	111.6	179.9	-57.9	176	0	0	0	109.6	D87 N92	D87-I90 HydrophobicContact CB-CB 4.11Å; D87-I90 WeakPolarHBondContact OD2-CD1 3.3Å; D87-I90 VanDerWaalsContact OD2-CG1 3.3Å; D87-I90 WeakPolarHBondContact OD2-CG1 3.35Å; I90-N92 PolarHBondContact O-N 3.38Å
91	P	81.9	Confident	72.3	Confident	39 Å²	39	100.2 Å²	100.2	25%	0.253	52%	0.519	S	S	.	.			trans	-57.5	134.3	176.9	-22.2	31.6	0	0	0	111.4	R93 L139 R140 Y141	P91-R93 PolarHBondContact O-N 3.47Å; P91-R93 VanDerWaalsContact O-N 3.14Å; P91-L139 HydrophobicContact CB-CB 4.39Å; P91-L139 HydrophobicContact CB-CD2 4.23Å; P91-L139 HydrophobicContact CG-CB 4.37Å; P91-L139 HydrophobicContact CG-CD1 4.01Å; P91-L139 HydrophobicContact CG-CD2 4.14Å; P91-L139 HydrophobicContact CG-CG 4.41Å; P91-R140 CarbonylContact C-O 3.58Å; P91-Y141 HydrophobicContact CB-CD1 4.48Å; P91-Y141 HydrophobicContact CB-CE1 4.25Å; P91-Y141 HydrophobicContact CG-CD1 4.36Å; P91-Y141 HydrophobicContact CG-CE1 3.68Å
92	N	81.2	Confident	74.5	Confident	34 Å²	34	103.5 Å²	103.5	18%	0.182	52%	0.516	C	S	.	.			trans	-74.2	111.1	178.2	179.9	-21.7	0	0	0	109.5	I90 S94 S95 T96 R140 Y141 A143	I90-N92 PolarHBondContact O-N 3.38Å; N92-S94 PolarHBondContact O-N 3.09Å; N92-S94 WeakPolarHBondContact OD1-CB 3.46Å; N92-S94 PolarHBondContact OD1-N 3.44Å; N92-S94 PolarHBondContact OD1-OG 2.98Å; N92-S95 WeakPolarHBondContact CB-OG 3.41Å; N92-S95 PolarHBondContact O-N 2.97Å; N92-S95 PolarHBondContact O-OG 3.27Å; N92-S95 PolarHBondContact OD1-N 3.06Å; N92-T96 WeakPolarHBondContact O-CB 3.35Å; N92-T96 PolarHBondContact O-N 2.8Å; N92-T96 PolarHBondContact O-OG1 3.1Å; N92-T96 VanDerWaalsContact O-OG1 3.1Å; N92-R140 PolarHBondContact N-O 3.48Å; N92-Y141 WeakPolarHBondContact CB-O 3.38Å; N92-A143 WeakPolarHBondContact ND2-CA 3.4Å; N92-A143 PolarHBondContact ND2-N 3.47Å
93	R	80.5	Confident	76.3	Confident	217 Å²	217	100.6 Å²	100.6	82%	0.819	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.3	-178.5	-167.3	173.3	-175.8	171.7	1.4	113.8	P91	P91-R93 PolarHBondContact O-N 3.47Å; P91-R93 VanDerWaalsContact O-N 3.14Å
94	S	79.5	Confident	77.8	Confident	105 Å²	105	93.4 Å²	93.4	73%	0.734	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-26	178.2	69.2	0	0	0	0	113.2	N92	N92-S94 PolarHBondContact O-N 3.09Å; N92-S94 WeakPolarHBondContact OD1-CB 3.46Å; N92-S94 PolarHBondContact OD1-N 3.44Å; N92-S94 PolarHBondContact OD1-OG 2.98Å
95	S	78.1	Confident	79.2	Confident	13 Å²	13	92.1 Å²	92.1	9%	0.091	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-24.1	-179.2	73.9	0	0	0	0	113.5	N92 R140 N142	N92-S95 WeakPolarHBondContact CB-OG 3.41Å; N92-S95 PolarHBondContact O-N 2.97Å; N92-S95 PolarHBondContact O-OG 3.27Å; N92-S95 PolarHBondContact OD1-N 3.06Å; S95-R140 WeakPolarHBondContact O-CD 3.27Å; S95-R140 WeakPolarHBondContact OG-CB 3.39Å; S95-R140 PolarHBondContact OG-O 2.87Å; S95-N142 WeakPolarHBondContact CB-O 3.34Å; S95-N142 PolarHBondContact OG-O 3.04Å; S95-N142 VanDerWaalsContact OG-O 3.09Å
96	T	79.9	Confident	80.3	Confident	10 Å²	10	93.3 Å²	93.3	6%	0.061	45%	0.448	C	S	.	.			trans	-87.8	120.2	-177.2	-61	0	0	0	0	111.2	N92 M98 L139 R140	N92-T96 WeakPolarHBondContact O-CB 3.35Å; N92-T96 PolarHBondContact O-N 2.8Å; N92-T96 PolarHBondContact O-OG1 3.1Å; N92-T96 VanDerWaalsContact O-OG1 3.1Å; T96-M98 HydrophobicContact CG2-CE 3.79Å; T96-M98 HydrophobicContact CG2-SD 3.83Å; T96-M98 PolarHBondContact O-N 2.98Å; T96-L139 HydrophobicContact CG2-CD2 4.02Å; T96-R140 PolarHBondContact OG1-N 3.09Å; T96-R140 PolarHBondContact OG1-O 3.05Å
97	N	81.6	Confident	80.8	Confident	88 Å²	88	97.4 Å²	97.4	47%	0.471	46%	0.458	S	S	.	.			trans	-81.4	97.1	171.4	-174.8	-28	0	0	0	110.3	C99 R100 A101	N97-C99 VanDerWaalsContact C-N 3.35Å; N97-C99 PolarHBondContact O-N 2.61Å; N97-C99 PolarHBondContact OD1-N 2.91Å; N97-R100 HydrophobicContact CB-CB 3.96Å; N97-R100 PolarHBondContact O-N 3.5Å; N97-R100 PolarHBondContact OD1-N 3.14Å; N97-A101 PolarHBondContact O-N 3.45Å
98	M	83.3	Confident	80.4	Confident	99 Å²	99	98.5 Å²	98.5	49%	0.488	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-34.1	-176.6	-64	-62.9	177.3	0	0	113.7	T96 A101 R102	T96-M98 HydrophobicContact CG2-CE 3.79Å; T96-M98 HydrophobicContact CG2-SD 3.83Å; T96-M98 PolarHBondContact O-N 2.98Å; M98-A101 PolarHBondContact O-N 3.43Å; M98-R102 WeakPolarHBondContact O-CB 3.21Å; M98-R102 PolarHBondContact O-N 3.24Å
99	C	82.1	Confident	79.8	Confident	105 Å²	105	95.3 Å²	95.3	71%	0.709	47%	0.468	S	S	*	.	H	α-helix	trans	-65.6	-43.9	177	-66.2	0	0	0	0	110.9	N97 R102 H103	N97-C99 VanDerWaalsContact C-N 3.35Å; N97-C99 PolarHBondContact O-N 2.61Å; N97-C99 PolarHBondContact OD1-N 2.91Å; C99-R102 PolarHBondContact O-N 2.85Å; C99-H103 PolarHBondContact O-N 3.07Å
100	R	79.6	Confident	79.2	Confident	43 Å²	43	93.1 Å²	93.1	16%	0.162	46%	0.46	C	S	.	.	H	α-helix	trans	-63.7	-47.4	174.3	-173.3	-152.4	175.7	118.5	14.1	111.6	N97 R102 H103 V104 N131 D132 S136	N97-R100 HydrophobicContact CB-CB 3.96Å; N97-R100 PolarHBondContact O-N 3.5Å; N97-R100 PolarHBondContact OD1-N 3.14Å; R100-R102 VanDerWaalsContact C-N 3.26Å; R100-R102 PolarHBondContact O-N 2.95Å; R100-H103 WeakPolarHBondContact O-CB 3.39Å; R100-H103 PolarHBondContact O-N 3.47Å; R100-V104 HydrophobicContact CG-CG2 4.26Å; R100-V104 WeakPolarHBondContact O-CG2 3.45Å; R100-V104 PolarHBondContact O-N 3.03Å; R100-N131 PolarHBondContact NH1-O 3.21Å; R100-D132 IonicContact CZ-OD1 3.55Å; R100-D132 IonicContact NE-OD1 3.44Å; R100-D132 IonicContact NH1-OD1 2.97Å; R100-D132 PolarHBondContact NH1-OD1 3.21Å; R100-D132 IonicContact NH2-OD1 3.93Å; R100-D132 PolarHBondContact NH2-OD1 3.5Å; R100-S136 PolarHBondContact NH1-OG 3.17Å; R100-S136 PolarHBondContact NH2-OG 3.05Å
101	A	81.1	Confident	78	Confident	7 Å²	7	94.9 Å²	94.9	6%	0.058	47%	0.471	C	S	.	.	H	α-helix	trans	-54.5	-45.4	178.6	0	0	0	0	0	111.3	N97 M98 V104 I105 I138	N97-A101 PolarHBondContact O-N 3.45Å; M98-A101 PolarHBondContact O-N 3.43Å; A101-V104 PolarHBondContact O-N 2.87Å; A101-I105 WeakPolarHBondContact O-CB 3.45Å; A101-I105 WeakPolarHBondContact O-CD1 3.36Å; A101-I105 WeakPolarHBondContact O-CG1 2.77Å; A101-I105 PolarHBondContact O-N 3.13Å; A101-I138 HydrophobicContact CB-CG2 3.79Å; A101-I138 WeakPolarHBondContact CB-O 3.22Å
102	R	84.7	Confident	76.8	Confident	205 Å²	205	99.3 Å²	99.3	77%	0.774	50%	0.499	S	S	*	.	H	α-helix	trans	-63.3	-40.8	175.6	-171.1	176.4	-175.1	160.2	2.3	112.9	M98 C99 R100 R106	M98-R102 WeakPolarHBondContact O-CB 3.21Å; M98-R102 PolarHBondContact O-N 3.24Å; C99-R102 PolarHBondContact O-N 2.85Å; R100-R102 VanDerWaalsContact C-N 3.26Å; R100-R102 PolarHBondContact O-N 2.95Å; R102-R106 WeakPolarHBondContact O-CB 3.21Å; R102-R106 PolarHBondContact O-N 2.92Å; R102-R106 VanDerWaalsContact O-N 3.09Å
103	H	82.2	Confident	75.6	Confident	102 Å²	102	101.7 Å²	101.7	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-48.4	176.7	174.7	69.9	0	0	0	111.9	C99 R100 I105 R106 K107	C99-H103 PolarHBondContact O-N 3.07Å; R100-H103 WeakPolarHBondContact O-CB 3.39Å; R100-H103 PolarHBondContact O-N 3.47Å; H103-I105 PolarHBondContact O-N 3.22Å; H103-R106 PolarHBondContact O-N 2.82Å; H103-R106 VanDerWaalsContact O-N 3.17Å; H103-K107 WeakPolarHBondContact O-CB 3.39Å; H103-K107 PolarHBondContact O-N 3.1Å
104	V	81	Confident	74.4	Confident	36 Å²	36	97.3 Å²	97.3	22%	0.218	51%	0.512	C	S	.	.	H	α-helix	trans	-61	-46	179.2	174.5	0	0	0	0	110.8	R100 A101 R106 K107 C108 I138	R100-V104 HydrophobicContact CG-CG2 4.26Å; R100-V104 WeakPolarHBondContact O-CG2 3.45Å; R100-V104 PolarHBondContact O-N 3.03Å; A101-V104 PolarHBondContact O-N 2.87Å; V104-R106 VanDerWaalsContact C-N 3.27Å; V104-R106 PolarHBondContact O-N 2.77Å; V104-K107 PolarHBondContact O-N 2.87Å; V104-C108 PolarHBondContact O-N 3.11Å; V104-C108 PolarHBondContact O-SG 3.12Å; V104-I138 HydrophobicContact CG1-CD1 4.02Å; V104-I138 HydrophobicContact CG1-CG1 4.04Å
105	I	82.7	Confident	73.5	Confident	94 Å²	94	101.1 Å²	101.1	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-59.5	-39.8	176.9	-68.4	165.3	0	0	0	111.3	A101 H103 I138	A101-I105 WeakPolarHBondContact O-CB 3.45Å; A101-I105 WeakPolarHBondContact O-CD1 3.36Å; A101-I105 WeakPolarHBondContact O-CG1 2.77Å; A101-I105 PolarHBondContact O-N 3.13Å; H103-I105 PolarHBondContact O-N 3.22Å; I105-I138 HydrophobicContact CD1-CG2 4.24Å; I105-I138 HydrophobicContact CG1-CG2 4.43Å
106	R	82.4	Confident	72.5	Confident	179 Å²	179	109.5 Å²	109.5	68%	0.675	56%	0.555	S	S	*	*	H	α-helix	trans	-69.1	-42	176.9	-173.5	179	176.9	178.4	0.7	112	R102 H103 V104 N109	R102-R106 WeakPolarHBondContact O-CB 3.21Å; R102-R106 PolarHBondContact O-N 2.92Å; R102-R106 VanDerWaalsContact O-N 3.09Å; H103-R106 PolarHBondContact O-N 2.82Å; H103-R106 VanDerWaalsContact O-N 3.17Å; V104-R106 VanDerWaalsContact C-N 3.27Å; V104-R106 PolarHBondContact O-N 2.77Å; R106-N109 WeakPolarHBondContact O-CB 3.37Å; R106-N109 PolarHBondContact O-N 3.08Å
107	K	76.1	Confident	71.9	Confident	115 Å²	115	110.3 Å²	110.3	50%	0.5	56%	0.563	S	S	.	*	H	α-helix	trans	-68.7	-33.1	-179.9	-168.4	-179.1	179.7	-177.6	0	112.3	H103 V104 N109 E110	H103-K107 WeakPolarHBondContact O-CB 3.39Å; H103-K107 PolarHBondContact O-N 3.1Å; V104-K107 PolarHBondContact O-N 2.87Å; K107-N109 PolarHBondContact O-N 3.03Å; K107-N109 VanDerWaalsContact O-N 3.14Å; K107-E110 PolarHBondContact O-N 2.86Å
108	C	68.6	Low	71.4	Confident	95 Å²	95	109.6 Å²	109.6	64%	0.642	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-16.2	172.8	-70.9	0	0	0	0	113.5	V104	V104-C108 PolarHBondContact O-N 3.11Å; V104-C108 PolarHBondContact O-SG 3.12Å
109	N	67.6	Low	70.9	Confident	136 Å²	136	111.5 Å²	111.5	73%	0.727	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	2.7	174.9	-64.3	-12.5	0	0	0	112.7	R106 K107	R106-N109 WeakPolarHBondContact O-CB 3.37Å; R106-N109 PolarHBondContact O-N 3.08Å; K107-N109 PolarHBondContact O-N 3.03Å; K107-N109 VanDerWaalsContact O-N 3.14Å
110	E	67.6	Low	70.7	Confident	120 Å²	120	114.6 Å²	114.6	56%	0.561	57%	0.572	S	S	*	*	S	Bend	trans	-101.2	131.2	174.2	-66.1	176.5	175	0	0	108.6	K107	K107-E110 PolarHBondContact O-N 2.86Å
111	D	56.3	Low	70.6	Confident	151 Å²	151	116.6 Å²	116.6	81%	0.807	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-62	139.7	179.1	-67.7	-46.8	0	0	0	110.8	S113	D111-S113 PolarHBondContact O-N 3.21Å
112	P	57.5	Low	70.4	Confident	131 Å²	131	119.2 Å²	119.2	85%	0.851	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-62.7	123.1	178.6	25.3	-31.6	0	0	0	109.9
113	S	54.7	Low	70.1	Confident	84 Å²	84	112 Å²	112	59%	0.587	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-102	129.4	174.1	46.2	0	0	0	0	110.3	D111	D111-S113 PolarHBondContact O-N 3.21Å
114	N	56.4	Low	70.1	Confident	126 Å²	126	109.4 Å²	109.4	67%	0.674	57%	0.57	S	S	*	*			trans	43.1	106.1	175.1	-84.7	2.9	0	0	0	117.2	E116 A117	N114-E116 PolarHBondContact O-N 3.06Å; N114-A117 HydrophobicContact CB-CB 4.16Å; N114-A117 PolarHBondContact O-N 3.1Å
115	E	59.9	Low	69.9	Low	185 Å²	185	109.1 Å²	109.1	86%	0.864	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-56.3	-35.3	172.3	-66.1	-168.8	160.5	0	0	113	A117 V118	E115-A117 PolarHBondContact O-N 3.29Å; E115-V118 WeakPolarHBondContact O-CB 3.38Å; E115-V118 WeakPolarHBondContact O-CG2 3.49Å; E115-V118 PolarHBondContact O-N 2.84Å; E115-V118 VanDerWaalsContact O-N 3.15Å
116	E	58	Low	69.5	Low	188 Å²	188	108.2 Å²	108.2	88%	0.879	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-65.4	-23.5	178.2	-66.4	-171.7	156.8	0	0	113.7	N114	N114-E116 PolarHBondContact O-N 3.06Å
117	A	67.2	Low	69.5	Low	28 Å²	28	104.6 Å²	104.6	23%	0.231	57%	0.569	C	S	.	*	G	3₁₀ helix	trans	-88.2	-8.6	179.3	0	0	0	0	0	112.7	N114 E115 D119 Y120 Q121	N114-A117 HydrophobicContact CB-CB 4.16Å; N114-A117 PolarHBondContact O-N 3.1Å; E115-A117 PolarHBondContact O-N 3.29Å; A117-D119 PolarHBondContact O-N 3.38Å; A117-Y120 PolarHBondContact O-N 3.43Å; A117-Q121 HydrophobicContact CB-CG 4.36Å; A117-Q121 VanDerWaalsContact O-CB 3.24Å; A117-Q121 WeakPolarHBondContact O-CB 3.22Å; A117-Q121 WeakPolarHBondContact O-CG 3.49Å; A117-Q121 PolarHBondContact O-N 2.91Å
118	V	71.3	Confident	69.7	Low	73 Å²	73	105.3 Å²	105.3	44%	0.442	58%	0.578	S	S	.	*	H	α-helix	trans	-62.4	-45.5	-172.1	175.5	0	0	0	0	111.4	E115 Q121 Q122	E115-V118 WeakPolarHBondContact O-CB 3.38Å; E115-V118 WeakPolarHBondContact O-CG2 3.49Å; E115-V118 PolarHBondContact O-N 2.84Å; E115-V118 VanDerWaalsContact O-N 3.15Å; V118-Q121 PolarHBondContact O-N 2.82Å; V118-Q122 WeakPolarHBondContact O-CB 3.19Å; V118-Q122 PolarHBondContact O-N 2.81Å
119	D	71.3	Confident	69.7	Low	138 Å²	138	105 Å²	105	74%	0.738	57%	0.57	S	S	*	*	H	α-helix	trans	-66.1	-41.3	179.8	-78.4	-7.1	0	0	0	112.2	A117 Q122 A123	A117-D119 PolarHBondContact O-N 3.38Å; D119-Q122 PolarHBondContact O-N 3.07Å; D119-A123 WeakPolarHBondContact O-CB 3.41Å; D119-A123 PolarHBondContact O-N 2.97Å
120	Y	79.5	Confident	69.3	Low	171 Å²	171	104.8 Å²	104.8	67%	0.671	57%	0.574	S	S	*	*	H	α-helix	trans	-66.7	-45.6	175.9	175.4	-100.9	0	0	0	111.1	A117 Q122 A123 V124	A117-Y120 PolarHBondContact O-N 3.43Å; Y120-Q122 VanDerWaalsContact C-N 3.27Å; Y120-Q122 PolarHBondContact O-N 3.41Å; Y120-A123 PolarHBondContact O-N 3.46Å; Y120-V124 HydrophobicContact CD1-CG2 4.18Å; Y120-V124 HydrophobicContact CD2-CG2 4.28Å; Y120-V124 HydrophobicContact CE1-CG2 3.75Å; Y120-V124 HydrophobicContact CE2-CG2 3.85Å; Y120-V124 HydrophobicContact CG-CG2 4.44Å; Y120-V124 WeakPolarHBondContact O-CB 3.24Å; Y120-V124 VanDerWaalsContact O-CG2 3.26Å; Y120-V124 WeakPolarHBondContact O-CG2 3.47Å; Y120-V124 PolarHBondContact O-N 3.2Å
121	Q	77.5	Confident	68.9	Low	85 Å²	85	104.8 Å²	104.8	40%	0.397	58%	0.578	S	S	.	*	H	α-helix	trans	-60.8	-39.6	176.1	-75	176.9	17.9	0	0	111	A117 V118 V124 A125	A117-Q121 HydrophobicContact CB-CG 4.36Å; A117-Q121 VanDerWaalsContact O-CB 3.24Å; A117-Q121 WeakPolarHBondContact O-CB 3.22Å; A117-Q121 WeakPolarHBondContact O-CG 3.49Å; A117-Q121 PolarHBondContact O-N 2.91Å; V118-Q121 PolarHBondContact O-N 2.82Å; Q121-V124 PolarHBondContact O-N 2.76Å; Q121-A125 WeakPolarHBondContact O-CB 3.34Å; Q121-A125 PolarHBondContact O-N 2.97Å
122	Q	75.3	Confident	68.8	Low	61 Å²	61	99.1 Å²	99.1	29%	0.285	55%	0.547	S	S	.	.	H	α-helix	trans	-65.8	-47.5	175.8	-174.1	58.9	45.1	0	0	110.9	V118 D119 Y120 V124 A125 D126	V118-Q122 WeakPolarHBondContact O-CB 3.19Å; V118-Q122 PolarHBondContact O-N 2.81Å; D119-Q122 PolarHBondContact O-N 3.07Å; Y120-Q122 VanDerWaalsContact C-N 3.27Å; Y120-Q122 PolarHBondContact O-N 3.41Å; Q122-V124 VanDerWaalsContact C-N 3.31Å; Q122-V124 PolarHBondContact O-N 3.15Å; Q122-A125 PolarHBondContact O-N 2.65Å; Q122-A125 VanDerWaalsContact O-N 3.15Å; Q122-D126 PolarHBondContact NE2-OD1 2.92Å; Q122-D126 PolarHBondContact NE2-OD2 3.08Å; Q122-D126 WeakPolarHBondContact O-CB 3.36Å; Q122-D126 VanDerWaalsContact O-CG 3.25Å; Q122-D126 PolarHBondContact O-N 3.28Å
123	A	79.2	Confident	68.8	Low	53 Å²	53	96.7 Å²	96.7	44%	0.438	53%	0.533	S	S	.	.	H	α-helix	trans	-61.3	-39	176.8	0	0	0	0	0	112.6	D119 Y120 S127	D119-A123 WeakPolarHBondContact O-CB 3.41Å; D119-A123 PolarHBondContact O-N 2.97Å; Y120-A123 PolarHBondContact O-N 3.46Å; A123-S127 WeakPolarHBondContact O-CB 3.4Å; A123-S127 PolarHBondContact O-N 3.33Å; A123-S127 PolarHBondContact O-OG 3.23Å
124	V	82.4	Confident	68.7	Low	49 Å²	49	97 Å²	97	30%	0.297	53%	0.533	S	S	.	.	H	α-helix	trans	-67.6	-42.9	173.8	171.4	0	0	0	0	110.8	Y120 Q121 Q122 S127 L128	Y120-V124 HydrophobicContact CD1-CG2 4.18Å; Y120-V124 HydrophobicContact CD2-CG2 4.28Å; Y120-V124 HydrophobicContact CE1-CG2 3.75Å; Y120-V124 HydrophobicContact CE2-CG2 3.85Å; Y120-V124 HydrophobicContact CG-CG2 4.44Å; Y120-V124 WeakPolarHBondContact O-CB 3.24Å; Y120-V124 VanDerWaalsContact O-CG2 3.26Å; Y120-V124 WeakPolarHBondContact O-CG2 3.47Å; Y120-V124 PolarHBondContact O-N 3.2Å; Q121-V124 PolarHBondContact O-N 2.76Å; Q122-V124 VanDerWaalsContact C-N 3.31Å; Q122-V124 PolarHBondContact O-N 3.15Å; V124-S127 PolarHBondContact O-N 2.65Å; V124-L128 HydrophobicContact CG1-CD1 3.62Å; V124-L128 HydrophobicContact CG1-CG 4.19Å; V124-L128 WeakPolarHBondContact O-CB 3.38Å; V124-L128 VanDerWaalsContact O-CG 3.28Å; V124-L128 WeakPolarHBondContact O-CG 3.43Å; V124-L128 PolarHBondContact O-N 3.02Å
125	A	77.1	Confident	69	Low	30 Å²	30	94.9 Å²	94.9	25%	0.248	54%	0.54	C	S	.	.	H	α-helix	trans	-62.2	-45	177.1	0	0	0	0	0	111.7	Q121 Q122 S127 L128 N129	Q121-A125 WeakPolarHBondContact O-CB 3.34Å; Q121-A125 PolarHBondContact O-N 2.97Å; Q122-A125 PolarHBondContact O-N 2.65Å; Q122-A125 VanDerWaalsContact O-N 3.15Å; A125-S127 VanDerWaalsContact C-N 3.27Å; A125-S127 PolarHBondContact O-N 2.75Å; A125-L128 PolarHBondContact O-N 2.97Å; A125-N129 PolarHBondContact O-N 2.99Å
126	D	74.6	Confident	69.4	Low	75 Å²	75	87.6 Å²	87.6	40%	0.401	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-35.3	176	-70.2	-25	0	0	0	111.6	Q122	Q122-D126 PolarHBondContact NE2-OD1 2.92Å; Q122-D126 PolarHBondContact NE2-OD2 3.08Å; Q122-D126 WeakPolarHBondContact O-CB 3.36Å; Q122-D126 VanDerWaalsContact O-CG 3.25Å; Q122-D126 PolarHBondContact O-N 3.28Å
127	S	80.6	Confident	70.2	Confident	102 Å²	102	87.7 Å²	87.7	71%	0.713	50%	0.502	S	S	*	.	H	α-helix	trans	-74.6	-35.5	177.6	-60.7	0	0	0	0	113.2	A123 V124 A125	A123-S127 WeakPolarHBondContact O-CB 3.4Å; A123-S127 PolarHBondContact O-N 3.33Å; A123-S127 PolarHBondContact O-OG 3.23Å; V124-S127 PolarHBondContact O-N 2.65Å; A125-S127 VanDerWaalsContact C-N 3.27Å; A125-S127 PolarHBondContact O-N 2.75Å
128	L	80.8	Confident	71	Confident	131 Å²	131	89.8 Å²	89.8	69%	0.686	51%	0.509	S	S	*	.	H	α-helix	trans	-82.2	-37.9	-179.3	-70.8	173	0	0	0	112.2	V124 A125	V124-L128 HydrophobicContact CG1-CD1 3.62Å; V124-L128 HydrophobicContact CG1-CG 4.19Å; V124-L128 WeakPolarHBondContact O-CB 3.38Å; V124-L128 VanDerWaalsContact O-CG 3.28Å; V124-L128 WeakPolarHBondContact O-CG 3.43Å; V124-L128 PolarHBondContact O-N 3.02Å; A125-L128 PolarHBondContact O-N 2.97Å
129	N	69	Low	71.7	Confident	87 Å²	87	89.5 Å²	89.5	47%	0.465	50%	0.504	S	S	.	.			trans	-129.7	102.3	-174.9	-70.6	-15.9	0	0	0	110.1	A125 N131 D132	A125-N129 PolarHBondContact O-N 2.99Å; N129-N131 PolarHBondContact O-N 3.44Å; N129-D132 HydrophobicContact CB-CB 4Å; N129-D132 PolarHBondContact ND2-OD2 3.2Å; N129-D132 PolarHBondContact O-N 3.14Å
130	T	60	Low	72.2	Confident	133 Å²	133	88.2 Å²	88.2	82%	0.816	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-7.3	177.8	54.1	0	0	0	0	115.1
131	N	57.9	Low	72.3	Confident	119 Å²	119	83.7 Å²	83.7	64%	0.636	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-5.6	179.7	-75.4	-43.1	0	0	0	113.7	R100 N129 C133	R100-N131 PolarHBondContact NH1-O 3.21Å; N129-N131 PolarHBondContact O-N 3.44Å; N131-C133 PolarHBondContact O-N 2.99Å
132	D	55.6	Low	72.1	Confident	32 Å²	32	85.2 Å²	85.2	17%	0.171	48%	0.482	C	S	.	.			trans	-83.8	46	-177.8	-94.1	-28.9	0	0	0	113.3	R100 N129	R100-D132 IonicContact CZ-OD1 3.55Å; R100-D132 IonicContact NE-OD1 3.44Å; R100-D132 IonicContact NH1-OD1 2.97Å; R100-D132 PolarHBondContact NH1-OD1 3.21Å; R100-D132 IonicContact NH2-OD1 3.93Å; R100-D132 PolarHBondContact NH2-OD1 3.5Å; N129-D132 HydrophobicContact CB-CB 4Å; N129-D132 PolarHBondContact ND2-OD2 3.2Å; N129-D132 PolarHBondContact O-N 3.14Å
133	C	55.7	Low	71.4	Confident	81 Å²	81	84.9 Å²	84.9	55%	0.547	49%	0.49	S	S	.	.			trans	-69.2	133.2	173	-160.5	0	0	0	0	110.2	N131 G135 S136	N131-C133 PolarHBondContact O-N 2.99Å; C133-G135 PolarHBondContact O-N 3.19Å; C133-S136 PolarHBondContact O-N 3.33Å; C133-S136 PolarHBondContact O-OG 2.86Å
134	P	54	Low	70.3	Confident	91 Å²	91	85.1 Å²	85.1	59%	0.591	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	128.9	169.1	-23.2	32.9	0	0	0	110
135	G	62.1	Low	68.6	Low	80 Å²	80	89.7 Å²	89.7	83%	0.825	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.3	0.4	-176.4	0	0	0	0	0	115.6	C133 R137	C133-G135 PolarHBondContact O-N 3.19Å; G135-R137 PolarHBondContact O-N 2.83Å
136	S	67.9	Low	66.9	Low	32 Å²	32	99.1 Å²	99.1	22%	0.224	54%	0.542	C	S	.	.			trans	-65.5	128.5	169.8	-55	0	0	0	0	112.1	R100 C133	R100-S136 PolarHBondContact NH1-OG 3.17Å; R100-S136 PolarHBondContact NH2-OG 3.05Å; C133-S136 PolarHBondContact O-N 3.33Å; C133-S136 PolarHBondContact O-OG 2.86Å
137	R	76.2	Confident	65	Low	191 Å²	191	102.6 Å²	102.6	72%	0.721	56%	0.561	S	S	*	*			trans	-74	142.1	178.4	-59.4	-177.5	-176.6	174.6	1.4	112.4	G135 L139	G135-R137 PolarHBondContact O-N 2.83Å; R137-L139 WeakPolarHBondContact CB-O 3.46Å
138	I	83.8	Confident	62.7	Low	72 Å²	72	102.8 Å²	102.8	37%	0.369	56%	0.562	S	S	.	*	S	Bend	trans	-61.9	-43.1	173.6	-62.2	176.1	0	0	0	110.8	A101 V104 I105	A101-I138 HydrophobicContact CB-CG2 3.79Å; A101-I138 WeakPolarHBondContact CB-O 3.22Å; V104-I138 HydrophobicContact CG1-CD1 4.02Å; V104-I138 HydrophobicContact CG1-CG1 4.04Å; I105-I138 HydrophobicContact CD1-CG2 4.24Å; I105-I138 HydrophobicContact CG1-CG2 4.43Å
139	L	85	Confident	60.3	Low	67 Å²	67	99.7 Å²	99.7	35%	0.351	56%	0.562	S	S	.	*	S	Bend	trans	-118.9	137.7	176.3	-62.6	175.6	0	0	0	109.8	P91 T96 R137 Y141	P91-L139 HydrophobicContact CB-CB 4.39Å; P91-L139 HydrophobicContact CB-CD2 4.23Å; P91-L139 HydrophobicContact CG-CB 4.37Å; P91-L139 HydrophobicContact CG-CD1 4.01Å; P91-L139 HydrophobicContact CG-CD2 4.14Å; P91-L139 HydrophobicContact CG-CG 4.41Å; T96-L139 HydrophobicContact CG2-CD2 4.02Å; R137-L139 WeakPolarHBondContact CB-O 3.46Å; L139-Y141 HydrophobicContact CB-CE2 3.93Å
140	R	82.4	Confident	58.4	Low	110 Å²	110	102.8 Å²	102.8	42%	0.415	58%	0.579	S	S	.	*			trans	-116.9	127.6	173.6	-65.7	-165.1	-173.2	-176.3	-2.8	109.5	P91 N92 S95 T96	P91-R140 CarbonylContact C-O 3.58Å; N92-R140 PolarHBondContact N-O 3.48Å; S95-R140 WeakPolarHBondContact O-CD 3.27Å; S95-R140 WeakPolarHBondContact OG-CB 3.39Å; S95-R140 PolarHBondContact OG-O 2.87Å; T96-R140 PolarHBondContact OG1-N 3.09Å; T96-R140 PolarHBondContact OG1-O 3.05Å
141	Y	81.3	Confident	57	Low	77 Å²	77	103.1 Å²	103.1	30%	0.302	58%	0.58	S	S	.	*			trans	-99.6	-26.3	-177	-68.5	-89.8	0	0	0	112.2	G86 D87 R88 P91 N92 L139	G86-Y141 WeakPolarHBondContact CA-O 3.4Å; D87-Y141 WeakPolarHBondContact O-CD1 3.44Å; R88-Y141 VanDerWaalsContact O-CD1 3.23Å; R88-Y141 WeakPolarHBondContact O-CD1 3.24Å; R88-Y141 VanDerWaalsContact O-CE1 3.24Å; R88-Y141 WeakPolarHBondContact O-CE1 3.23Å; P91-Y141 HydrophobicContact CB-CD1 4.48Å; P91-Y141 HydrophobicContact CB-CE1 4.25Å; P91-Y141 HydrophobicContact CG-CD1 4.36Å; P91-Y141 HydrophobicContact CG-CE1 3.68Å; N92-Y141 WeakPolarHBondContact CB-O 3.38Å; L139-Y141 HydrophobicContact CB-CE2 3.93Å
142	N	72.9	Confident	55.8	Low	116 Å²	116	105.7 Å²	105.7	62%	0.62	59%	0.588	S	S	*	*	S	Bend	trans	-92.7	145.2	-179.8	-59.6	-0.5	0	0	0	110.4	S95 A144	S95-N142 WeakPolarHBondContact CB-O 3.34Å; S95-N142 PolarHBondContact OG-O 3.04Å; S95-N142 VanDerWaalsContact OG-O 3.09Å; N142-A144 PolarHBondContact O-N 3.3Å
143	A	60.2	Low	54.5	Low	54 Å²	54	108.6 Å²	108.6	45%	0.446	61%	0.61	S	S	.	*			trans	-59	135.3	169.1	0	0	0	0	0	109.7	N92 I145	N92-A143 WeakPolarHBondContact ND2-CA 3.4Å; N92-A143 PolarHBondContact ND2-N 3.47Å; A143-I145 PolarHBondContact O-N 3.04Å
144	A	56.5	Low	53.5	Low	59 Å²	59	110.9 Å²	110.9	49%	0.488	62%	0.623	S	S	.	*			trans	-64.6	111.6	-177.1	0	0	0	0	0	109.7	N142 R146	N142-A144 PolarHBondContact O-N 3.3Å; A144-R146 PolarHBondContact O-N 3.46Å; A144-R146 VanDerWaalsContact O-N 3.13Å
145	I	47.4	Very low	52.4	Low	144 Å²	144	111.9 Å²	111.9	74%	0.738	63%	0.628	S	S	*	*			trans	-60.6	117.4	163.8	-58.5	173.8	0	0	0	105.6	A143 D147	A143-I145 PolarHBondContact O-N 3.04Å; I145-D147 PolarHBondContact O-N 3.3Å
146	R	40.3	Very low	50.9	Low	228 Å²	228	115.6 Å²	115.6	86%	0.86	63%	0.629	S	S	*	*			trans	-69.4	82.3	171.8	-74	-178	175.6	179.7	-0.5	107.8	A144 S148	A144-R146 PolarHBondContact O-N 3.46Å; A144-R146 VanDerWaalsContact O-N 3.13Å; R146-S148 PolarHBondContact O-N 2.94Å; R146-S148 PolarHBondContact O-OG 3Å
147	D	35.4	Very low	49.3	Very low	148 Å²	148	119.2 Å²	119.2	79%	0.791	65%	0.654	S	S	*	*			trans	-69	93.6	169.1	-83.7	-17.5	0	0	0	108.6	I145 G149	I145-D147 PolarHBondContact O-N 3.3Å; D147-G149 PolarHBondContact O-N 3.22Å
148	S	32.9	Very low	47.4	Very low	107 Å²	107	115.7 Å²	115.7	75%	0.748	66%	0.659	S	S	*	*			trans	-78.4	111.6	171.6	-49.1	0	0	0	0	106.6	R146	R146-S148 PolarHBondContact O-N 2.94Å; R146-S148 PolarHBondContact O-OG 3Å
149	G	29.1	Very low	45.3	Very low	65 Å²	65	118.1 Å²	118.1	67%	0.67	68%	0.677	S	S	*	*	S	Bend	trans	17.6	109.5	162.7	0	0	0	0	0	119.3	D147	D147-G149 PolarHBondContact O-N 3.22Å
150	N	29.1	Very low	43.1	Very low	153 Å²	153	119.6 Å²	119.6	82%	0.818	69%	0.693	S	S	*	*				179.8	96.7	118.7	-97.6	-15.4	0	0	0	108.8	H152	N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 3.42Å
151	V	31.7	Very low	40.9	Very low	139 Å²	139	120.5 Å²	120.5	84%	0.842	71%	0.711	S	S	*	*			trans	-73.1	90	165.7	-179.4	0	0	0	0	106.9	C153	V151-C153 PolarHBondContact O-N 2.93Å
152	H	31.5	Very low	39	Very low	174 Å²	174	121.9 Å²	121.9	81%	0.806	73%	0.727	S	S	*	*			trans	-75.3	99	162.6	-113.9	28.3	0	0	0	107.5	N150 P154	N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 3.42Å; H152-P154 WeakPolarHBondContact O-CD 3.32Å
153	C	29	Very low	37.4	Very low	93 Å²	93	126 Å²	126	63%	0.628	74%	0.739	S	S	*	*			trans	-61.5	121.6	164.8	-72.2	0	0	0	0	108.5	V151 T155	V151-C153 PolarHBondContact O-N 2.93Å; C153-T155 PolarHBondContact O-N 2.85Å
154	P	33.8	Very low	36.2	Very low	128 Å²	128	125.3 Å²	125.3	83%	0.831	74%	0.738	S	S	*	*			trans	-72.5	102.2	165.5	28.9	-26.9	0	0	0	107.2	H152	H152-P154 WeakPolarHBondContact O-CD 3.32Å
155	T	31	Very low	35.8	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.693	76%	0.757	S	S	*	*			trans	-71.8	140.5	162.5	47	0	0	0	0	108.5	C153	C153-T155 PolarHBondContact O-N 2.85Å
156	N	30.7	Very low	36	Very low	157 Å²	157	134 Å²	134	84%	0.84	76%	0.762	S	S	*	*			trans	82.9	78.5	169.2	-52.4	-20.3	0	0	0	116.9
157	S	36	Very low	37.5	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	76%	0.762	S	S	*	*			trans	-92.7	113.3	139	54.5	0	0	0	0	108.5	V159	S157-V159 PolarHBondContact O-N 2.97Å
158	S	35.9	Very low	39.9	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	74%	0.737	S	S	*	*			trans	-63.8	100.6	170.8	50.2	0	0	0	0	109.2	S160	S158-S160 PolarHBondContact O-N 2.94Å; S158-S160 VanDerWaalsContact O-N 3.12Å
159	V	39.4	Very low	42.4	Very low	122 Å²	122	128.2 Å²	128.2	74%	0.739	74%	0.738	S	S	*	*			trans	-70.5	106.3	172.3	-176.4	0	0	0	0	107.8	S157 T161	S157-V159 PolarHBondContact O-N 2.97Å; V159-T161 PolarHBondContact O-N 3.3Å; V159-T161 VanDerWaalsContact O-N 3.11Å
160	S	38.2	Very low	45.4	Very low	98 Å²	98	126.3 Å²	126.3	69%	0.685	71%	0.713	S	S	*	*			trans	-57.1	112	168.5	51.7	0	0	0	0	109.2	S158 V162	S158-S160 PolarHBondContact O-N 2.94Å; S158-S160 VanDerWaalsContact O-N 3.12Å; S160-V162 VanDerWaalsContact C-N 3.28Å; S160-V162 PolarHBondContact O-N 3.06Å
161	T	37.4	Very low	48.5	Very low	130 Å²	130	121.9 Å²	121.9	80%	0.798	69%	0.692	S	S	*	*			trans	-71	83.2	176.3	-20	0	0	0	0	109.3	V159 K163	V159-T161 PolarHBondContact O-N 3.3Å; V159-T161 VanDerWaalsContact O-N 3.11Å; T161-K163 PolarHBondContact O-N 3.14Å; T161-K163 VanDerWaalsContact O-N 3.1Å
162	V	40.4	Very low	51.4	Low	106 Å²	106	120.3 Å²	120.3	64%	0.642	68%	0.675	S	S	*	*			trans	-69.3	106.2	163.4	-173.8	0	0	0	0	105.8	S160 G164	S160-V162 VanDerWaalsContact C-N 3.28Å; S160-V162 PolarHBondContact O-N 3.06Å; V162-G164 PolarHBondContact O-N 2.81Å
163	K	39.2	Very low	54.4	Low	202 Å²	202	119.2 Å²	119.2	88%	0.878	67%	0.673	S	S	*	*			trans	-69.2	62.7	169.2	-71.4	-175.7	178	179.4	0	109.6	T161	T161-K163 PolarHBondContact O-N 3.14Å; T161-K163 VanDerWaalsContact O-N 3.1Å
164	G	35.4	Very low	57.6	Low	40 Å²	40	116.3 Å²	116.3	41%	0.412	65%	0.653	S	S	.	*			trans	-74	129.6	160.9	0	0	0	0	0	107.7	V162 Y166	V162-G164 PolarHBondContact O-N 2.81Å; G164-Y166 VanDerWaalsContact C-N 3.28Å; G164-Y166 VanDerWaalsContact O-CD2 3.24Å; G164-Y166 WeakPolarHBondContact O-CD2 3.43Å; G164-Y166 PolarHBondContact O-N 3.45Å
165	L	47.4	Very low	60.5	Low	172 Å²	172	115.3 Å²	115.3	90%	0.901	64%	0.637	S	S	*	*			trans	-59.7	94.8	167.9	-81.8	134.6	0	0	0	108	K167	L165-K167 PolarHBondContact O-N 3.08Å
166	Y	52.3	Low	63.5	Low	213 Å²	213	114.1 Å²	114.1	84%	0.835	62%	0.622	S	S	*	*			trans	-63.7	99	172.6	-72.1	-85	0	0	0	108.1	G164	G164-Y166 VanDerWaalsContact C-N 3.28Å; G164-Y166 VanDerWaalsContact O-CD2 3.24Å; G164-Y166 WeakPolarHBondContact O-CD2 3.43Å; G164-Y166 PolarHBondContact O-N 3.45Å
167	K	71	Confident	66.7	Low	200 Å²	200	110.3 Å²	110.3	87%	0.87	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-70.8	130	164	-69.5	-175	178	-176.9	0	107.2	L165	L165-K167 PolarHBondContact O-N 3.08Å
168	R	85.6	Confident	69.6	Low	67 Å²	67	107 Å²	107	25%	0.253	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-64.3	144.9	176	76.1	-179.9	-167.1	-100.3	-4.3	110	I170 Y415 E417 C475	R168-I170 HydrophobicContact CG-CD1 4.41Å; R168-I170 HydrophobicContact CG-CG1 4Å; R168-Y415 VanDerWaalsContact CD-CE1 3.46Å; R168-Y415 WeakPolarHBondContact CD-OH 3.36Å; R168-E417 IonicContact CZ-OE1 2.64Å; R168-E417 IonicContact CZ-OE2 3.74Å; R168-E417 VanDerWaalsContact CZ-OE2 3.26Å; R168-E417 IonicContact NH1-OE1 2.96Å; R168-E417 PolarHBondContact NH1-OE1 3.42Å; R168-E417 IonicContact NH1-OE2 3.22Å; R168-E417 PolarHBondContact NH1-OE2 2.84Å; R168-E417 IonicContact NH2-OE1 3.74Å; R168-E417 IonicContact NH2-OE2 3.81Å; R168-E417 PolarHBondContact NH2-OE2 3.46Å; R168-C475 PolarHBondContact NH2-O 3.27Å
169	A	86.6	Confident	72.5	Confident	95 Å²	95	108 Å²	108	79%	0.785	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-79.2	126.7	172.4	0	0	0	0	0	108.7
170	I	92.2	Very high	75.3	Confident	25 Å²	25	102.1 Å²	102.1	13%	0.128	54%	0.539	C	S	.	.			trans	-113.3	118	177	-58.2	172.9	0	0	0	107.2	R168 Q172 I431 V440 T441 C475	R168-I170 HydrophobicContact CG-CD1 4.41Å; R168-I170 HydrophobicContact CG-CG1 4Å; I170-Q172 PolarHBondContact O-N 3.09Å; I170-Q172 PolarHBondContact O-NE2 3.4Å; I170-Q172 VanDerWaalsContact O-NE2 3.1Å; I170-I431 HydrophobicContact CD1-CD1 4.37Å; I170-I431 HydrophobicContact CG2-CD1 4.49Å; I170-V440 HydrophobicContact CD1-CG1 3.89Å; I170-T441 HydrophobicContact CB-CG2 4.38Å; I170-T441 HydrophobicContact CD1-CG2 3.76Å; I170-T441 HydrophobicContact CG2-CG2 4Å; I170-C475 HydrophobicContact CG2-CB 3.85Å
171	P	92.8	Very high	78.1	Confident	60 Å²	60	100.5 Å²	100.5	39%	0.39	53%	0.526	S	S	.	.			trans	-55.3	131.9	176.2	-24.4	34	0	0	0	111.1	L443 H474	P171-L443 VanDerWaalsContact O-CD2 3.27Å; P171-L443 WeakPolarHBondContact O-CD2 3.41Å; P171-H474 WeakPolarHBondContact CD-O 3.43Å
172	Q	93.4	Very high	80.8	Confident	105 Å²	105	99.6 Å²	99.6	49%	0.491	52%	0.516	S	S	.	.	S	Bend	trans	-89.6	-11.2	177	-60.1	-60.6	-63	0	0	112.5	I170 T441 H442	I170-Q172 PolarHBondContact O-N 3.09Å; I170-Q172 PolarHBondContact O-NE2 3.4Å; I170-Q172 VanDerWaalsContact O-NE2 3.1Å; Q172-T441 PolarHBondContact NE2-OG1 3.03Å; Q172-H442 PolarHBondContact OE1-O 3.05Å; Q172-H442 VanDerWaalsContact OE1-O 3.05Å
173	M	94.5	Very high	83.5	Confident	151 Å²	151	95.2 Å²	95.2	74%	0.744	49%	0.489	S	S	*	.	S	Bend	trans	-106.4	147.6	174.2	-65.4	-173.8	72	0	0	109.2
174	P	95.8	Very high	86.2	Confident	33 Å²	33	87.5 Å²	87.5	21%	0.214	46%	0.457	C	S	.	.			trans	-66.3	147.6	172.9	30.7	-35.6	0	0	0	110	V177 R471 I472 W473	P174-V177 HydrophobicContact CB-CG2 4.21Å; P174-V177 HydrophobicContact CG-CG2 3.53Å; P174-R471 HydrophobicContact CB-CB 3.96Å; P174-R471 HydrophobicContact CB-CG 4.44Å; P174-R471 HydrophobicContact CG-CB 4.45Å; P174-R471 HydrophobicContact CG-CG 4.4Å; P174-I472 CarbonylContact C-O 3.4Å; P174-I472 WeakPolarHBondContact CA-O 3.43Å; P174-I472 WeakPolarHBondContact CB-O 3.47Å; P174-W473 HydrophobicContact CB-CD2 4.15Å; P174-W473 HydrophobicContact CB-CE3 4.02Å; P174-W473 HydrophobicContact CB-CH2 4.3Å; P174-W473 HydrophobicContact CB-CZ2 4.41Å; P174-W473 HydrophobicContact CB-CZ3 4.09Å; P174-W473 HydrophobicContact CG-CH2 4.39Å; P174-W473 HydrophobicContact CG-CZ3 4.39Å
175	E	94.3	Very high	89.1	Confident	107 Å²	107	89.5 Å²	89.5	50%	0.5	46%	0.458	S	S	.	.	S	Bend	trans	-69.9	-39	174.4	-171.9	176.4	132	0	0	110.9	M460 I472 H474	E175-M460 HydrophobicContact CB-CE 4.03Å; E175-M460 VanDerWaalsContact CD-CE 3.42Å; E175-M460 HydrophobicContact CG-CE 4.29Å; E175-M460 WeakPolarHBondContact OE2-CE 3.38Å; E175-I472 PolarHBondContact N-O 3.34Å; E175-H474 WeakPolarHBondContact OE2-CB 3.44Å; E175-H474 IonicContact OE2-CG 2.99Å; E175-H474 IonicContact OE2-ND1 2.73Å; E175-H474 PolarHBondContact OE2-ND1 2.86Å
176	K	95.7	Very high	91.5	Very high	87 Å²	87	82.9 Å²	82.9	38%	0.378	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.2	176	-63.1	-178	-176.8	177.6	0	110.2	W211 I472	K176-W211 HydrophobicContact CD-CH2 4.11Å; K176-W211 HydrophobicContact CD-CZ2 4.19Å; K176-I472 HydrophobicContact CB-CB 4.32Å; K176-I472 HydrophobicContact CB-CD1 4.15Å; K176-I472 HydrophobicContact CB-CG1 4.37Å; K176-I472 PolarHBondContact O-N 3.31Å
177	V	96.7	Very high	93.6	Very high	77 Å²	77	73.3 Å²	73.3	47%	0.467	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.7	169.6	-174.4	0	0	0	0	106.8	P174 T469 L470 R471	P174-V177 HydrophobicContact CB-CG2 4.21Å; P174-V177 HydrophobicContact CG-CG2 3.53Å; V177-T469 HydrophobicContact CG1-CG2 4.22Å; V177-L470 CarbonylContact C-O 3.59Å; V177-L470 WeakPolarHBondContact CA-O 3.42Å; V177-R471 HydrophobicContact CG1-CG 4.36Å; V177-R471 HydrophobicContact CG2-CG 4.29Å
178	L	97.2	Very high	94.9	Very high	38 Å²	38	66.7 Å²	66.7	20%	0.199	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.8	175.9	-46.1	174.4	0	0	0	108.7	L200 W211 T469 L470 I472	L178-L200 HydrophobicContact CD1-CD2 4.45Å; L178-W211 HydrophobicContact CD1-CD2 3.71Å; L178-W211 HydrophobicContact CD1-CE3 3.87Å; L178-W211 HydrophobicContact CD1-CG 4.13Å; L178-W211 HydrophobicContact CD1-CH2 4.41Å; L178-W211 HydrophobicContact CD1-CZ2 4.3Å; L178-W211 HydrophobicContact CD1-CZ3 4.21Å; L178-W211 HydrophobicContact CD2-CZ2 4.27Å; L178-T469 WeakPolarHBondContact O-CA 3.24Å; L178-L470 HydrophobicContact CB-CB 4.17Å; L178-L470 PolarHBondContact N-O 2.74Å; L178-L470 PolarHBondContact O-N 2.82Å; L178-I472 HydrophobicContact CD1-CD1 4.22Å
179	D	97.4	Very high	95.5	Very high	139 Å²	139	63.6 Å²	63.6	74%	0.743	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	137.8	174.7	-58.6	-34	0	0	0	110	P181	D179-P181 VanDerWaalsContact C-CD 3.49Å
180	A	96.9	Very high	96	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.			trans	-129.5	67.2	175.5	0	0	0	0	0	109.7	L204 E468 L470	A180-L204 HydrophobicContact CB-CD2 3.74Å; A180-E468 CarbonylContact C-O 3.53Å; A180-E468 WeakPolarHBondContact CA-O 3.47Å; A180-E468 PolarHBondContact N-O 2.81Å; A180-E468 WeakPolarHBondContact O-CA 3.42Å; A180-E468 WeakPolarHBondContact O-CB 3.35Å; A180-L470 HydrophobicContact CB-CD1 4.46Å; A180-L470 HydrophobicContact CB-CD2 4.49Å; A180-L470 HydrophobicContact CB-CG 3.97Å
181	P	96.8	Very high	96.3	Very high	63 Å²	63	60 Å²	60	41%	0.409	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	150.5	178.6	28.4	-36.1	0	0	0	110.9	D179 I183 L204	D179-P181 VanDerWaalsContact C-CD 3.49Å; P181-I183 PolarHBondContact O-N 2.74Å; P181-I183 VanDerWaalsContact O-N 3.13Å; P181-L204 HydrophobicContact CG-CD1 4.29Å; P181-L204 WeakPolarHBondContact O-CB 3.46Å
182	D	94.9	Very high	96.5	Very high	111 Å²	111	57.8 Å²	57.8	59%	0.594	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.1	178.5	-58.8	-43.1	0	0	0	114.4	I184 N205	D182-I184 PolarHBondContact O-N 2.77Å; D182-N205 HydrophobicContact CB-CB 4.12Å; D182-N205 WeakPolarHBondContact O-CB 3.35Å; D182-N205 PolarHBondContact O-N 2.74Å
183	I	96.6	Very high	96.8	Very high	15 Å²	15	54.7 Å²	54.7	8%	0.077	28%	0.284	C	S	.	.			trans	-61.6	130.6	170.7	-167.8	176	0	0	0	110.3	P181 D185 I191 L204 L450 C464 E468	P181-I183 PolarHBondContact O-N 2.74Å; P181-I183 VanDerWaalsContact O-N 3.13Å; I183-D185 PolarHBondContact O-N 3.39Å; I183-I191 HydrophobicContact CD1-CD1 3.78Å; I183-I191 HydrophobicContact CG1-CD1 3.54Å; I183-L204 HydrophobicContact CB-CD2 4.41Å; I183-L450 HydrophobicContact CD1-CD1 3.97Å; I183-L450 HydrophobicContact CG1-CD1 4.35Å; I183-C464 WeakPolarHBondContact CD1-SG 3.26Å; I183-E468 HydrophobicContact CG2-CG 4.03Å
184	I	97	Very high	96.9	Very high	40 Å²	40	48.2 Å²	48.2	21%	0.205	25%	0.251	C	S	.	.			trans	-76	114.9	177.7	-60.1	179.4	0	0	0	108.8	D182 D186 L189 N205 Y230	D182-I184 PolarHBondContact O-N 2.77Å; I184-D186 HydrophobicContact CG2-CB 3.78Å; I184-D186 PolarHBondContact O-N 2.78Å; I184-L189 HydrophobicContact CB-CD1 4.13Å; I184-L189 HydrophobicContact CD1-CD1 4.47Å; I184-L189 HydrophobicContact CG2-CD1 3.84Å; I184-N205 HydrophobicContact CG1-CB 4.42Å; I184-Y230 HydrophobicContact CD1-CD1 4.35Å; I184-Y230 HydrophobicContact CD1-CD2 3.47Å; I184-Y230 VanDerWaalsContact CD1-CD2 3.47Å; I184-Y230 HydrophobicContact CD1-CE2 4.2Å; I184-Y230 HydrophobicContact CD1-CG 3.56Å
185	D	96.5	Very high	97	Very high	81 Å²	81	46.7 Å²	46.7	43%	0.433	24%	0.242	S	C	.	.			trans	-74.8	65.3	175.1	-170.6	24	0	0	0	112.2	I183 R448 S466	I183-D185 PolarHBondContact O-N 3.39Å; D185-R448 PolarHBondContact O-NH2 2.77Å; D185-R448 IonicContact OD1-CZ 3.56Å; D185-R448 IonicContact OD1-NE 3.48Å; D185-R448 PolarHBondContact OD1-NE 3.1Å; D185-R448 IonicContact OD1-NH2 3.2Å; D185-R448 PolarHBondContact OD1-NH2 3.3Å; D185-R448 IonicContact OD2-CZ 2.74Å; D185-R448 IonicContact OD2-NE 3.11Å; D185-R448 PolarHBondContact OD2-NE 3.44Å; D185-R448 IonicContact OD2-NH2 2.69Å; D185-R448 PolarHBondContact OD2-NH2 2.71Å; D185-S466 VanDerWaalsContact OD1-CB 3.25Å; D185-S466 WeakPolarHBondContact OD1-CB 3.44Å
186	D	96.9	Very high	97	Very high	33 Å²	33	45.6 Å²	45.6	18%	0.176	24%	0.242	C	C	.	.			trans	-126	118.6	178.4	-174	-22.9	0	0	0	110.8	I184 Y188 L189 R277	I184-D186 HydrophobicContact CG2-CB 3.78Å; I184-D186 PolarHBondContact O-N 2.78Å; D186-Y188 PolarHBondContact O-N 3.3Å; D186-Y188 VanDerWaalsContact OD1-CD2 3.22Å; D186-Y188 WeakPolarHBondContact OD1-CD2 3.5Å; D186-Y188 PolarHBondContact OD1-N 3.3Å; D186-L189 HydrophobicContact CB-CD1 3.84Å; D186-L189 HydrophobicContact CB-CG 3.85Å; D186-L189 PolarHBondContact O-N 3.43Å; D186-R277 IonicContact OD1-NH2 2.78Å; D186-R277 IonicContact OD2-CZ 3.53Å; D186-R277 IonicContact OD2-NH1 3.46Å; D186-R277 PolarHBondContact OD2-NH1 3.17Å; D186-R277 IonicContact OD2-NH2 2.86Å; D186-R277 PolarHBondContact OD2-NH2 3.11Å
187	F	96.6	Very high	96.9	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.053	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-34.6	179.7	173.3	-101.5	0	0	0	112.8	L189 A361 K363 Q405	F187-L189 VanDerWaalsContact C-N 3.31Å; F187-L189 PolarHBondContact O-N 2.93Å; F187-A361 HydrophobicContact CE1-CB 4.07Å; F187-K363 HydrophobicContact CE1-CB 3.72Å; F187-K363 HydrophobicContact CE1-CD 4.45Å; F187-K363 HydrophobicContact CE2-CB 4.35Å; F187-K363 HydrophobicContact CE2-CD 4.36Å; F187-K363 HydrophobicContact CZ-CB 3.61Å; F187-K363 HydrophobicContact CZ-CD 4.34Å; F187-K363 WeakPolarHBondContact O-CD 3.29Å; F187-K363 VanDerWaalsContact O-CE 3.24Å; F187-K363 WeakPolarHBondContact O-CE 3.44Å; F187-Q405 VanDerWaalsContact CD2-CD 3.42Å; F187-Q405 HydrophobicContact CD2-CG 4.09Å; F187-Q405 HydrophobicContact CE2-CG 3.57Å; F187-Q405 HydrophobicContact CZ-CG 4.22Å
188	Y	97.9	Very high	96.9	Very high	62 Å²	62	43.4 Å²	43.4	24%	0.243	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.1	-168.3	-59.8	-77.2	0	0	0	114.2	D186 P279 C320 N336 A361	D186-Y188 PolarHBondContact O-N 3.3Å; D186-Y188 VanDerWaalsContact OD1-CD2 3.22Å; D186-Y188 WeakPolarHBondContact OD1-CD2 3.5Å; D186-Y188 PolarHBondContact OD1-N 3.3Å; Y188-P279 WeakPolarHBondContact O-CB 3.19Å; Y188-C320 HydrophobicContact CD1-CB 3.91Å; Y188-C320 WeakPolarHBondContact O-CB 3.47Å; Y188-N336 HydrophobicContact CE1-CB 3.82Å; Y188-N336 WeakPolarHBondContact CE1-OD1 3.47Å; Y188-N336 VanDerWaalsContact CZ-OD1 3.31Å; Y188-N336 PolarHBondContact OH-OD1 2.93Å; Y188-A361 HydrophobicContact CE1-CB 3.87Å
189	L	98	Very high	96.9	Very high	1 Å²	1	43 Å²	43	1%	0.005	23%	0.229	C	C	.	.			trans	-87.6	153.1	-173.3	-52.3	-175.5	0	0	0	112.5	I184 D186 F187 I191 Y230 S232 K363 C451	I184-L189 HydrophobicContact CB-CD1 4.13Å; I184-L189 HydrophobicContact CD1-CD1 4.47Å; I184-L189 HydrophobicContact CG2-CD1 3.84Å; D186-L189 HydrophobicContact CB-CD1 3.84Å; D186-L189 HydrophobicContact CB-CG 3.85Å; D186-L189 PolarHBondContact O-N 3.43Å; F187-L189 VanDerWaalsContact C-N 3.31Å; F187-L189 PolarHBondContact O-N 2.93Å; L189-I191 HydrophobicContact CB-CG2 3.83Å; L189-I191 HydrophobicContact CD1-CG2 4.41Å; L189-Y230 HydrophobicContact CD1-CD2 4.43Å; L189-Y230 HydrophobicContact CD1-CE2 4.04Å; L189-Y230 HydrophobicContact CD2-CE2 4.35Å; L189-S232 WeakPolarHBondContact CB-O 3.43Å; L189-K363 WeakPolarHBondContact O-CE 3.26Å; L189-K363 PolarHBondContact O-NZ 3.28Å; L189-C451 PolarHBondContact O-SG 3.06Å
190	N	98.3	Very high	96.9	Very high	42 Å²	42	36.4 Å²	36.4	23%	0.225	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-118.6	75.8	176.5	-69.8	-78.7	0	0	0	110.5	S232 S233 L234 P279 C320 K363	N190-S232 PolarHBondContact N-O 2.96Å; N190-S232 VanDerWaalsContact N-O 3.15Å; N190-S233 CarbonylContact O-C 3.57Å; N190-S233 WeakPolarHBondContact O-CA 3.48Å; N190-L234 PolarHBondContact O-N 2.86Å; N190-P279 PolarHBondContact N-O 2.85Å; N190-P279 PolarHBondContact ND2-O 2.89Å; N190-C320 PolarHBondContact ND2-O 2.69Å; N190-K363 VanDerWaalsContact CG-NZ 3.35Å; N190-K363 PolarHBondContact OD1-NZ 3.22Å
191	I	97.9	Very high	97	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	19%	0.194	C	C	.	.			trans	-98.7	14.9	-163.9	54.1	167.4	0	0	0	114.9	I183 L189 V202 A203	I183-I191 HydrophobicContact CD1-CD1 3.78Å; I183-I191 HydrophobicContact CG1-CD1 3.54Å; L189-I191 HydrophobicContact CB-CG2 3.83Å; L189-I191 HydrophobicContact CD1-CG2 4.41Å; I191-V202 WeakPolarHBondContact O-CA 3.45Å; I191-A203 HydrophobicContact CB-CB 3.81Å; I191-A203 HydrophobicContact CG2-CB 3.89Å; I191-A203 PolarHBondContact O-N 3.27Å
192	L	98.3	Very high	97.1	Very high	13 Å²	13	33.9 Å²	33.9	7%	0.068	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	130.8	-174	-172.8	78.5	0	0	0	110.6	L200 A201 V202 L234 C451 A453 V462 C464 L470	L192-L200 HydrophobicContact CD1-CD1 3.84Å; L192-L200 HydrophobicContact CD1-CD2 4.31Å; L192-L200 HydrophobicContact CD1-CG 4.19Å; L192-L200 HydrophobicContact CG-CD1 4.3Å; L192-A201 WeakPolarHBondContact CA-O 3.28Å; L192-V202 HydrophobicContact CD1-CB 4.06Å; L192-V202 HydrophobicContact CD1-CG2 4.14Å; L192-L234 VanDerWaalsContact C-CD1 3.45Å; L192-C451 HydrophobicContact CB-CB 3.8Å; L192-C451 HydrophobicContact CD2-CB 4.29Å; L192-A453 HydrophobicContact CD2-CB 4.32Å; L192-A453 HydrophobicContact CG-CB 4.43Å; L192-V462 HydrophobicContact CD2-CG1 3.76Å; L192-V462 HydrophobicContact CD2-CG2 4.3Å; L192-V462 HydrophobicContact CG-CG1 4.34Å; L192-C464 HydrophobicContact CB-CB 4.47Å; L192-C464 HydrophobicContact CD1-CB 4.41Å; L192-C464 HydrophobicContact CD2-CB 3.64Å; L192-C464 HydrophobicContact CG-CB 4.41Å; L192-L470 HydrophobicContact CD1-CD1 4.49Å; L192-L470 HydrophobicContact CD1-CD2 3.85Å
193	D	98.2	Very high	97.2	Very high	39 Å²	39	28.7 Å²	28.7	21%	0.209	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	153.5	173	-167.1	20.8	0	0	0	111.1	A201 L234 E235 W236	D193-A201 PolarHBondContact N-O 2.76Å; D193-A201 VanDerWaalsContact N-O 3.16Å; D193-A201 PolarHBondContact O-N 3.2Å; D193-L234 HydrophobicContact CB-CD1 3.44Å; D193-L234 VanDerWaalsContact CB-CD1 3.44Å; D193-E235 WeakPolarHBondContact OD2-CA 3.15Å; D193-W236 PolarHBondContact O-NE1 2.74Å; D193-W236 VanDerWaalsContact OD2-CD1 3.31Å; D193-W236 PolarHBondContact OD2-N 3.03Å
194	W	97.7	Very high	97.3	Very high	15 Å²	15	28.7 Å²	28.7	6%	0.057	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.6	-173.3	-157	-24	0	0	0	110.5	N198 L200 A453 S454 M460 V462 I472	W194-N198 WeakPolarHBondContact CZ2-OD1 3.21Å; W194-N198 PolarHBondContact NE1-OD1 2.83Å; W194-L200 HydrophobicContact CB-CD1 4.11Å; W194-L200 HydrophobicContact CD2-CD1 4.21Å; W194-L200 HydrophobicContact CE3-CD1 4.43Å; W194-L200 HydrophobicContact CG-CD1 4.12Å; W194-A453 HydrophobicContact CB-CB 4.1Å; W194-S454 WeakPolarHBondContact CB-O 3.44Å; W194-M460 HydrophobicContact CH2-CB 4.02Å; W194-M460 HydrophobicContact CZ3-CB 4.21Å; W194-V462 HydrophobicContact CE3-CB 3.98Å; W194-V462 HydrophobicContact CE3-CG1 3.57Å; W194-V462 HydrophobicContact CZ3-CB 3.79Å; W194-V462 HydrophobicContact CZ3-CG1 3.93Å; W194-I472 HydrophobicContact CH2-CG2 3.98Å; W194-I472 HydrophobicContact CZ3-CG2 4.37Å
195	S	96.9	Very high	97.2	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.014	16%	0.155	C	C	.	.			trans	-72.5	160.8	-175.5	86.1	0	0	0	0	113.4	D197 N198 I199 W236	S195-D197 PolarHBondContact O-N 2.69Å; S195-D197 PolarHBondContact OG-N 2.63Å; S195-N198 PolarHBondContact O-N 3.28Å; S195-N198 PolarHBondContact OG-N 3.5Å; S195-I199 WeakPolarHBondContact CB-O 3.44Å; S195-I199 PolarHBondContact N-O 2.73Å; S195-I199 WeakPolarHBondContact OG-CB 3.37Å; S195-I199 PolarHBondContact OG-N 3.48Å; S195-I199 PolarHBondContact OG-O 2.94Å; S195-W236 VanDerWaalsContact CB-CD2 3.47Å
196	V	94.9	Very high	97.2	Very high	84 Å²	84	27.8 Å²	27.8	51%	0.509	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.8	171.2	-64.8	0	0	0	0	113.4	N198 P241	V196-N198 PolarHBondContact O-N 3.16Å; V196-P241 HydrophobicContact CG2-CB 3.51Å
197	D	94.2	Very high	97.2	Very high	80 Å²	80	29.2 Å²	29.2	43%	0.428	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	14.8	176.1	-72.2	-17.8	0	0	0	112.7	S195 I199 P241	S195-D197 PolarHBondContact O-N 2.69Å; S195-D197 PolarHBondContact OG-N 2.63Å; D197-I199 VanDerWaalsContact C-N 3.3Å; D197-I199 HydrophobicContact CB-CD1 4.46Å; D197-I199 PolarHBondContact O-N 3.2Å; D197-P241 WeakPolarHBondContact OD2-CB 3.36Å
198	N	95.5	Very high	97.3	Very high	37 Å²	37	28.6 Å²	28.6	20%	0.198	15%	0.147	C	C	.	.	S	Bend	trans	64	31.8	177.9	-157.9	28.9	0	0	0	113.9	W194 S195 V196 S213 S214 P456	W194-N198 WeakPolarHBondContact CZ2-OD1 3.21Å; W194-N198 PolarHBondContact NE1-OD1 2.83Å; S195-N198 PolarHBondContact O-N 3.28Å; S195-N198 PolarHBondContact OG-N 3.5Å; V196-N198 PolarHBondContact O-N 3.16Å; N198-S213 WeakPolarHBondContact ND2-CB 3.3Å; N198-S213 WeakPolarHBondContact O-CB 3.38Å; N198-S213 PolarHBondContact O-N 3.13Å; N198-S214 PolarHBondContact ND2-OG 3.25Å; N198-P456 HydrophobicContact CB-CG 4.3Å
199	I	97.3	Very high	97.3	Very high	29 Å²	29	29 Å²	29	15%	0.149	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.1	175.4	-55.8	173.3	0	0	0	108.7	S195 D197 L210 W211 W236	S195-I199 WeakPolarHBondContact CB-O 3.44Å; S195-I199 PolarHBondContact N-O 2.73Å; S195-I199 WeakPolarHBondContact OG-CB 3.37Å; S195-I199 PolarHBondContact OG-N 3.48Å; S195-I199 PolarHBondContact OG-O 2.94Å; D197-I199 VanDerWaalsContact C-N 3.3Å; D197-I199 HydrophobicContact CB-CD1 4.46Å; D197-I199 PolarHBondContact O-N 3.2Å; I199-L210 HydrophobicContact CG2-CB 3.87Å; I199-L210 HydrophobicContact CG2-CD2 4.45Å; I199-W211 WeakPolarHBondContact CA-O 3.4Å; I199-W236 HydrophobicContact CB-CH2 4.4Å; I199-W236 HydrophobicContact CB-CZ2 4.21Å; I199-W236 HydrophobicContact CG2-CH2 4.2Å; I199-W236 HydrophobicContact CG2-CZ2 3.97Å
200	L	97.8	Very high	97.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.3	173.3	-174.4	67.9	0	0	0	109.7	L178 L192 W194 L210 W211 V462 L470	L178-L200 HydrophobicContact CD1-CD2 4.45Å; L192-L200 HydrophobicContact CD1-CD1 3.84Å; L192-L200 HydrophobicContact CD1-CD2 4.31Å; L192-L200 HydrophobicContact CD1-CG 4.19Å; L192-L200 HydrophobicContact CG-CD1 4.3Å; W194-L200 HydrophobicContact CB-CD1 4.11Å; W194-L200 HydrophobicContact CD2-CD1 4.21Å; W194-L200 HydrophobicContact CE3-CD1 4.43Å; W194-L200 HydrophobicContact CG-CD1 4.12Å; L200-L210 CarbonylContact O-C 3.59Å; L200-L210 VanDerWaalsContact O-CA 3.26Å; L200-L210 WeakPolarHBondContact O-CA 3.27Å; L200-W211 HydrophobicContact CB-CB 4.42Å; L200-W211 HydrophobicContact CB-CE3 3.99Å; L200-W211 HydrophobicContact CD2-CE3 4.26Å; L200-W211 PolarHBondContact N-O 2.88Å; L200-W211 PolarHBondContact O-N 3Å; L200-V462 HydrophobicContact CD1-CB 4.42Å; L200-V462 HydrophobicContact CD1-CG1 3.69Å; L200-V462 HydrophobicContact CD1-CG2 4.37Å; L200-V462 HydrophobicContact CD2-CG2 3.98Å; L200-L470 HydrophobicContact CD2-CD1 3.97Å
201	A	98.4	Very high	97.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.7	169.1	0	0	0	0	0	109.7	L192 D193 V208 Y209 L210 L234 W236 I244	L192-A201 WeakPolarHBondContact CA-O 3.28Å; D193-A201 PolarHBondContact N-O 2.76Å; D193-A201 VanDerWaalsContact N-O 3.16Å; D193-A201 PolarHBondContact O-N 3.2Å; A201-V208 HydrophobicContact CB-CG1 4.44Å; A201-Y209 WeakPolarHBondContact CA-O 3.48Å; A201-L210 HydrophobicContact CB-CD2 3.66Å; A201-L234 HydrophobicContact CB-CD1 4.07Å; A201-L234 HydrophobicContact CB-CD2 4.28Å; A201-W236 HydrophobicContact CB-CZ2 3.84Å; A201-I244 HydrophobicContact CB-CD1 3.52Å
202	V	98.4	Very high	97.2	Very high	11 Å²	11	30.3 Å²	30.3	7%	0.067	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.5	176	63.1	0	0	0	0	110.1	I191 L192 L204 V208 Y209 L470	I191-V202 WeakPolarHBondContact O-CA 3.45Å; L192-V202 HydrophobicContact CD1-CB 4.06Å; L192-V202 HydrophobicContact CD1-CG2 4.14Å; V202-L204 HydrophobicContact CG1-CD2 4.43Å; V202-L204 HydrophobicContact CG1-CG 4.3Å; V202-L204 HydrophobicContact CG2-CD2 3.8Å; V202-L204 HydrophobicContact CG2-CG 4.41Å; V202-V208 WeakPolarHBondContact O-CA 3.25Å; V202-Y209 PolarHBondContact N-O 2.77Å; V202-Y209 PolarHBondContact O-N 3.3Å; V202-L470 HydrophobicContact CB-CD1 4.2Å; V202-L470 HydrophobicContact CG1-CD1 4.2Å; V202-L470 HydrophobicContact CG2-CD1 4.16Å; V202-L470 HydrophobicContact CG2-CD2 4.36Å
203	A	98.3	Very high	97	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	118.4	172.3	0	0	0	0	0	110.5	I191 E207 V208 V231 L234	I191-A203 HydrophobicContact CB-CB 3.81Å; I191-A203 HydrophobicContact CG2-CB 3.89Å; I191-A203 PolarHBondContact O-N 3.27Å; A203-E207 WeakPolarHBondContact CA-O 3.15Å; A203-V208 HydrophobicContact CB-CG2 4.42Å; A203-V231 HydrophobicContact CB-CB 3.64Å; A203-V231 HydrophobicContact CB-CG1 3.49Å; A203-V231 VanDerWaalsContact CB-CG1 3.49Å; A203-L234 HydrophobicContact CB-CD2 3.88Å
204	L	97.4	Very high	96.8	Very high	16 Å²	16	33.6 Å²	33.6	8%	0.084	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	94.3	176.6	-57.7	-175.2	0	0	0	107.4	A180 P181 I183 V202 Q206 E207 Y209	A180-L204 HydrophobicContact CB-CD2 3.74Å; P181-L204 HydrophobicContact CG-CD1 4.29Å; P181-L204 WeakPolarHBondContact O-CB 3.46Å; I183-L204 HydrophobicContact CB-CD2 4.41Å; V202-L204 HydrophobicContact CG1-CD2 4.43Å; V202-L204 HydrophobicContact CG1-CG 4.3Å; V202-L204 HydrophobicContact CG2-CD2 3.8Å; V202-L204 HydrophobicContact CG2-CG 4.41Å; L204-Q206 PolarHBondContact O-N 2.9Å; L204-E207 PolarHBondContact N-O 3.5Å; L204-E207 PolarHBondContact O-N 2.86Å; L204-Y209 HydrophobicContact CB-CD2 4.26Å; L204-Y209 HydrophobicContact CB-CE2 4.45Å; L204-Y209 HydrophobicContact CD1-CD2 3.71Å; L204-Y209 HydrophobicContact CD1-CE2 4.11Å; L204-Y209 HydrophobicContact CD1-CG 4.42Å; L204-Y209 HydrophobicContact CG-CD2 4.1Å
205	N	96.2	Very high	96.6	Very high	57 Å²	57	36 Å²	36	31%	0.305	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	-101.1	-173.9	-170	10.9	0	0	0	113.7	D182 I184 Y230 V231	D182-N205 HydrophobicContact CB-CB 4.12Å; D182-N205 WeakPolarHBondContact O-CB 3.35Å; D182-N205 PolarHBondContact O-N 2.74Å; I184-N205 HydrophobicContact CG1-CB 4.42Å; N205-Y230 WeakPolarHBondContact O-CA 3.13Å; N205-Y230 WeakPolarHBondContact O-CB 3.45Å; N205-V231 PolarHBondContact O-N 3.42Å
206	Q	96	Very high	96.5	Very high	45 Å²	45	37.7 Å²	37.7	21%	0.21	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.8	-177.3	-81.5	177.4	44.8	0	0	114	L204 S223 C224 D227 E229	L204-Q206 PolarHBondContact O-N 2.9Å; Q206-S223 WeakPolarHBondContact O-CA 3.5Å; Q206-C224 HydrophobicContact CB-CB 4.43Å; Q206-C224 HydrophobicContact CG-CB 4.42Å; Q206-C224 PolarHBondContact O-N 3.43Å; Q206-C224 PolarHBondContact O-SG 3.22Å; Q206-D227 PolarHBondContact NE2-O 2.9Å; Q206-E229 WeakPolarHBondContact CG-O 3.43Å
207	E	97.4	Very high	96.5	Very high	62 Å²	62	38.7 Å²	38.7	29%	0.29	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.1	-167.6	-54.6	-169.3	138.3	0	0	111.7	A203 L204 Y209 M222	A203-E207 WeakPolarHBondContact CA-O 3.15Å; L204-E207 PolarHBondContact N-O 3.5Å; L204-E207 PolarHBondContact O-N 2.86Å; E207-Y209 HydrophobicContact CB-CD2 4.23Å; E207-Y209 HydrophobicContact CB-CE2 3.69Å; E207-Y209 VanDerWaalsContact OE2-CE2 3.27Å; E207-Y209 WeakPolarHBondContact OE2-CE2 3.34Å; E207-Y209 VanDerWaalsContact OE2-CZ 3.28Å; E207-Y209 PolarHBondContact OE2-OH 2.91Å; E207-M222 VanDerWaalsContact CA-O 3.29Å; E207-M222 WeakPolarHBondContact CA-O 3.41Å
208	V	98.2	Very high	96.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.8	168.5	-179.3	0	0	0	0	109.1	A201 V202 A203 L210 L221 M222 V231 L234 I246	A201-V208 HydrophobicContact CB-CG1 4.44Å; V202-V208 WeakPolarHBondContact O-CA 3.25Å; A203-V208 HydrophobicContact CB-CG2 4.42Å; V208-L210 HydrophobicContact CG1-CD2 4.38Å; V208-L221 PolarHBondContact O-N 3.37Å; V208-M222 HydrophobicContact CB-CG 4.1Å; V208-M222 HydrophobicContact CG2-CG 4.09Å; V208-M222 HydrophobicContact CG2-SD 4.01Å; V208-M222 PolarHBondContact N-O 2.86Å; V208-V231 HydrophobicContact CG2-CB 4.35Å; V208-V231 HydrophobicContact CG2-CG1 4Å; V208-V231 HydrophobicContact CG2-CG2 3.76Å; V208-L234 HydrophobicContact CG1-CD2 4.23Å; V208-I246 HydrophobicContact CB-CD1 4.41Å; V208-I246 HydrophobicContact CG2-CD1 3.93Å; V208-I246 HydrophobicContact CG2-CG2 4.37Å
209	Y	98.3	Very high	96.7	Very high	70 Å²	70	41.2 Å²	41.2	28%	0.275	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	142.7	173.7	-73.9	-93.1	0	0	0	110.5	A201 V202 L204 E207 I218 T219 C220	A201-Y209 WeakPolarHBondContact CA-O 3.48Å; V202-Y209 PolarHBondContact N-O 2.77Å; V202-Y209 PolarHBondContact O-N 3.3Å; L204-Y209 HydrophobicContact CB-CD2 4.26Å; L204-Y209 HydrophobicContact CB-CE2 4.45Å; L204-Y209 HydrophobicContact CD1-CD2 3.71Å; L204-Y209 HydrophobicContact CD1-CE2 4.11Å; L204-Y209 HydrophobicContact CD1-CG 4.42Å; L204-Y209 HydrophobicContact CG-CD2 4.1Å; E207-Y209 HydrophobicContact CB-CD2 4.23Å; E207-Y209 HydrophobicContact CB-CE2 3.69Å; E207-Y209 VanDerWaalsContact OE2-CE2 3.27Å; E207-Y209 WeakPolarHBondContact OE2-CE2 3.34Å; E207-Y209 VanDerWaalsContact OE2-CZ 3.28Å; E207-Y209 PolarHBondContact OE2-OH 2.91Å; Y209-I218 HydrophobicContact CD1-CG2 3.99Å; Y209-T219 CarbonylContact C-O 3.38Å; Y209-T219 WeakPolarHBondContact CA-O 3.35Å; Y209-C220 HydrophobicContact CD1-CB 4.13Å; Y209-C220 HydrophobicContact CE1-CB 3.8Å
210	L	98.2	Very high	96.7	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.4	172.5	-52.4	179.6	0	0	0	108.9	I199 L200 A201 V208 I218 T219 L221 W236 V258	I199-L210 HydrophobicContact CG2-CB 3.87Å; I199-L210 HydrophobicContact CG2-CD2 4.45Å; L200-L210 CarbonylContact O-C 3.59Å; L200-L210 VanDerWaalsContact O-CA 3.26Å; L200-L210 WeakPolarHBondContact O-CA 3.27Å; A201-L210 HydrophobicContact CB-CD2 3.66Å; V208-L210 HydrophobicContact CG1-CD2 4.38Å; L210-I218 CarbonylContact O-C 3.52Å; L210-I218 WeakPolarHBondContact O-CA 3.49Å; L210-T219 WeakPolarHBondContact CB-OG1 3.38Å; L210-T219 PolarHBondContact N-O 3.05Å; L210-T219 PolarHBondContact O-N 3.3Å; L210-L221 HydrophobicContact CD1-CB 4Å; L210-L221 HydrophobicContact CD1-CD1 4.27Å; L210-L221 HydrophobicContact CD1-CD2 4.29Å; L210-L221 HydrophobicContact CD1-CG 4.42Å; L210-L221 HydrophobicContact CD2-CD2 4.4Å; L210-L221 HydrophobicContact CG-CB 4.03Å; L210-W236 HydrophobicContact CD2-CH2 4.17Å; L210-W236 HydrophobicContact CD2-CZ2 3.88Å; L210-V258 HydrophobicContact CD1-CB 4.21Å; L210-V258 HydrophobicContact CD1-CG1 3.35Å; L210-V258 HydrophobicContact CD1-CG2 3.89Å
211	W	98	Very high	96.7	Very high	25 Å²	25	43 Å²	43	10%	0.095	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.2	175	175.7	73.8	0	0	0	109.7	K176 L178 I199 L200 S213 D217 I472	K176-W211 HydrophobicContact CD-CH2 4.11Å; K176-W211 HydrophobicContact CD-CZ2 4.19Å; L178-W211 HydrophobicContact CD1-CD2 3.71Å; L178-W211 HydrophobicContact CD1-CE3 3.87Å; L178-W211 HydrophobicContact CD1-CG 4.13Å; L178-W211 HydrophobicContact CD1-CH2 4.41Å; L178-W211 HydrophobicContact CD1-CZ2 4.3Å; L178-W211 HydrophobicContact CD1-CZ3 4.21Å; L178-W211 HydrophobicContact CD2-CZ2 4.27Å; I199-W211 WeakPolarHBondContact CA-O 3.4Å; L200-W211 HydrophobicContact CB-CB 4.42Å; L200-W211 HydrophobicContact CB-CE3 3.99Å; L200-W211 HydrophobicContact CD2-CE3 4.26Å; L200-W211 PolarHBondContact N-O 2.88Å; L200-W211 PolarHBondContact O-N 3Å; W211-S213 WeakPolarHBondContact CH2-OG 3.35Å; W211-S213 VanDerWaalsContact CZ3-CA 3.46Å; W211-S213 WeakPolarHBondContact CZ3-OG 3.09Å; W211-S213 PolarHBondContact O-N 2.89Å; W211-D217 WeakPolarHBondContact CA-O 3.29Å; W211-I472 HydrophobicContact CE3-CD1 4.4Å; W211-I472 HydrophobicContact CH2-CD1 3.48Å; W211-I472 VanDerWaalsContact CH2-CD1 3.48Å; W211-I472 HydrophobicContact CZ3-CD1 3.41Å; W211-I472 VanDerWaalsContact CZ3-CD1 3.41Å
212	N	96.1	Very high	96.6	Very high	45 Å²	45	43.3 Å²	43.3	24%	0.241	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114.5	176.1	-174	-45.2	0	0	0	109.3	S214 S215 G216 D217	N212-S214 PolarHBondContact O-N 2.99Å; N212-S214 WeakPolarHBondContact OD1-CA 3.25Å; N212-S214 WeakPolarHBondContact OD1-CB 3.48Å; N212-S214 PolarHBondContact OD1-N 2.84Å; N212-S215 WeakPolarHBondContact CB-OG 3.5Å; N212-S215 PolarHBondContact OD1-N 2.84Å; N212-S215 VanDerWaalsContact OD1-N 3.08Å; N212-G216 VanDerWaalsContact O-CA 3.24Å; N212-G216 WeakPolarHBondContact O-CA 3.4Å; N212-G216 PolarHBondContact O-N 3.23Å; N212-D217 PolarHBondContact N-O 2.77Å
213	S	93.7	Very high	96.5	Very high	26 Å²	26	45.5 Å²	45.5	18%	0.182	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.2	-176.1	-179.7	0	0	0	0	113.8	N198 W211	N198-S213 WeakPolarHBondContact ND2-CB 3.3Å; N198-S213 WeakPolarHBondContact O-CB 3.38Å; N198-S213 PolarHBondContact O-N 3.13Å; W211-S213 WeakPolarHBondContact CH2-OG 3.35Å; W211-S213 VanDerWaalsContact CZ3-CA 3.46Å; W211-S213 WeakPolarHBondContact CZ3-OG 3.09Å; W211-S213 PolarHBondContact O-N 2.89Å
214	S	93.2	Very high	96.1	Very high	95 Å²	95	46 Å²	46	66%	0.664	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-45.7	180	-54.5	0	0	0	0	112.1	N198 N212	N198-S214 PolarHBondContact ND2-OG 3.25Å; N212-S214 PolarHBondContact O-N 2.99Å; N212-S214 WeakPolarHBondContact OD1-CA 3.25Å; N212-S214 WeakPolarHBondContact OD1-CB 3.48Å; N212-S214 PolarHBondContact OD1-N 2.84Å
215	S	94.6	Very high	95.4	Very high	66 Å²	66	48.1 Å²	48.1	46%	0.462	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-24.6	-179.5	65.2	0	0	0	0	114.1	N212 D217	N212-S215 WeakPolarHBondContact CB-OG 3.5Å; N212-S215 PolarHBondContact OD1-N 2.84Å; N212-S215 VanDerWaalsContact OD1-N 3.08Å; S215-D217 VanDerWaalsContact C-N 3.29Å; S215-D217 VanDerWaalsContact CB-OD2 3.26Å; S215-D217 WeakPolarHBondContact CB-OD2 3.43Å; S215-D217 WeakPolarHBondContact OG-CB 3.48Å; S215-D217 PolarHBondContact OG-N 2.87Å; S215-D217 PolarHBondContact OG-OD2 2.77Å
216	G	94.1	Very high	94.8	Very high	37 Å²	37	50.9 Å²	50.9	38%	0.381	30%	0.304	S	S	.	.			trans	82.1	2.1	-171.4	0	0	0	0	0	114.3	N212	N212-G216 VanDerWaalsContact O-CA 3.24Å; N212-G216 WeakPolarHBondContact O-CA 3.4Å; N212-G216 PolarHBondContact O-N 3.23Å
217	D	96.3	Very high	94	Very high	106 Å²	106	55.8 Å²	55.8	57%	0.567	33%	0.332	S	S	*	.			trans	-66.5	141.9	-179.5	-62.6	-43	0	0	0	111.7	W211 N212 S215	W211-D217 WeakPolarHBondContact CA-O 3.29Å; N212-D217 PolarHBondContact N-O 2.77Å; S215-D217 VanDerWaalsContact C-N 3.29Å; S215-D217 VanDerWaalsContact CB-OD2 3.26Å; S215-D217 WeakPolarHBondContact CB-OD2 3.43Å; S215-D217 WeakPolarHBondContact OG-CB 3.48Å; S215-D217 PolarHBondContact OG-N 2.87Å; S215-D217 PolarHBondContact OG-OD2 2.77Å
218	I	96.9	Very high	93.6	Very high	119 Å²	119	60.1 Å²	60.1	61%	0.61	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.5	177.6	-60.9	165.8	0	0	0	109	Y209 L210	Y209-I218 HydrophobicContact CD1-CG2 3.99Å; L210-I218 CarbonylContact O-C 3.52Å; L210-I218 WeakPolarHBondContact O-CA 3.49Å
219	T	97	Very high	93.3	Very high	51 Å²	51	61.5 Å²	61.5	31%	0.313	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.7	172.8	60.9	0	0	0	0	110.6	Y209 L210	Y209-T219 CarbonylContact C-O 3.38Å; Y209-T219 WeakPolarHBondContact CA-O 3.35Å; L210-T219 WeakPolarHBondContact CB-OG1 3.38Å; L210-T219 PolarHBondContact N-O 3.05Å; L210-T219 PolarHBondContact O-N 3.3Å
220	C	97.2	Very high	93.2	Very high	55 Å²	55	60.7 Å²	60.7	37%	0.372	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.8	166.9	-179	0	0	0	0	107.6	Y209	Y209-C220 HydrophobicContact CD1-CB 4.13Å; Y209-C220 HydrophobicContact CE1-CB 3.8Å
221	L	97.4	Very high	93.2	Very high	11 Å²	11	60.5 Å²	60.5	6%	0.058	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-46.3	-176.5	175.9	64.6	0	0	0	111.3	V208 L210 I244 I246 W256 V258	V208-L221 PolarHBondContact O-N 3.37Å; L210-L221 HydrophobicContact CD1-CB 4Å; L210-L221 HydrophobicContact CD1-CD1 4.27Å; L210-L221 HydrophobicContact CD1-CD2 4.29Å; L210-L221 HydrophobicContact CD1-CG 4.42Å; L210-L221 HydrophobicContact CD2-CD2 4.4Å; L210-L221 HydrophobicContact CG-CB 4.03Å; L221-I244 HydrophobicContact CD2-CG2 3.71Å; L221-I246 HydrophobicContact CD2-CD1 4.23Å; L221-W256 HydrophobicContact CD1-CE3 4.08Å; L221-W256 HydrophobicContact CD2-CB 3.97Å; L221-W256 HydrophobicContact CD2-CG 4.36Å; L221-W256 HydrophobicContact CG-CB 4.45Å; L221-W256 HydrophobicContact CG-CD2 4.43Å; L221-W256 HydrophobicContact CG-CE3 4.16Å; L221-V258 HydrophobicContact CD1-CG2 4.11Å; L221-V258 HydrophobicContact CD2-CG2 4Å
222	M	96.3	Very high	93.2	Very high	8 Å²	8	59.3 Å²	59.3	4%	0.039	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	156.8	-174.9	70.9	84.1	66.8	0	0	111.6	E207 V208 V231 I246 L248 Q254 W256	E207-M222 VanDerWaalsContact CA-O 3.29Å; E207-M222 WeakPolarHBondContact CA-O 3.41Å; V208-M222 HydrophobicContact CB-CG 4.1Å; V208-M222 HydrophobicContact CG2-CG 4.09Å; V208-M222 HydrophobicContact CG2-SD 4.01Å; V208-M222 PolarHBondContact N-O 2.86Å; M222-V231 HydrophobicContact SD-CG2 4.14Å; M222-I246 HydrophobicContact CG-CD1 3.8Å; M222-I246 HydrophobicContact SD-CD1 4.48Å; M222-L248 HydrophobicContact CE-CD2 4.4Å; M222-Q254 VanDerWaalsContact CE-OE1 3.26Å; M222-W256 HydrophobicContact CB-CD2 4.11Å; M222-W256 HydrophobicContact CB-CE3 4.24Å; M222-W256 HydrophobicContact CB-CH2 3.52Å; M222-W256 HydrophobicContact CB-CZ2 3.34Å; M222-W256 HydrophobicContact CB-CZ3 3.97Å; M222-W256 HydrophobicContact CE-CZ2 4.15Å; M222-W256 HydrophobicContact CG-CZ2 4.14Å
223	S	95.5	Very high	93.3	Very high	57 Å²	57	57.2 Å²	57.2	40%	0.399	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.3	167.8	178.6	0	0	0	0	108.4	Q206 G225	Q206-S223 WeakPolarHBondContact O-CA 3.5Å; S223-G225 PolarHBondContact O-N 2.9Å
224	C	90.3	Very high	93.5	Very high	11 Å²	11	56.3 Å²	56.3	7%	0.074	34%	0.336	C	S	.	.			trans	-60.5	-32.7	-178.3	-66.7	0	0	0	0	112.6	Q206 F226 E229	Q206-C224 HydrophobicContact CB-CB 4.43Å; Q206-C224 HydrophobicContact CG-CB 4.42Å; Q206-C224 PolarHBondContact O-N 3.43Å; Q206-C224 PolarHBondContact O-SG 3.22Å; C224-F226 VanDerWaalsContact C-N 3.29Å; C224-F226 VanDerWaalsContact O-CD2 3.32Å; C224-F226 WeakPolarHBondContact O-CD2 3.31Å; C224-F226 PolarHBondContact O-N 3.25Å; C224-E229 HydrophobicContact CB-CB 3.91Å
225	G	82	Confident	93.7	Very high	61 Å²	61	53.9 Å²	53.9	63%	0.629	32%	0.315	S	S	*	.			trans	76.3	5.9	176.4	0	0	0	0	0	115.8	S223	S223-G225 PolarHBondContact O-N 2.9Å
226	F	84.5	Confident	93.9	Very high	115 Å²	115	51.3 Å²	51.3	50%	0.504	30%	0.295	S	S	.	.	S	Bend	trans	-129.2	134.1	177.1	-61.5	-80	0	0	0	109.7	C224 D228 E229	C224-F226 VanDerWaalsContact C-N 3.29Å; C224-F226 VanDerWaalsContact O-CD2 3.32Å; C224-F226 WeakPolarHBondContact O-CD2 3.31Å; C224-F226 PolarHBondContact O-N 3.25Å; F226-D228 PolarHBondContact O-N 2.75Å; F226-D228 VanDerWaalsContact O-N 3.11Å; F226-E229 HydrophobicContact CB-CB 4.18Å; F226-E229 HydrophobicContact CB-CG 3.92Å; F226-E229 WeakPolarHBondContact CD2-OE1 3.14Å; F226-E229 PolarHBondContact O-N 2.78Å; F226-E229 VanDerWaalsContact O-N 3.11Å
227	D	79.6	Confident	94	Very high	148 Å²	148	49.8 Å²	49.8	79%	0.791	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.8	-168.8	-63.2	-23.4	0	0	0	114.5	Q206	Q206-D227 PolarHBondContact NE2-O 2.9Å
228	D	87.7	Confident	93.8	Very high	152 Å²	152	47.7 Å²	47.7	81%	0.813	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	3.6	-177	-65.4	-37.5	0	0	0	114	F226	F226-D228 PolarHBondContact O-N 2.75Å; F226-D228 VanDerWaalsContact O-N 3.11Å
229	E	93.5	Very high	93.5	Very high	29 Å²	29	46.8 Å²	46.8	14%	0.136	27%	0.267	C	S	.	.			trans	-95.6	151.1	178.4	-68.8	-161.2	-148.5	0	0	111.6	Q206 C224 F226 S249 A250 R252	Q206-E229 WeakPolarHBondContact CG-O 3.43Å; C224-E229 HydrophobicContact CB-CB 3.91Å; F226-E229 HydrophobicContact CB-CB 4.18Å; F226-E229 HydrophobicContact CB-CG 3.92Å; F226-E229 WeakPolarHBondContact CD2-OE1 3.14Å; F226-E229 PolarHBondContact O-N 2.78Å; F226-E229 VanDerWaalsContact O-N 3.11Å; E229-S249 WeakPolarHBondContact CA-OG 3.38Å; E229-A250 VanDerWaalsContact CD-CB 3.45Å; E229-A250 HydrophobicContact CG-CB 4.1Å; E229-A250 WeakPolarHBondContact OE2-CB 2.78Å; E229-R252 IonicContact OE1-CZ 2.78Å; E229-R252 IonicContact OE1-NH2 2.72Å; E229-R252 PolarHBondContact OE1-NH2 3.3Å; E229-R252 IonicContact OE2-CZ 3.59Å; E229-R252 IonicContact OE2-NE 2.59Å; E229-R252 IonicContact OE2-NH2 2.88Å; E229-R252 PolarHBondContact OE2-NH2 2.84Å
230	Y	96.1	Very high	93.4	Very high	53 Å²	53	47.1 Å²	47.1	21%	0.208	27%	0.271	C	S	.	.			trans	-149.7	162.6	174.1	60	-94	0	0	0	110.1	I184 L189 N205 S249 R277	I184-Y230 HydrophobicContact CD1-CD1 4.35Å; I184-Y230 HydrophobicContact CD1-CD2 3.47Å; I184-Y230 VanDerWaalsContact CD1-CD2 3.47Å; I184-Y230 HydrophobicContact CD1-CE2 4.2Å; I184-Y230 HydrophobicContact CD1-CG 3.56Å; L189-Y230 HydrophobicContact CD1-CD2 4.43Å; L189-Y230 HydrophobicContact CD1-CE2 4.04Å; L189-Y230 HydrophobicContact CD2-CE2 4.35Å; N205-Y230 WeakPolarHBondContact O-CA 3.13Å; N205-Y230 WeakPolarHBondContact O-CB 3.45Å; Y230-S249 PolarHBondContact N-OG 2.61Å; Y230-S249 PolarHBondContact O-N 3.04Å; Y230-R277 WeakPolarHBondContact OH-CD 3.4Å; Y230-R277 PolarHBondContact OH-NH1 3.25Å
231	V	97.5	Very high	93.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.9	177	-178.6	0	0	0	0	109.1	A203 N205 V208 M222 I246 L248	A203-V231 HydrophobicContact CB-CB 3.64Å; A203-V231 HydrophobicContact CB-CG1 3.49Å; A203-V231 VanDerWaalsContact CB-CG1 3.49Å; N205-V231 PolarHBondContact O-N 3.42Å; V208-V231 HydrophobicContact CG2-CB 4.35Å; V208-V231 HydrophobicContact CG2-CG1 4Å; V208-V231 HydrophobicContact CG2-CG2 3.76Å; M222-V231 HydrophobicContact SD-CG2 4.14Å; V231-I246 HydrophobicContact CG1-CG2 3.62Å; V231-I246 HydrophobicContact CG2-CG2 4.25Å; V231-L248 HydrophobicContact CB-CD2 4.5Å; V231-L248 HydrophobicContact CG2-CD2 3.94Å
232	S	97.3	Very high	93	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-21	-175.1	51.8	0	0	0	0	113.6	L189 N190 G247 L248 V278	L189-S232 WeakPolarHBondContact CB-O 3.43Å; N190-S232 PolarHBondContact N-O 2.96Å; N190-S232 VanDerWaalsContact N-O 3.15Å; S232-G247 PolarHBondContact N-O 2.92Å; S232-G247 PolarHBondContact OG-O 3.06Å; S232-G247 VanDerWaalsContact OG-O 3.09Å; S232-L248 VanDerWaalsContact OG-C 3.24Å; S232-L248 PolarHBondContact OG-O 2.6Å; S232-V278 CarbonylContact C-O 3.6Å; S232-V278 VanDerWaalsContact CB-O 3.24Å; S232-V278 WeakPolarHBondContact CB-O 3.45Å; S232-V278 VanDerWaalsContact OG-C 3.23Å; S232-V278 PolarHBondContact OG-N 3.15Å; S232-V278 PolarHBondContact OG-O 3.45Å
233	S	98.1	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	153.5	173.8	67.3	0	0	0	0	112.9	N190 I246 G247 V278 P279 V281	N190-S233 CarbonylContact O-C 3.57Å; N190-S233 WeakPolarHBondContact O-CA 3.48Å; S233-I246 CarbonylContact O-C 3.57Å; S233-I246 WeakPolarHBondContact O-CA 3.45Å; S233-G247 PolarHBondContact N-O 2.88Å; S233-G247 PolarHBondContact O-N 2.84Å; S233-G247 WeakPolarHBondContact OG-CA 3.36Å; S233-G247 PolarHBondContact OG-N 3.42Å; S233-V278 WeakPolarHBondContact CB-O 3.44Å; S233-V278 PolarHBondContact OG-O 3.04Å; S233-V278 VanDerWaalsContact OG-O 3.06Å; S233-P279 WeakPolarHBondContact CB-O 3.33Å; S233-V281 WeakPolarHBondContact OG-CG1 3.34Å
234	L	98	Very high	93.2	Very high	7 Å²	7	47.6 Å²	47.6	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.2	167.5	57.7	82.9	0	0	0	111.6	N190 L192 D193 A201 A203 V208 I244 A245	N190-L234 PolarHBondContact O-N 2.86Å; L192-L234 VanDerWaalsContact C-CD1 3.45Å; D193-L234 HydrophobicContact CB-CD1 3.44Å; D193-L234 VanDerWaalsContact CB-CD1 3.44Å; A201-L234 HydrophobicContact CB-CD1 4.07Å; A201-L234 HydrophobicContact CB-CD2 4.28Å; A203-L234 HydrophobicContact CB-CD2 3.88Å; V208-L234 HydrophobicContact CG1-CD2 4.23Å; L234-I244 HydrophobicContact CB-CD1 4.18Å; L234-I244 HydrophobicContact CD1-CD1 4.47Å; L234-A245 VanDerWaalsContact CA-O 3.24Å; L234-A245 WeakPolarHBondContact CA-O 3.28Å
235	E	98.2	Very high	93.5	Very high	45 Å²	45	47.1 Å²	47.1	21%	0.21	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	129.3	171.2	-168.1	-179.9	119.3	0	0	109.4	D193 A245 V281 T282 W283	D193-E235 WeakPolarHBondContact OD2-CA 3.15Å; E235-A245 PolarHBondContact N-O 2.73Å; E235-A245 PolarHBondContact O-N 2.91Å; E235-V281 HydrophobicContact CB-CG2 3.85Å; E235-T282 WeakPolarHBondContact OE1-CA 3.21Å; E235-T282 PolarHBondContact OE1-OG1 2.86Å; E235-T282 WeakPolarHBondContact OE2-CA 3.35Å; E235-T282 WeakPolarHBondContact OE2-CB 3.42Å; E235-T282 PolarHBondContact OE2-OG1 2.79Å; E235-W283 PolarHBondContact O-NE1 3.37Å; E235-W283 PolarHBondContact OE1-N 3.39Å
236	W	98	Very high	94.3	Very high	12 Å²	12	44.2 Å²	44.2	5%	0.045	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	143.6	173	-71	101.4	0	0	0	110.8	D193 S195 I199 A201 L210 P238 I244 V258 W283	D193-W236 PolarHBondContact O-NE1 2.74Å; D193-W236 VanDerWaalsContact OD2-CD1 3.31Å; D193-W236 PolarHBondContact OD2-N 3.03Å; S195-W236 VanDerWaalsContact CB-CD2 3.47Å; I199-W236 HydrophobicContact CB-CH2 4.4Å; I199-W236 HydrophobicContact CB-CZ2 4.21Å; I199-W236 HydrophobicContact CG2-CH2 4.2Å; I199-W236 HydrophobicContact CG2-CZ2 3.97Å; A201-W236 HydrophobicContact CB-CZ2 3.84Å; L210-W236 HydrophobicContact CD2-CH2 4.17Å; L210-W236 HydrophobicContact CD2-CZ2 3.88Å; W236-P238 WeakPolarHBondContact O-CD 3.35Å; W236-I244 HydrophobicContact CD2-CB 4.17Å; W236-I244 HydrophobicContact CD2-CD1 4.05Å; W236-I244 HydrophobicContact CD2-CG1 4.18Å; W236-I244 HydrophobicContact CE3-CB 3.87Å; W236-I244 HydrophobicContact CE3-CG1 4.4Å; W236-I244 HydrophobicContact CG-CD1 4.47Å; W236-I244 HydrophobicContact CG-CG1 4.48Å; W236-I244 HydrophobicContact CZ2-CD1 4.19Å; W236-I244 HydrophobicContact CZ3-CB 4.16Å; W236-V258 HydrophobicContact CH2-CB 4.23Å; W236-V258 HydrophobicContact CH2-CG1 4.21Å; W236-V258 HydrophobicContact CH2-CG2 3.59Å; W236-V258 HydrophobicContact CZ3-CB 4.22Å; W236-V258 HydrophobicContact CZ3-CG2 3.59Å; W236-W283 VanDerWaalsContact O-CD1 3.29Å
237	S	96.9	Very high	94.9	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	21%	0.211	C	C	.	.			trans	-71.6	125.4	172.5	-179.3	0	0	0	0	109.7	D239 S240 I243	S237-D239 VanDerWaalsContact C-N 3.26Å; S237-D239 PolarHBondContact O-N 2.99Å; S237-S240 WeakPolarHBondContact CB-O 3.42Å; S237-S240 PolarHBondContact OG-N 2.71Å; S237-I243 WeakPolarHBondContact CB-O 3.25Å; S237-I243 PolarHBondContact N-O 3.09Å
238	P	91.7	Very high	95.7	Very high	63 Å²	63	31.7 Å²	31.7	41%	0.409	17%	0.173	S	C	.	.	S	Bend	trans	-69.8	-25.6	178.3	27.7	-34.1	0	0	0	112.5	W236 W283	W236-P238 WeakPolarHBondContact O-CD 3.35Å; P238-W283 VanDerWaalsContact CD-CB 3.47Å; P238-W283 HydrophobicContact CG-CB 4.06Å
239	D	91.2	Very high	96	Very high	100 Å²	100	25.4 Å²	25.4	54%	0.535	14%	0.141	S	C	.	.	S	Bend	trans	-97.6	-22.4	-176	-58.4	-67.2	0	0	0	112.9	S237 E285	S237-D239 VanDerWaalsContact C-N 3.26Å; S237-D239 PolarHBondContact O-N 2.99Å; D239-E285 WeakPolarHBondContact OD2-CA 3.38Å; D239-E285 PolarHBondContact OD2-N 2.79Å
240	S	94.1	Very high	95.9	Very high	57 Å²	57	26.5 Å²	26.5	40%	0.399	16%	0.155	S	C	.	.			trans	-125.6	92.8	-179.7	-66.4	0	0	0	0	109.8	S237 N242 I243	S237-S240 WeakPolarHBondContact CB-O 3.42Å; S237-S240 PolarHBondContact OG-N 2.71Å; S240-N242 PolarHBondContact O-N 3.25Å; S240-I243 PolarHBondContact O-N 3.2Å
241	P	91.3	Very high	95.7	Very high	48 Å²	48	24.5 Å²	24.5	31%	0.312	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.8	-165	25.6	-36.9	0	0	0	114.5	V196 D197	V196-P241 HydrophobicContact CG2-CB 3.51Å; D197-P241 WeakPolarHBondContact OD2-CB 3.36Å
242	N	94.4	Very high	95.4	Very high	60 Å²	60	27.1 Å²	27.1	32%	0.321	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.3	179	-64.8	-39.4	0	0	0	114.2	S240 V258 S259	S240-N242 PolarHBondContact O-N 3.25Å; N242-V258 WeakPolarHBondContact O-CB 3.42Å; N242-V258 PolarHBondContact O-N 3.3Å; N242-S259 PolarHBondContact ND2-OG 2.9Å; N242-S259 PolarHBondContact OD1-OG 3.03Å; N242-S259 VanDerWaalsContact OD1-OG 3.04Å
243	I	97.5	Very high	95.4	Very high	34 Å²	34	27.3 Å²	27.3	17%	0.174	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	132	-173.5	-58.2	-60.4	0	0	0	110.4	S237 S240 W256 D257 V264 W283	S237-I243 WeakPolarHBondContact CB-O 3.25Å; S237-I243 PolarHBondContact N-O 3.09Å; S240-I243 PolarHBondContact O-N 3.2Å; I243-W256 WeakPolarHBondContact CA-O 3.26Å; I243-D257 HydrophobicContact CD1-CB 3.73Å; I243-V264 HydrophobicContact CD1-CG2 4.22Å; I243-W283 HydrophobicContact CG2-CH2 4.04Å; I243-W283 HydrophobicContact CG2-CZ2 4.18Å
244	I	98.2	Very high	95.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.7	172.5	-168.6	171.4	0	0	0	110.5	A201 L221 L234 W236 I246 L255 W256 V258	A201-I244 HydrophobicContact CB-CD1 3.52Å; L221-I244 HydrophobicContact CD2-CG2 3.71Å; L234-I244 HydrophobicContact CB-CD1 4.18Å; L234-I244 HydrophobicContact CD1-CD1 4.47Å; W236-I244 HydrophobicContact CD2-CB 4.17Å; W236-I244 HydrophobicContact CD2-CD1 4.05Å; W236-I244 HydrophobicContact CD2-CG1 4.18Å; W236-I244 HydrophobicContact CE3-CB 3.87Å; W236-I244 HydrophobicContact CE3-CG1 4.4Å; W236-I244 HydrophobicContact CG-CD1 4.47Å; W236-I244 HydrophobicContact CG-CG1 4.48Å; W236-I244 HydrophobicContact CZ2-CD1 4.19Å; W236-I244 HydrophobicContact CZ3-CB 4.16Å; I244-I246 HydrophobicContact CG1-CG1 4.45Å; I244-I246 HydrophobicContact CG2-CD1 4.27Å; I244-I246 HydrophobicContact CG2-CG1 4.28Å; I244-L255 WeakPolarHBondContact O-CA 3.16Å; I244-W256 HydrophobicContact CG2-CB 3.88Å; I244-W256 PolarHBondContact N-O 3.08Å; I244-W256 PolarHBondContact O-N 3.3Å; I244-V258 HydrophobicContact CG2-CG2 4.08Å
245	A	98.3	Very high	95.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.8	168.5	0	0	0	0	0	109.7	L234 E235 Q254 L255 V281 W283 V288	L234-A245 VanDerWaalsContact CA-O 3.24Å; L234-A245 WeakPolarHBondContact CA-O 3.28Å; E235-A245 PolarHBondContact N-O 2.73Å; E235-A245 PolarHBondContact O-N 2.91Å; A245-Q254 CarbonylContact C-O 3.53Å; A245-Q254 WeakPolarHBondContact CA-O 3.34Å; A245-L255 HydrophobicContact CB-CD2 3.82Å; A245-V281 HydrophobicContact CB-CG2 4.19Å; A245-W283 HydrophobicContact CB-CZ2 3.54Å; A245-V288 HydrophobicContact CB-CG1 4.49Å
246	I	98.1	Very high	95.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	119.8	-179.6	-57.8	177.9	0	0	0	108.4	V208 L221 M222 V231 S233 I244 L248 V253 Q254 W256	V208-I246 HydrophobicContact CB-CD1 4.41Å; V208-I246 HydrophobicContact CG2-CD1 3.93Å; V208-I246 HydrophobicContact CG2-CG2 4.37Å; L221-I246 HydrophobicContact CD2-CD1 4.23Å; M222-I246 HydrophobicContact CG-CD1 3.8Å; M222-I246 HydrophobicContact SD-CD1 4.48Å; V231-I246 HydrophobicContact CG1-CG2 3.62Å; V231-I246 HydrophobicContact CG2-CG2 4.25Å; S233-I246 CarbonylContact O-C 3.57Å; S233-I246 WeakPolarHBondContact O-CA 3.45Å; I244-I246 HydrophobicContact CG1-CG1 4.45Å; I244-I246 HydrophobicContact CG2-CD1 4.27Å; I244-I246 HydrophobicContact CG2-CG1 4.28Å; I246-L248 HydrophobicContact CG2-CD2 3.92Å; I246-V253 CarbonylContact O-C 3.59Å; I246-V253 WeakPolarHBondContact O-CA 3.24Å; I246-Q254 PolarHBondContact N-O 2.64Å; I246-Q254 PolarHBondContact O-N 3.02Å; I246-W256 HydrophobicContact CD1-CG 4.14Å
247	G	96.9	Very high	95.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.6	172.5	0	0	0	0	0	110.6	S232 S233	S232-G247 PolarHBondContact N-O 2.92Å; S232-G247 PolarHBondContact OG-O 3.06Å; S232-G247 VanDerWaalsContact OG-O 3.09Å; S233-G247 PolarHBondContact N-O 2.88Å; S233-G247 PolarHBondContact O-N 2.84Å; S233-G247 WeakPolarHBondContact OG-CA 3.36Å; S233-G247 PolarHBondContact OG-N 3.42Å
248	L	95.8	Very high	95.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	157.4	-177.5	-59.4	-178	0	0	0	112.2	M222 V231 S232 I246 A250 G251 R252 Q254 V278	M222-L248 HydrophobicContact CE-CD2 4.4Å; V231-L248 HydrophobicContact CB-CD2 4.5Å; V231-L248 HydrophobicContact CG2-CD2 3.94Å; S232-L248 VanDerWaalsContact OG-C 3.24Å; S232-L248 PolarHBondContact OG-O 2.6Å; I246-L248 HydrophobicContact CG2-CD2 3.92Å; L248-A250 PolarHBondContact O-N 2.85Å; L248-G251 PolarHBondContact O-N 3.26Å; L248-R252 HydrophobicContact CB-CB 4.46Å; L248-R252 HydrophobicContact CD1-CB 4.3Å; L248-R252 PolarHBondContact N-O 2.83Å; L248-Q254 HydrophobicContact CD1-CG 4.28Å; L248-V278 PolarHBondContact O-N 3.23Å
249	S	94.6	Very high	95.4	Very high	21 Å²	21	30.6 Å²	30.6	15%	0.147	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.9	177	69.6	0	0	0	0	113.6	E229 Y230 G251 R277	E229-S249 WeakPolarHBondContact CA-OG 3.38Å; Y230-S249 PolarHBondContact N-OG 2.61Å; Y230-S249 PolarHBondContact O-N 3.04Å; S249-G251 VanDerWaalsContact C-N 3.25Å; S249-G251 PolarHBondContact O-N 3.22Å; S249-R277 VanDerWaalsContact O-CA 3.23Å; S249-R277 WeakPolarHBondContact O-CA 3.22Å; S249-R277 PolarHBondContact O-N 2.86Å
250	A	91.5	Very high	95.6	Very high	52 Å²	52	28.8 Å²	28.8	43%	0.43	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	8.5	175.4	0	0	0	0	0	114.9	E229 L248	E229-A250 VanDerWaalsContact CD-CB 3.45Å; E229-A250 HydrophobicContact CG-CB 4.1Å; E229-A250 WeakPolarHBondContact OE2-CB 2.78Å; L248-A250 PolarHBondContact O-N 2.85Å
251	G	91.6	Very high	95.7	Very high	10 Å²	10	31.3 Å²	31.3	10%	0.103	18%	0.182	C	C	.	.	S	Bend	trans	78.7	23.2	176.6	0	0	0	0	0	114.5	L248 S249 G276	L248-G251 PolarHBondContact O-N 3.26Å; S249-G251 VanDerWaalsContact C-N 3.25Å; S249-G251 PolarHBondContact O-N 3.22Å; G251-G276 WeakPolarHBondContact CA-O 3.49Å; G251-G276 PolarHBondContact N-O 3Å
252	R	92.5	Very high	95.9	Very high	57 Å²	57	31.3 Å²	31.3	22%	0.215	18%	0.183	C	C	.	.			trans	-106.2	143.4	178.2	-58.5	-177.7	-69.5	-171.7	1.7	109.6	E229 L248 T266	E229-R252 IonicContact OE1-CZ 2.78Å; E229-R252 IonicContact OE1-NH2 2.72Å; E229-R252 PolarHBondContact OE1-NH2 3.3Å; E229-R252 IonicContact OE2-CZ 3.59Å; E229-R252 IonicContact OE2-NE 2.59Å; E229-R252 IonicContact OE2-NH2 2.88Å; E229-R252 PolarHBondContact OE2-NH2 2.84Å; L248-R252 HydrophobicContact CB-CB 4.46Å; L248-R252 HydrophobicContact CD1-CB 4.3Å; L248-R252 PolarHBondContact N-O 2.83Å; R252-T266 HydrophobicContact CB-CG2 4.33Å
253	V	95.8	Very high	96.1	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.5	169.1	-175.6	0	0	0	0	108.3	I246 M267 V278 V281 V288	I246-V253 CarbonylContact O-C 3.59Å; I246-V253 WeakPolarHBondContact O-CA 3.24Å; V253-M267 HydrophobicContact CB-CB 4.33Å; V253-M267 HydrophobicContact CB-CE 3.8Å; V253-M267 HydrophobicContact CG1-CE 3.47Å; V253-M267 VanDerWaalsContact CG1-CE 3.47Å; V253-M267 PolarHBondContact N-O 3.37Å; V253-M267 WeakPolarHBondContact O-CB 3.46Å; V253-M267 PolarHBondContact O-N 2.92Å; V253-V278 HydrophobicContact CG2-CG1 4.07Å; V253-V278 HydrophobicContact CG2-CG2 4.12Å; V253-V281 HydrophobicContact CG1-CG1 4.25Å; V253-V281 HydrophobicContact CG2-CG1 4.44Å; V253-V288 HydrophobicContact CG1-CG1 4.35Å
254	Q	96.7	Very high	96	Very high	17 Å²	17	34.6 Å²	34.6	8%	0.079	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	143.9	177.7	-66.6	-175.1	-7.7	0	0	110.4	M222 A245 I246 L248 L263 R265 T266	M222-Q254 VanDerWaalsContact CE-OE1 3.26Å; A245-Q254 CarbonylContact C-O 3.53Å; A245-Q254 WeakPolarHBondContact CA-O 3.34Å; I246-Q254 PolarHBondContact N-O 2.64Å; I246-Q254 PolarHBondContact O-N 3.02Å; L248-Q254 HydrophobicContact CD1-CG 4.28Å; Q254-L263 HydrophobicContact CB-CD1 3.75Å; Q254-L263 HydrophobicContact CG-CD1 3.96Å; Q254-R265 CarbonylContact C-O 3.48Å; Q254-R265 VanDerWaalsContact CA-O 3.3Å; Q254-R265 WeakPolarHBondContact CA-O 3.23Å; Q254-T266 HydrophobicContact CG-CG2 4.32Å
255	L	97.8	Very high	95.9	Very high	9 Å²	9	37.3 Å²	37.3	5%	0.047	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.7	168.6	-57.4	-176.8	0	0	0	108.2	I244 A245 V264 R265 M267 W283 V288 T302	I244-L255 WeakPolarHBondContact O-CA 3.16Å; A245-L255 HydrophobicContact CB-CD2 3.82Å; L255-V264 HydrophobicContact CB-CB 4.3Å; L255-V264 WeakPolarHBondContact O-CB 3.42Å; L255-V264 PolarHBondContact O-N 2.73Å; L255-R265 HydrophobicContact CB-CB 4.41Å; L255-R265 HydrophobicContact CD1-CB 4.46Å; L255-R265 PolarHBondContact N-O 2.9Å; L255-R265 PolarHBondContact O-N 3.04Å; L255-M267 HydrophobicContact CD1-CE 4.41Å; L255-M267 HydrophobicContact CD2-CE 4.1Å; L255-M267 HydrophobicContact CG-CE 4.13Å; L255-W283 HydrophobicContact CD1-CH2 4.36Å; L255-W283 HydrophobicContact CD2-CH2 3.7Å; L255-W283 HydrophobicContact CD2-CZ2 3.79Å; L255-V288 HydrophobicContact CD2-CG2 4.34Å; L255-T302 HydrophobicContact CD1-CG2 3.62Å
256	W	98.2	Very high	95.7	Very high	33 Å²	33	39.9 Å²	39.9	13%	0.125	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.9	179.8	-75.3	79	0	0	0	110.1	L221 M222 I243 I244 I246 S262 L263	L221-W256 HydrophobicContact CD1-CE3 4.08Å; L221-W256 HydrophobicContact CD2-CB 3.97Å; L221-W256 HydrophobicContact CD2-CG 4.36Å; L221-W256 HydrophobicContact CG-CB 4.45Å; L221-W256 HydrophobicContact CG-CD2 4.43Å; L221-W256 HydrophobicContact CG-CE3 4.16Å; M222-W256 HydrophobicContact CB-CD2 4.11Å; M222-W256 HydrophobicContact CB-CE3 4.24Å; M222-W256 HydrophobicContact CB-CH2 3.52Å; M222-W256 HydrophobicContact CB-CZ2 3.34Å; M222-W256 HydrophobicContact CB-CZ3 3.97Å; M222-W256 HydrophobicContact CE-CZ2 4.15Å; M222-W256 HydrophobicContact CG-CZ2 4.14Å; I243-W256 WeakPolarHBondContact CA-O 3.26Å; I244-W256 HydrophobicContact CG2-CB 3.88Å; I244-W256 PolarHBondContact N-O 3.08Å; I244-W256 PolarHBondContact O-N 3.3Å; I246-W256 HydrophobicContact CD1-CG 4.14Å; W256-S262 WeakPolarHBondContact CA-O 3.3Å; W256-S262 VanDerWaalsContact CE3-C 3.47Å; W256-L263 HydrophobicContact CD2-CB 4.25Å; W256-L263 HydrophobicContact CD2-CD1 4.3Å; W256-L263 HydrophobicContact CE3-CB 4.34Å; W256-L263 HydrophobicContact CG-CD1 4.44Å; W256-L263 HydrophobicContact CH2-CB 4.05Å; W256-L263 HydrophobicContact CZ2-CB 3.93Å; W256-L263 HydrophobicContact CZ2-CD1 4.11Å; W256-L263 HydrophobicContact CZ2-CG 4.48Å; W256-L263 HydrophobicContact CZ3-CB 4.26Å
257	D	97.4	Very high	95.5	Very high	38 Å²	38	40 Å²	40	20%	0.203	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.6	167.7	173.6	7.8	0	0	0	108.7	I243 S259 S260 Q261 S262 V264	I243-D257 HydrophobicContact CD1-CB 3.73Å; D257-S259 WeakPolarHBondContact OD1-CB 3.39Å; D257-S259 PolarHBondContact OD1-N 3.15Å; D257-S260 WeakPolarHBondContact CB-OG 3.43Å; D257-S260 WeakPolarHBondContact OD2-CB 3.44Å; D257-S260 PolarHBondContact OD2-OG 2.96Å; D257-Q261 VanDerWaalsContact O-CA 3.26Å; D257-Q261 WeakPolarHBondContact O-CA 3.24Å; D257-Q261 PolarHBondContact O-N 3.1Å; D257-S262 PolarHBondContact N-O 3Å; D257-S262 PolarHBondContact O-N 3.47Å; D257-V264 HydrophobicContact CB-CG2 3.69Å
258	V	96.8	Very high	95.1	Very high	18 Å²	18	48.7 Å²	48.7	11%	0.109	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-31.4	-175.3	171	0	0	0	0	112.1	L210 L221 W236 N242 I244 Q261	L210-V258 HydrophobicContact CD1-CB 4.21Å; L210-V258 HydrophobicContact CD1-CG1 3.35Å; L210-V258 HydrophobicContact CD1-CG2 3.89Å; L221-V258 HydrophobicContact CD1-CG2 4.11Å; L221-V258 HydrophobicContact CD2-CG2 4Å; W236-V258 HydrophobicContact CH2-CB 4.23Å; W236-V258 HydrophobicContact CH2-CG1 4.21Å; W236-V258 HydrophobicContact CH2-CG2 3.59Å; W236-V258 HydrophobicContact CZ3-CB 4.22Å; W236-V258 HydrophobicContact CZ3-CG2 3.59Å; N242-V258 WeakPolarHBondContact O-CB 3.42Å; N242-V258 PolarHBondContact O-N 3.3Å; I244-V258 HydrophobicContact CG2-CG2 4.08Å; V258-Q261 PolarHBondContact O-N 3.15Å
259	S	95.1	Very high	93.9	Very high	85 Å²	85	50.5 Å²	50.5	59%	0.594	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-39.6	177.9	-79.1	0	0	0	0	111.6	N242 D257	N242-S259 PolarHBondContact ND2-OG 2.9Å; N242-S259 PolarHBondContact OD1-OG 3.03Å; N242-S259 VanDerWaalsContact OD1-OG 3.04Å; D257-S259 WeakPolarHBondContact OD1-CB 3.39Å; D257-S259 PolarHBondContact OD1-N 3.15Å
260	S	95.6	Very high	92	Very high	61 Å²	61	53.1 Å²	53.1	43%	0.427	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-5.9	177.2	62.1	0	0	0	0	114	D257 S262	D257-S260 WeakPolarHBondContact CB-OG 3.43Å; D257-S260 WeakPolarHBondContact OD2-CB 3.44Å; D257-S260 PolarHBondContact OD2-OG 2.96Å; S260-S262 PolarHBondContact O-N 2.84Å; S260-S262 PolarHBondContact OG-OG 2.64Å
261	Q	95.2	Very high	90.2	Very high	111 Å²	111	54.7 Å²	54.7	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	44.8	-171.8	-61.8	-177.5	1.4	0	0	112.2	D257 V258	D257-Q261 VanDerWaalsContact O-CA 3.26Å; D257-Q261 WeakPolarHBondContact O-CA 3.24Å; D257-Q261 PolarHBondContact O-N 3.1Å; V258-Q261 PolarHBondContact O-N 3.15Å
262	S	96.7	Very high	88	Confident	48 Å²	48	58 Å²	58	34%	0.336	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.3	-172.3	76.7	0	0	0	0	112.9	W256 D257 S260 V264	W256-S262 WeakPolarHBondContact CA-O 3.3Å; W256-S262 VanDerWaalsContact CE3-C 3.47Å; D257-S262 PolarHBondContact N-O 3Å; D257-S262 PolarHBondContact O-N 3.47Å; S260-S262 PolarHBondContact O-N 2.84Å; S260-S262 PolarHBondContact OG-OG 2.64Å; S262-V264 PolarHBondContact O-N 3.43Å
263	L	97.3	Very high	85.8	Confident	76 Å²	76	61.7 Å²	61.7	40%	0.398	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115	173.1	176.9	68.1	0	0	0	109.3	Q254 W256 R265	Q254-L263 HydrophobicContact CB-CD1 3.75Å; Q254-L263 HydrophobicContact CG-CD1 3.96Å; W256-L263 HydrophobicContact CD2-CB 4.25Å; W256-L263 HydrophobicContact CD2-CD1 4.3Å; W256-L263 HydrophobicContact CE3-CB 4.34Å; W256-L263 HydrophobicContact CG-CD1 4.44Å; W256-L263 HydrophobicContact CH2-CB 4.05Å; W256-L263 HydrophobicContact CZ2-CB 3.93Å; W256-L263 HydrophobicContact CZ2-CD1 4.11Å; W256-L263 HydrophobicContact CZ2-CG 4.48Å; W256-L263 HydrophobicContact CZ3-CB 4.26Å; L263-R265 WeakPolarHBondContact CD1-O 3.43Å
264	V	96.2	Very high	83.8	Confident	87 Å²	87	65.8 Å²	65.8	53%	0.527	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-44.7	177	179.9	0	0	0	0	110.5	I243 L255 D257 S262	I243-V264 HydrophobicContact CD1-CG2 4.22Å; L255-V264 HydrophobicContact CB-CB 4.3Å; L255-V264 WeakPolarHBondContact O-CB 3.42Å; L255-V264 PolarHBondContact O-N 2.73Å; D257-V264 HydrophobicContact CB-CG2 3.69Å; S262-V264 PolarHBondContact O-N 3.43Å
265	R	95.3	Very high	82.1	Confident	57 Å²	57	65.3 Å²	65.3	22%	0.215	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	145.2	-173.6	176.9	171.9	-99.2	-159.1	-10.6	112.2	Q254 L255 L263 M267 D301 T302 I304	Q254-R265 CarbonylContact C-O 3.48Å; Q254-R265 VanDerWaalsContact CA-O 3.3Å; Q254-R265 WeakPolarHBondContact CA-O 3.23Å; L255-R265 HydrophobicContact CB-CB 4.41Å; L255-R265 HydrophobicContact CD1-CB 4.46Å; L255-R265 PolarHBondContact N-O 2.9Å; L255-R265 PolarHBondContact O-N 3.04Å; L263-R265 WeakPolarHBondContact CD1-O 3.43Å; R265-M267 HydrophobicContact CG-CG 3.86Å; R265-D301 PolarHBondContact NH1-O 2.77Å; R265-T302 PolarHBondContact NH1-O 3.12Å; R265-I304 PolarHBondContact NH1-O 3.14Å; R265-I304 PolarHBondContact NH2-O 3.24Å
266	T	95.1	Very high	81.4	Confident	53 Å²	53	66.2 Å²	66.2	33%	0.325	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.8	162.3	-61.8	0	0	0	0	109.4	R252 Q254	R252-T266 HydrophobicContact CB-CG2 4.33Å; Q254-T266 HydrophobicContact CG-CG2 4.32Å
267	M	94.1	Very high	81.2	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.015	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.1	173.8	-58.5	-179	-66	0	0	107.7	V253 L255 R265 V288 H300 H307	V253-M267 HydrophobicContact CB-CB 4.33Å; V253-M267 HydrophobicContact CB-CE 3.8Å; V253-M267 HydrophobicContact CG1-CE 3.47Å; V253-M267 VanDerWaalsContact CG1-CE 3.47Å; V253-M267 PolarHBondContact N-O 3.37Å; V253-M267 WeakPolarHBondContact O-CB 3.46Å; V253-M267 PolarHBondContact O-N 2.92Å; L255-M267 HydrophobicContact CD1-CE 4.41Å; L255-M267 HydrophobicContact CD2-CE 4.1Å; L255-M267 HydrophobicContact CG-CE 4.13Å; R265-M267 HydrophobicContact CG-CG 3.86Å; M267-V288 HydrophobicContact CE-CB 4.37Å; M267-V288 HydrophobicContact CE-CG1 4.38Å; M267-H300 HydrophobicContact CE-CB 4.08Å; M267-H300 HydrophobicContact SD-CB 3.51Å; M267-H300 VanDerWaalsContact SD-CB 3.51Å; M267-H307 WeakPolarHBondContact CA-NE2 3.37Å; M267-H307 HydrophobicContact CG-CB 4.27Å; M267-H307 HydrophobicContact SD-CB 4.06Å
268	R	87.3	Confident	81.2	Confident	182 Å²	182	64 Å²	64	69%	0.687	41%	0.406	S	S	*	.			trans	-134	147.2	-175.6	61.6	178.8	173.5	-177.6	-3.3	109.4	G270 H307	R268-G270 PolarHBondContact O-N 3.02Å; R268-H307 PolarHBondContact N-NE2 3.48Å; R268-H307 PolarHBondContact O-NE2 3.01Å
269	L	70.9	Confident	81.2	Confident	39 Å²	39	63.2 Å²	63.2	20%	0.204	40%	0.4	C	S	.	.			trans	-76.4	122.1	171.1	-71.6	153.9	0	0	0	109.1	G271 A275 R298 E308	L269-G271 PolarHBondContact O-N 2.98Å; L269-A275 HydrophobicContact CD1-CB 3.33Å; L269-R298 VanDerWaalsContact CD1-NE 3.33Å; L269-E308 WeakPolarHBondContact CD2-OE2 3.39Å
270	G	55.5	Low	81.3	Confident	76 Å²	76	59.3 Å²	59.3	78%	0.784	37%	0.373	S	S	*	.	S	Bend	trans	-68.3	118.2	170.9	0	0	0	0	0	109.9	R268	R268-G270 PolarHBondContact O-N 3.02Å
271	G	52.7	Low	81.4	Confident	84 Å²	84	56.7 Å²	56.7	87%	0.866	36%	0.355	S	S	*	.	S	Bend	trans	90.4	1.6	163.4	0	0	0	0	0	117.8	L269	L269-G271 PolarHBondContact O-N 2.98Å
272	V	46.2	Very low	81.6	Confident	79 Å²	79	51.6 Å²	51.6	48%	0.479	33%	0.331	S	S	.	.			trans	-127.7	96.2	-179.3	-170.9	0	0	0	0	110.3	S274 A275	V272-S274 PolarHBondContact O-N 3.33Å; V272-S274 VanDerWaalsContact O-N 3.11Å; V272-A275 PolarHBondContact O-N 2.94Å
273	S	46.3	Very low	81.6	Confident	136 Å²	136	49.6 Å²	49.6	95%	0.951	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-9.8	167.1	48.8	0	0	0	0	113.3
274	S	52.4	Low	81.6	Confident	90 Å²	90	47.3 Å²	47.3	63%	0.629	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	8.3	-177.1	-166.1	0	0	0	0	114.6	V272 G276	V272-S274 PolarHBondContact O-N 3.33Å; V272-S274 VanDerWaalsContact O-N 3.11Å; S274-G276 PolarHBondContact O-N 3.21Å; S274-G276 VanDerWaalsContact O-N 3.14Å
275	A	61.8	Low	81.5	Confident	7 Å²	7	47.4 Å²	47.4	6%	0.058	30%	0.297	C	S	.	.			trans	-61.5	-23	-179.9	0	0	0	0	0	113	L269 V272 S292	L269-A275 HydrophobicContact CD1-CB 3.33Å; V272-A275 PolarHBondContact O-N 2.94Å; A275-S292 PolarHBondContact O-OG 2.85Å
276	G	83.2	Confident	81.5	Confident	28 Å²	28	48.3 Å²	48.3	29%	0.289	30%	0.301	S	S	.	.			trans	63.6	177.8	-176.5	0	0	0	0	0	112.8	G251 S274	G251-G276 WeakPolarHBondContact CA-O 3.49Å; G251-G276 PolarHBondContact N-O 3Å; S274-G276 PolarHBondContact O-N 3.21Å; S274-G276 VanDerWaalsContact O-N 3.14Å
277	R	94.3	Very high	81.6	Confident	19 Å²	19	46.2 Å²	46.2	7%	0.072	29%	0.288	C	S	.	.			trans	-61	156.2	178.8	64.9	-177	-178.4	-179.7	9.7	112.9	D186 Y230 S249 P279 S292 K293 E318	D186-R277 IonicContact OD1-NH2 2.78Å; D186-R277 IonicContact OD2-CZ 3.53Å; D186-R277 IonicContact OD2-NH1 3.46Å; D186-R277 PolarHBondContact OD2-NH1 3.17Å; D186-R277 IonicContact OD2-NH2 2.86Å; D186-R277 PolarHBondContact OD2-NH2 3.11Å; Y230-R277 WeakPolarHBondContact OH-CD 3.4Å; Y230-R277 PolarHBondContact OH-NH1 3.25Å; S249-R277 VanDerWaalsContact O-CA 3.23Å; S249-R277 WeakPolarHBondContact O-CA 3.22Å; S249-R277 PolarHBondContact O-N 2.86Å; R277-P279 WeakPolarHBondContact O-CD 3.37Å; R277-S292 WeakPolarHBondContact O-CA 3.07Å; R277-K293 HydrophobicContact CG-CB 3.87Å; R277-K293 HydrophobicContact CG-CD 4.12Å; R277-K293 PolarHBondContact O-N 2.91Å; R277-E318 WeakPolarHBondContact CG-OE1 3.43Å; R277-E318 IonicContact CZ-OE1 3.59Å; R277-E318 IonicContact CZ-OE2 3.43Å; R277-E318 IonicContact NE-OE1 3.69Å; R277-E318 PolarHBondContact NE-OE1 3.13Å; R277-E318 IonicContact NE-OE2 2.69Å; R277-E318 PolarHBondContact NE-OE2 3.49Å; R277-E318 IonicContact NH2-OE1 2.99Å; R277-E318 PolarHBondContact NH2-OE1 3.27Å; R277-E318 IonicContact NH2-OE2 3.41Å; R277-E318 PolarHBondContact NH2-OE2 2.94Å
278	V	96.4	Very high	81.7	Confident	6 Å²	6	46.1 Å²	46.1	4%	0.036	29%	0.287	C	S	.	.			trans	-101.9	87.3	175.2	-178.5	0	0	0	0	109.4	S232 S233 L248 V253 A280 V281 A291	S232-V278 CarbonylContact C-O 3.6Å; S232-V278 VanDerWaalsContact CB-O 3.24Å; S232-V278 WeakPolarHBondContact CB-O 3.45Å; S232-V278 VanDerWaalsContact OG-C 3.23Å; S232-V278 PolarHBondContact OG-N 3.15Å; S232-V278 PolarHBondContact OG-O 3.45Å; S233-V278 WeakPolarHBondContact CB-O 3.44Å; S233-V278 PolarHBondContact OG-O 3.04Å; S233-V278 VanDerWaalsContact OG-O 3.06Å; L248-V278 PolarHBondContact O-N 3.23Å; V253-V278 HydrophobicContact CG2-CG1 4.07Å; V253-V278 HydrophobicContact CG2-CG2 4.12Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 3.43Å; V278-V281 HydrophobicContact CG1-CG1 3.7Å; V278-A291 VanDerWaalsContact CA-O 3.31Å; V278-A291 WeakPolarHBondContact CA-O 3.48Å; V278-A291 WeakPolarHBondContact CG1-O 3.41Å
279	P	97.2	Very high	82.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	26%	0.255	C	S	.	.			trans	-72.9	-20	-175.3	31.1	-42	0	0	0	114.6	Y188 N190 S233 R277 A291 E318 V319	Y188-P279 WeakPolarHBondContact O-CB 3.19Å; N190-P279 PolarHBondContact N-O 2.85Å; N190-P279 PolarHBondContact ND2-O 2.89Å; S233-P279 WeakPolarHBondContact CB-O 3.33Å; R277-P279 WeakPolarHBondContact O-CD 3.37Å; P279-A291 HydrophobicContact CG-CB 4.26Å; P279-E318 HydrophobicContact CB-CG 4.23Å; P279-E318 WeakPolarHBondContact CB-OE1 3.45Å; P279-E318 HydrophobicContact CG-CG 3.86Å; P279-E318 WeakPolarHBondContact CG-OE1 3.4Å; P279-V319 WeakPolarHBondContact CG-O 3.27Å
280	A	98	Very high	83.5	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.025	25%	0.247	C	C	.	.			trans	-146.2	143.4	179	0	0	0	0	0	110.8	V278 A291 L322	V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 3.43Å; A280-A291 HydrophobicContact CB-CB 3.96Å; A280-A291 WeakPolarHBondContact O-CB 3.31Å; A280-A291 PolarHBondContact O-N 2.88Å; A280-L322 HydrophobicContact CB-CB 3.77Å
281	V	98	Very high	85.4	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.5	170	-72.2	0	0	0	0	107.5	S233 E235 A245 V253 V278 S289	S233-V281 WeakPolarHBondContact OG-CG1 3.34Å; E235-V281 HydrophobicContact CB-CG2 3.85Å; A245-V281 HydrophobicContact CB-CG2 4.19Å; V253-V281 HydrophobicContact CG1-CG1 4.25Å; V253-V281 HydrophobicContact CG2-CG1 4.44Å; V278-V281 HydrophobicContact CG1-CG1 3.7Å; V281-S289 CarbonylContact C-O 3.56Å; V281-S289 VanDerWaalsContact CA-O 3.28Å; V281-S289 WeakPolarHBondContact CA-O 3.45Å
282	T	98.3	Very high	87.4	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	150.2	172.2	-169.6	0	0	0	0	113.9	E235 S289 L322 W324 L331	E235-T282 WeakPolarHBondContact OE1-CA 3.21Å; E235-T282 PolarHBondContact OE1-OG1 2.86Å; E235-T282 WeakPolarHBondContact OE2-CA 3.35Å; E235-T282 WeakPolarHBondContact OE2-CB 3.42Å; E235-T282 PolarHBondContact OE2-OG1 2.79Å; T282-S289 PolarHBondContact N-O 3.31Å; T282-S289 PolarHBondContact O-N 2.85Å; T282-L322 HydrophobicContact CG2-CB 4.41Å; T282-L322 HydrophobicContact CG2-CD2 3.75Å; T282-L322 HydrophobicContact CG2-CG 3.64Å; T282-W324 VanDerWaalsContact CG2-CD1 3.46Å; T282-W324 HydrophobicContact CG2-CG 4.49Å; T282-L331 HydrophobicContact CG2-CD1 3.92Å
283	W	97.8	Very high	89.7	Confident	7 Å²	7	30 Å²	30	3%	0.027	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.5	-174.2	-67.9	93.6	0	0	0	114.8	E235 W236 P238 I243 A245 L255 V288 T302 W324 K328	E235-W283 PolarHBondContact O-NE1 3.37Å; E235-W283 PolarHBondContact OE1-N 3.39Å; W236-W283 VanDerWaalsContact O-CD1 3.29Å; P238-W283 VanDerWaalsContact CD-CB 3.47Å; P238-W283 HydrophobicContact CG-CB 4.06Å; I243-W283 HydrophobicContact CG2-CH2 4.04Å; I243-W283 HydrophobicContact CG2-CZ2 4.18Å; A245-W283 HydrophobicContact CB-CZ2 3.54Å; L255-W283 HydrophobicContact CD1-CH2 4.36Å; L255-W283 HydrophobicContact CD2-CH2 3.7Å; L255-W283 HydrophobicContact CD2-CZ2 3.79Å; W283-V288 HydrophobicContact CD2-CG2 3.74Å; W283-V288 HydrophobicContact CE3-CG2 3.39Å; W283-V288 HydrophobicContact CH2-CG2 3.38Å; W283-V288 HydrophobicContact CZ2-CG2 3.73Å; W283-V288 HydrophobicContact CZ3-CG2 3.2Å; W283-T302 HydrophobicContact CH2-CG2 4.38Å; W283-T302 HydrophobicContact CZ3-CG2 4.09Å; W283-W324 VanDerWaalsContact C-CD1 3.49Å; W283-W324 VanDerWaalsContact O-CD1 3.26Å; W283-K328 PolarHBondContact O-NZ 3.28Å
284	R	96.5	Very high	92	Very high	27 Å²	27	25.5 Å²	25.5	10%	0.102	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	96.2	162.7	175	-176.7	-178.6	-62.4	-7.8	108.4	Y286 L287 W324 K328 F345	R284-Y286 PolarHBondContact O-N 3.15Å; R284-L287 HydrophobicContact CB-CB 4.41Å; R284-L287 PolarHBondContact N-O 2.81Å; R284-L287 WeakPolarHBondContact O-CA 3.27Å; R284-L287 VanDerWaalsContact O-CB 3.27Å; R284-L287 WeakPolarHBondContact O-CB 3.32Å; R284-L287 PolarHBondContact O-N 2.61Å; R284-W324 HydrophobicContact CB-CD2 3.75Å; R284-W324 HydrophobicContact CB-CE3 4.44Å; R284-W324 HydrophobicContact CB-CG 3.84Å; R284-W324 HydrophobicContact CB-CZ2 4.23Å; R284-W324 HydrophobicContact CG-CD2 4.27Å; R284-W324 HydrophobicContact CG-CE3 4.49Å; R284-K328 HydrophobicContact CB-CD 4.27Å; R284-K328 HydrophobicContact CG-CB 4.02Å; R284-K328 HydrophobicContact CG-CD 4.03Å; R284-K328 HydrophobicContact CG-CG 4.21Å; R284-K328 PolarHBondContact NE-O 3.04Å; R284-F345 VanDerWaalsContact CZ-CE1 3.47Å; R284-F345 VanDerWaalsContact CZ-CE2 3.47Å; R284-F345 VanDerWaalsContact NE-CD2 3.35Å; R284-F345 VanDerWaalsContact NH1-CZ 3.32Å; R284-F345 VanDerWaalsContact NH2-CE1 3.27Å
285	E	94.4	Very high	94	Very high	90 Å²	90	21.3 Å²	21.3	42%	0.421	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	-122.8	-176.7	-56.5	169.4	-176.8	0	0	110.2	D239 L287	D239-E285 WeakPolarHBondContact OD2-CA 3.38Å; D239-E285 PolarHBondContact OD2-N 2.79Å; E285-L287 VanDerWaalsContact C-N 3.29Å; E285-L287 PolarHBondContact O-N 3.41Å
286	Y	94.6	Very high	95.5	Very high	76 Å²	76	23.3 Å²	23.3	30%	0.298	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.4	176.4	58.3	-92.4	0	0	0	114.1	R284 D301 T302 R303	R284-Y286 PolarHBondContact O-N 3.15Å; Y286-D301 HydrophobicContact CD2-CB 4.42Å; Y286-D301 WeakPolarHBondContact CE2-OD2 3.39Å; Y286-T302 WeakPolarHBondContact O-CB 3.16Å; Y286-T302 VanDerWaalsContact O-CG2 3.3Å; Y286-T302 WeakPolarHBondContact O-CG2 3.24Å; Y286-T302 PolarHBondContact O-N 3.32Å; Y286-T302 VanDerWaalsContact O-N 3.12Å; Y286-T302 PolarHBondContact O-OG1 2.79Å; Y286-R303 VanDerWaalsContact CD2-CZ 3.43Å; Y286-R303 VanDerWaalsContact CZ-NH2 3.31Å
287	L	96.9	Very high	96.2	Very high	9 Å²	9	22 Å²	22	5%	0.047	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.3	-178.2	-168.6	78.8	0	0	0	110.3	R284 E285 H299 H300 V309 W324 F345	R284-L287 HydrophobicContact CB-CB 4.41Å; R284-L287 PolarHBondContact N-O 2.81Å; R284-L287 WeakPolarHBondContact O-CA 3.27Å; R284-L287 VanDerWaalsContact O-CB 3.27Å; R284-L287 WeakPolarHBondContact O-CB 3.32Å; R284-L287 PolarHBondContact O-N 2.61Å; E285-L287 VanDerWaalsContact C-N 3.29Å; E285-L287 PolarHBondContact O-N 3.41Å; L287-H299 HydrophobicContact CD1-CB 4.08Å; L287-H299 HydrophobicContact CD2-CB 4.27Å; L287-H299 HydrophobicContact CG-CB 4.39Å; L287-H300 WeakPolarHBondContact CA-O 3.49Å; L287-V309 HydrophobicContact CD1-CG2 3.69Å; L287-W324 HydrophobicContact CD2-CZ2 4.03Å; L287-F345 HydrophobicContact CD2-CE2 4.24Å
288	V	97.5	Very high	96.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.7	169.3	176.8	0	0	0	0	108.3	A245 V253 L255 M267 W283 H300 T302	A245-V288 HydrophobicContact CB-CG1 4.49Å; V253-V288 HydrophobicContact CG1-CG1 4.35Å; L255-V288 HydrophobicContact CD2-CG2 4.34Å; M267-V288 HydrophobicContact CE-CB 4.37Å; M267-V288 HydrophobicContact CE-CG1 4.38Å; W283-V288 HydrophobicContact CD2-CG2 3.74Å; W283-V288 HydrophobicContact CE3-CG2 3.39Å; W283-V288 HydrophobicContact CH2-CG2 3.38Å; W283-V288 HydrophobicContact CZ2-CG2 3.73Å; W283-V288 HydrophobicContact CZ3-CG2 3.2Å; V288-H300 HydrophobicContact CB-CB 4.28Å; V288-H300 PolarHBondContact N-O 3.5Å; V288-H300 WeakPolarHBondContact O-CB 3.21Å; V288-H300 PolarHBondContact O-CD2 2.91Å; V288-H300 VanDerWaalsContact O-CD2 3.29Å; V288-H300 PolarHBondContact O-N 2.81Å; V288-T302 HydrophobicContact CB-CG2 4.43Å; V288-T302 HydrophobicContact CG2-CG2 3.63Å
289	S	97.8	Very high	96.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.9	169.5	-58.8	0	0	0	0	109.1	V281 T282 R298 H299 W324	V281-S289 CarbonylContact C-O 3.56Å; V281-S289 VanDerWaalsContact CA-O 3.28Å; V281-S289 WeakPolarHBondContact CA-O 3.45Å; T282-S289 PolarHBondContact N-O 3.31Å; T282-S289 PolarHBondContact O-N 2.85Å; S289-R298 CarbonylContact C-O 3.53Å; S289-R298 VanDerWaalsContact CA-O 3.24Å; S289-R298 WeakPolarHBondContact CA-O 3.41Å; S289-H299 PolarHBondContact OG-ND1 3.41Å; S289-W324 PolarHBondContact OG-NE1 3.15Å
290	S	97.3	Very high	96.2	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.042	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.7	179.8	73.2	0	0	0	0	110.7	I297 R298 H300	S290-I297 CarbonylContact O-C 3.58Å; S290-I297 VanDerWaalsContact O-CA 3.32Å; S290-I297 WeakPolarHBondContact O-CA 3.34Å; S290-R298 PolarHBondContact N-O 3.43Å; S290-R298 PolarHBondContact O-N 3.39Å; S290-H300 PolarHBondContact OG-NE2 2.88Å
291	A	96.5	Very high	96.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	159.9	174.1	0	0	0	0	0	110.8	V278 P279 A280 V319 L322	V278-A291 VanDerWaalsContact CA-O 3.31Å; V278-A291 WeakPolarHBondContact CA-O 3.48Å; V278-A291 WeakPolarHBondContact CG1-O 3.41Å; P279-A291 HydrophobicContact CG-CB 4.26Å; A280-A291 HydrophobicContact CB-CB 3.96Å; A280-A291 WeakPolarHBondContact O-CB 3.31Å; A280-A291 PolarHBondContact O-N 2.88Å; A291-V319 HydrophobicContact CB-CB 3.74Å; A291-V319 HydrophobicContact CB-CG1 3.69Å; A291-V319 VanDerWaalsContact CB-O 3.23Å; A291-V319 WeakPolarHBondContact CB-O 3.37Å; A291-L322 HydrophobicContact CB-CD2 4.09Å
292	S	95.1	Very high	96	Very high	4 Å²	4	24.2 Å²	24.2	3%	0.028	12%	0.115	C	C	.	.			trans	-132.4	152.6	177.4	162.5	0	0	0	0	111.2	A275 R277 S294 G295 H296 V319	A275-S292 PolarHBondContact O-OG 2.85Å; R277-S292 WeakPolarHBondContact O-CA 3.07Å; S292-S294 PolarHBondContact O-N 3.33Å; S292-S294 WeakPolarHBondContact OG-CB 3.46Å; S292-S294 PolarHBondContact OG-N 2.82Å; S292-S294 PolarHBondContact OG-OG 2.86Å; S292-G295 PolarHBondContact O-N 3.24Å; S292-H296 WeakPolarHBondContact CB-O 3.43Å; S292-H296 PolarHBondContact N-O 3.34Å; S292-V319 PolarHBondContact O-N 3.41Å
293	K	94.6	Very high	95.9	Very high	111 Å²	111	31.6 Å²	31.6	48%	0.483	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.4	166.7	-174.4	169.2	-175.4	174	0	113.9	R277 G295 E318	R277-K293 HydrophobicContact CG-CB 3.87Å; R277-K293 HydrophobicContact CG-CD 4.12Å; R277-K293 PolarHBondContact O-N 2.91Å; K293-G295 VanDerWaalsContact C-N 3.27Å; K293-G295 PolarHBondContact O-N 2.73Å; K293-E318 HydrophobicContact CB-CG 4.37Å; K293-E318 HydrophobicContact CG-CB 4.22Å; K293-E318 HydrophobicContact CG-CG 4.41Å; K293-E318 WeakPolarHBondContact O-CA 3.29Å; K293-E318 PolarHBondContact O-N 2.7Å
294	S	92.9	Very high	95.8	Very high	43 Å²	43	34.7 Å²	34.7	30%	0.301	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.8	177.1	62.1	0	0	0	0	114.6	S292 H296	S292-S294 PolarHBondContact O-N 3.33Å; S292-S294 WeakPolarHBondContact OG-CB 3.46Å; S292-S294 PolarHBondContact OG-N 2.82Å; S292-S294 PolarHBondContact OG-OG 2.86Å; S294-H296 PolarHBondContact OG-CD2 3.22Å
295	G	94.6	Very high	95.7	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.01	19%	0.187	C	C	.	.	S	Bend	trans	99.2	-15.9	-177.4	0	0	0	0	0	114.9	S292 K293 H315 Q317 V319	S292-G295 PolarHBondContact O-N 3.24Å; K293-G295 VanDerWaalsContact C-N 3.27Å; K293-G295 PolarHBondContact O-N 2.73Å; G295-H315 WeakPolarHBondContact CA-O 3.39Å; G295-Q317 WeakPolarHBondContact CA-O 3.48Å; G295-V319 WeakPolarHBondContact O-CG2 3.49Å
296	H	94.8	Very high	95.6	Very high	49 Å²	49	41.1 Å²	41.1	23%	0.227	20%	0.204	C	C	.	.			trans	-71.5	141.1	177	-57.7	-54.4	0	0	0	112.4	S292 S294 V311 D313	S292-H296 WeakPolarHBondContact CB-O 3.43Å; S292-H296 PolarHBondContact N-O 3.34Å; S294-H296 PolarHBondContact OG-CD2 3.22Å; H296-V311 HydrophobicContact CB-CG1 4.23Å; H296-D313 IonicContact CE1-OD1 2.79Å; H296-D313 PolarHBondContact CE1-OD1 2.93Å; H296-D313 IonicContact CE1-OD2 3.68Å; H296-D313 PolarHBondContact CE1-OD2 2.9Å; H296-D313 IonicContact ND1-OD1 3.2Å; H296-D313 PolarHBondContact ND1-OD1 3.46Å; H296-D313 IonicContact ND1-OD2 2.99Å
297	I	96.5	Very high	95.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.3	167.7	-54.2	163	0	0	0	107.9	S290 V311 S312 V319 L322 L331 S333 W343	S290-I297 CarbonylContact O-C 3.58Å; S290-I297 VanDerWaalsContact O-CA 3.32Å; S290-I297 WeakPolarHBondContact O-CA 3.34Å; I297-V311 CarbonylContact O-C 3.55Å; I297-V311 WeakPolarHBondContact O-CA 3.35Å; I297-S312 PolarHBondContact N-O 2.86Å; I297-S312 PolarHBondContact O-N 3.49Å; I297-V319 HydrophobicContact CD1-CG1 4.25Å; I297-V319 HydrophobicContact CG1-CG1 4.2Å; I297-V319 HydrophobicContact CG1-CG2 4.31Å; I297-L322 HydrophobicContact CD1-CD1 3.85Å; I297-L322 HydrophobicContact CG1-CD1 4.28Å; I297-L322 HydrophobicContact CG2-CD1 4.08Å; I297-L322 HydrophobicContact CG2-CD2 4.25Å; I297-L331 HydrophobicContact CG2-CD2 4.31Å; I297-S333 VanDerWaalsContact CD1-CB 3.49Å; I297-W343 HydrophobicContact CD1-CZ2 4.28Å
298	R	95.4	Very high	95.5	Very high	27 Å²	27	42.1 Å²	42.1	10%	0.102	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.6	-176.4	-62.8	-175.3	170.1	78.3	0.9	110.8	L269 S289 S290 H300 V311	L269-R298 VanDerWaalsContact CD1-NE 3.33Å; S289-R298 CarbonylContact C-O 3.53Å; S289-R298 VanDerWaalsContact CA-O 3.24Å; S289-R298 WeakPolarHBondContact CA-O 3.41Å; S290-R298 PolarHBondContact N-O 3.43Å; S290-R298 PolarHBondContact O-N 3.39Å; R298-H300 PolarHBondContact O-CD2 3.27Å; R298-V311 HydrophobicContact CG-CG1 4.32Å; R298-V311 HydrophobicContact CG-CG2 4.17Å
299	H	96.6	Very high	95.4	Very high	3 Å²	3	46 Å²	46	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124	-178.3	-51.3	-63.8	0	0	0	109.5	L287 S289 E308 V309 G310 S312	L287-H299 HydrophobicContact CD1-CB 4.08Å; L287-H299 HydrophobicContact CD2-CB 4.27Å; L287-H299 HydrophobicContact CG-CB 4.39Å; S289-H299 PolarHBondContact OG-ND1 3.41Å; H299-E308 WeakPolarHBondContact O-CA 3.31Å; H299-V309 HydrophobicContact CB-CG2 3.97Å; H299-V309 WeakPolarHBondContact O-CG2 3.29Å; H299-V309 PolarHBondContact O-N 3.25Å; H299-G310 PolarHBondContact N-O 2.91Å; H299-S312 PolarHBondContact NE2-OG 3.13Å
300	H	96.5	Very high	95.2	Very high	5 Å²	5	47.3 Å²	47.3	2%	0.023	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	110.2	-172.4	-52.7	-87.2	0	0	0	110.3	M267 L287 V288 S290 R298 T302 H307	M267-H300 HydrophobicContact CE-CB 4.08Å; M267-H300 HydrophobicContact SD-CB 3.51Å; M267-H300 VanDerWaalsContact SD-CB 3.51Å; L287-H300 WeakPolarHBondContact CA-O 3.49Å; V288-H300 HydrophobicContact CB-CB 4.28Å; V288-H300 PolarHBondContact N-O 3.5Å; V288-H300 WeakPolarHBondContact O-CB 3.21Å; V288-H300 PolarHBondContact O-CD2 2.91Å; V288-H300 VanDerWaalsContact O-CD2 3.29Å; V288-H300 PolarHBondContact O-N 2.81Å; S290-H300 PolarHBondContact OG-NE2 2.88Å; R298-H300 PolarHBondContact O-CD2 3.27Å; H300-T302 PolarHBondContact O-N 2.85Å; H300-H307 CarbonylContact C-O 3.51Å; H300-H307 WeakPolarHBondContact CA-O 3.27Å; H300-H307 HydrophobicContact CB-CB 4.36Å; H300-H307 AromaticContact CE1-ND1 3.98Å; H300-H307 AromaticContact ND1-CE1 3.73Å; H300-H307 AromaticContact ND1-CG 3.98Å; H300-H307 AromaticContact ND1-ND1 3.14Å; H300-H307 PolarHBondContact ND1-ND1 3.18Å; H300-H307 VanDerWaalsContact ND1-ND1 3.14Å
301	D	96.5	Very high	95	Very high	14 Å²	14	49.7 Å²	49.7	8%	0.075	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	112.7	166.2	-174.8	-26.7	0	0	0	108.6	R265 Y286 R303 I304 H307 V309	R265-D301 PolarHBondContact NH1-O 2.77Å; Y286-D301 HydrophobicContact CD2-CB 4.42Å; Y286-D301 WeakPolarHBondContact CE2-OD2 3.39Å; D301-R303 PolarHBondContact O-N 3.25Å; D301-R303 VanDerWaalsContact OD1-CB 3.31Å; D301-R303 WeakPolarHBondContact OD1-CB 3.44Å; D301-R303 WeakPolarHBondContact OD1-CG 3.4Å; D301-R303 IonicContact OD1-CZ 3.87Å; D301-R303 PolarHBondContact OD1-N 3.37Å; D301-R303 IonicContact OD1-NE 3.04Å; D301-R303 PolarHBondContact OD1-NE 2.66Å; D301-R303 IonicContact OD1-NH2 3.81Å; D301-R303 IonicContact OD2-CZ 3.58Å; D301-R303 IonicContact OD2-NE 3.5Å; D301-R303 PolarHBondContact OD2-NE 2.87Å; D301-R303 IonicContact OD2-NH2 2.8Å; D301-R303 PolarHBondContact OD2-NH2 3.17Å; D301-I304 HydrophobicContact CB-CD1 3.92Å; D301-I304 HydrophobicContact CB-CG1 3.87Å; D301-H307 PolarHBondContact N-O 2.6Å; D301-H307 WeakPolarHBondContact O-CA 3.37Å; D301-V309 HydrophobicContact CB-CG1 3.75Å
302	T	95.4	Very high	95	Very high	33 Å²	33	49.7 Å²	49.7	20%	0.202	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.3	-174	57.6	0	0	0	0	113.7	L255 R265 W283 Y286 V288 H300	L255-T302 HydrophobicContact CD1-CG2 3.62Å; R265-T302 PolarHBondContact NH1-O 3.12Å; W283-T302 HydrophobicContact CH2-CG2 4.38Å; W283-T302 HydrophobicContact CZ3-CG2 4.09Å; Y286-T302 WeakPolarHBondContact O-CB 3.16Å; Y286-T302 VanDerWaalsContact O-CG2 3.3Å; Y286-T302 WeakPolarHBondContact O-CG2 3.24Å; Y286-T302 PolarHBondContact O-N 3.32Å; Y286-T302 VanDerWaalsContact O-N 3.12Å; Y286-T302 PolarHBondContact O-OG1 2.79Å; V288-T302 HydrophobicContact CB-CG2 4.43Å; V288-T302 HydrophobicContact CG2-CG2 3.63Å; H300-T302 PolarHBondContact O-N 2.85Å
303	R	95.3	Very high	94.9	Very high	158 Å²	158	54.4 Å²	54.4	60%	0.596	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-24.8	-173.2	-53.2	169.4	-61.2	173.8	6.1	113.6	Y286 D301	Y286-R303 VanDerWaalsContact CD2-CZ 3.43Å; Y286-R303 VanDerWaalsContact CZ-NH2 3.31Å; D301-R303 PolarHBondContact O-N 3.25Å; D301-R303 VanDerWaalsContact OD1-CB 3.31Å; D301-R303 WeakPolarHBondContact OD1-CB 3.44Å; D301-R303 WeakPolarHBondContact OD1-CG 3.4Å; D301-R303 IonicContact OD1-CZ 3.87Å; D301-R303 PolarHBondContact OD1-N 3.37Å; D301-R303 IonicContact OD1-NE 3.04Å; D301-R303 PolarHBondContact OD1-NE 2.66Å; D301-R303 IonicContact OD1-NH2 3.81Å; D301-R303 IonicContact OD2-CZ 3.58Å; D301-R303 IonicContact OD2-NE 3.5Å; D301-R303 PolarHBondContact OD2-NE 2.87Å; D301-R303 IonicContact OD2-NH2 2.8Å; D301-R303 PolarHBondContact OD2-NH2 3.17Å
304	I	95.9	Very high	95.1	Very high	72 Å²	72	52.4 Å²	52.4	37%	0.369	28%	0.279	S	S	.	.	S	Bend	trans	-101.2	153.3	-174.7	63.2	175.9	0	0	0	111.5	R265 D301 H306 V309	R265-I304 PolarHBondContact NH1-O 3.14Å; R265-I304 PolarHBondContact NH2-O 3.24Å; D301-I304 HydrophobicContact CB-CD1 3.92Å; D301-I304 HydrophobicContact CB-CG1 3.87Å; I304-H306 WeakPolarHBondContact CD1-O 3.22Å; I304-H306 WeakPolarHBondContact CG1-O 3.2Å; I304-V309 HydrophobicContact CD1-CG1 3.75Å
305	A	93.9	Very high	95.3	Very high	84 Å²	84	50.5 Å²	50.5	69%	0.694	27%	0.266	S	S	*	.	S	Bend	trans	-61.8	-49.5	-179.1	0	0	0	0	0	112.6	H307	A305-H307 PolarHBondContact O-N 2.95Å; A305-H307 VanDerWaalsContact O-N 3.13Å
306	H	93.6	Very high	95.4	Very high	169 Å²	169	55.7 Å²	55.7	78%	0.782	30%	0.297	S	S	*	.	S	Bend	trans	-83.7	82.1	172.5	-64.9	-68.3	0	0	0	109.3	I304 E308	I304-H306 WeakPolarHBondContact CD1-O 3.22Å; I304-H306 WeakPolarHBondContact CG1-O 3.2Å; H306-E308 VanDerWaalsContact C-N 3.26Å; H306-E308 PolarHBondContact O-N 2.86Å
307	H	95	Very high	95.5	Very high	24 Å²	24	57.2 Å²	57.2	11%	0.111	30%	0.304	C	S	.	.			trans	-59.3	-33.2	-170.9	55.1	64.5	0	0	0	113.8	M267 R268 H300 D301 A305 V309	M267-H307 WeakPolarHBondContact CA-NE2 3.37Å; M267-H307 HydrophobicContact CG-CB 4.27Å; M267-H307 HydrophobicContact SD-CB 4.06Å; R268-H307 PolarHBondContact N-NE2 3.48Å; R268-H307 PolarHBondContact O-NE2 3.01Å; H300-H307 CarbonylContact C-O 3.51Å; H300-H307 WeakPolarHBondContact CA-O 3.27Å; H300-H307 HydrophobicContact CB-CB 4.36Å; H300-H307 AromaticContact CE1-ND1 3.98Å; H300-H307 AromaticContact ND1-CE1 3.73Å; H300-H307 AromaticContact ND1-CG 3.98Å; H300-H307 AromaticContact ND1-ND1 3.14Å; H300-H307 PolarHBondContact ND1-ND1 3.18Å; H300-H307 VanDerWaalsContact ND1-ND1 3.14Å; D301-H307 PolarHBondContact N-O 2.6Å; D301-H307 WeakPolarHBondContact O-CA 3.37Å; A305-H307 PolarHBondContact O-N 2.95Å; A305-H307 VanDerWaalsContact O-N 3.13Å; H307-V309 PolarHBondContact O-N 3.32Å
308	E	94	Very high	95.5	Very high	82 Å²	82	57.8 Å²	57.8	38%	0.383	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	113	-174.7	-173.1	177.5	142	0	0	110.8	L269 H299 H306 V311	L269-E308 WeakPolarHBondContact CD2-OE2 3.39Å; H299-E308 WeakPolarHBondContact O-CA 3.31Å; H306-E308 VanDerWaalsContact C-N 3.26Å; H306-E308 PolarHBondContact O-N 2.86Å; E308-V311 HydrophobicContact CG-CG2 4.47Å; E308-V311 WeakPolarHBondContact OE1-CG2 3.45Å
309	V	94.6	Very high	95.6	Very high	81 Å²	81	56.5 Å²	56.5	49%	0.491	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-9.4	-179.2	-64.9	0	0	0	0	113.1	L287 H299 D301 I304 H307	L287-V309 HydrophobicContact CD1-CG2 3.69Å; H299-V309 HydrophobicContact CB-CG2 3.97Å; H299-V309 WeakPolarHBondContact O-CG2 3.29Å; H299-V309 PolarHBondContact O-N 3.25Å; D301-V309 HydrophobicContact CB-CG1 3.75Å; I304-V309 HydrophobicContact CD1-CG1 3.75Å; H307-V309 PolarHBondContact O-N 3.32Å
310	G	93.5	Very high	95.7	Very high	28 Å²	28	56.3 Å²	56.3	29%	0.289	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	177.3	163.5	177.4	0	0	0	0	0	113.1	H299	H299-G310 PolarHBondContact N-O 2.91Å
311	V	94.2	Very high	95.8	Very high	55 Å²	55	56.2 Å²	56.2	33%	0.333	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.2	177.5	-175.4	0	0	0	0	108.7	H296 I297 R298 E308	H296-V311 HydrophobicContact CB-CG1 4.23Å; I297-V311 CarbonylContact O-C 3.55Å; I297-V311 WeakPolarHBondContact O-CA 3.35Å; R298-V311 HydrophobicContact CG-CG1 4.32Å; R298-V311 HydrophobicContact CG-CG2 4.17Å; E308-V311 HydrophobicContact CG-CG2 4.47Å; E308-V311 WeakPolarHBondContact OE1-CG2 3.45Å
312	S	95.9	Very high	95.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	119.2	165.9	-48.8	0	0	0	0	108.3	I297 H299 L348	I297-S312 PolarHBondContact N-O 2.86Å; I297-S312 PolarHBondContact O-N 3.49Å; H299-S312 PolarHBondContact NE2-OG 3.13Å; S312-L348 WeakPolarHBondContact CB-O 3.41Å; S312-L348 PolarHBondContact OG-O 3.34Å
313	D	94.3	Very high	96	Very high	104 Å²	104	56.1 Å²	56.1	56%	0.556	30%	0.302	S	S	*	.			trans	-125	92.8	-174.8	-170.5	17.1	0	0	0	110.7	H296	H296-D313 IonicContact CE1-OD1 2.79Å; H296-D313 PolarHBondContact CE1-OD1 2.93Å; H296-D313 IonicContact CE1-OD2 3.68Å; H296-D313 PolarHBondContact CE1-OD2 2.9Å; H296-D313 IonicContact ND1-OD1 3.2Å; H296-D313 PolarHBondContact ND1-OD1 3.46Å; H296-D313 IonicContact ND1-OD2 2.99Å
314	F	97	Very high	96.1	Very high	68 Å²	68	49 Å²	49	30%	0.298	28%	0.275	S	S	.	.			trans	-143.6	-47.4	-178.6	179.9	-92.5	0	0	0	112.4	F339 C341 W343 P351 V354	F314-F339 AromaticContact CE1-CD2 3.92Å; F314-F339 HydrophobicContact CE1-CD2 3.92Å; F314-F339 HydrophobicContact CZ-CD2 4.5Å; F314-C341 WeakPolarHBondContact CD1-SG 3.42Å; F314-C341 WeakPolarHBondContact CE1-SG 3.49Å; F314-W343 HydrophobicContact CB-CH2 3.52Å; F314-W343 HydrophobicContact CB-CZ2 4.12Å; F314-W343 HydrophobicContact CG-CH2 4.4Å; F314-P351 HydrophobicContact CD2-CG 4Å; F314-P351 HydrophobicContact CE2-CG 4.28Å; F314-P351 HydrophobicContact CG-CG 4.18Å; F314-V354 HydrophobicContact CE1-CG1 3.76Å; F314-V354 HydrophobicContact CE1-CG2 3.98Å; F314-V354 HydrophobicContact CE2-CG2 4.04Å; F314-V354 HydrophobicContact CZ-CB 4.26Å; F314-V354 HydrophobicContact CZ-CG1 3.62Å; F314-V354 HydrophobicContact CZ-CG2 3.57Å
315	H	97.1	Very high	96.2	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.019	26%	0.258	C	S	.	.			trans	-64.4	142.6	178.1	-73.3	-70.6	0	0	0	110.1	G295 V319 S333 A335 D337 F339	G295-H315 WeakPolarHBondContact CA-O 3.39Å; H315-V319 HydrophobicContact CB-CG2 3.67Å; H315-S333 PolarHBondContact CD2-OG 3.29Å; H315-S333 PolarHBondContact NE2-OG 2.78Å; H315-A335 HydrophobicContact CB-CB 4.18Å; H315-A335 VanDerWaalsContact ND1-CB 3.3Å; H315-A335 WeakPolarHBondContact ND1-CB 3.21Å; H315-D337 VanDerWaalsContact CA-OD2 3.24Å; H315-D337 WeakPolarHBondContact CA-OD2 3.49Å; H315-D337 WeakPolarHBondContact CB-OD2 3.36Å; H315-D337 IonicContact CE1-OD1 3.8Å; H315-D337 IonicContact CG-OD2 3.04Å; H315-D337 IonicContact ND1-OD1 3.52Å; H315-D337 PolarHBondContact ND1-OD1 2.72Å; H315-D337 IonicContact ND1-OD2 2.62Å; H315-D337 PolarHBondContact ND1-OD2 3.11Å; H315-F339 PolarHBondContact CE1-O 3.06Å
316	T	96.5	Very high	96.3	Very high	110 Å²	110	44.8 Å²	44.8	68%	0.675	25%	0.245	S	C	*	.	S	Bend	trans	-104.7	-4.6	-177.3	56.5	0	0	0	0	112.7	D337	T316-D337 PolarHBondContact N-OD2 3.27Å
317	Q	96.8	Very high	96.3	Very high	80 Å²	80	39.4 Å²	39.4	37%	0.374	22%	0.222	S	C	.	.	S	Bend	trans	-139.9	176.8	-179.8	-58.1	-172.7	43.8	0	0	110.2	G295 V319 N336 D337	G295-Q317 WeakPolarHBondContact CA-O 3.48Å; Q317-V319 PolarHBondContact O-N 3.35Å; Q317-N336 HydrophobicContact CB-CB 3.99Å; Q317-N336 PolarHBondContact OE1-ND2 3.24Å; Q317-N336 PolarHBondContact OE1-O 2.8Å; Q317-D337 HydrophobicContact CB-CB 4.14Å; Q317-D337 HydrophobicContact CG-CB 4.08Å
318	E	97.3	Very high	96.3	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.056	23%	0.228	C	C	.	.			trans	-52.3	121.6	-174.5	-177	149.7	-143.1	0	0	113.8	R277 P279 K293 C320 A335 N336	R277-E318 WeakPolarHBondContact CG-OE1 3.43Å; R277-E318 IonicContact CZ-OE1 3.59Å; R277-E318 IonicContact CZ-OE2 3.43Å; R277-E318 IonicContact NE-OE1 3.69Å; R277-E318 PolarHBondContact NE-OE1 3.13Å; R277-E318 IonicContact NE-OE2 2.69Å; R277-E318 PolarHBondContact NE-OE2 3.49Å; R277-E318 IonicContact NH2-OE1 2.99Å; R277-E318 PolarHBondContact NH2-OE1 3.27Å; R277-E318 IonicContact NH2-OE2 3.41Å; R277-E318 PolarHBondContact NH2-OE2 2.94Å; P279-E318 HydrophobicContact CB-CG 4.23Å; P279-E318 WeakPolarHBondContact CB-OE1 3.45Å; P279-E318 HydrophobicContact CG-CG 3.86Å; P279-E318 WeakPolarHBondContact CG-OE1 3.4Å; K293-E318 HydrophobicContact CB-CG 4.37Å; K293-E318 HydrophobicContact CG-CB 4.22Å; K293-E318 HydrophobicContact CG-CG 4.41Å; K293-E318 WeakPolarHBondContact O-CA 3.29Å; K293-E318 PolarHBondContact O-N 2.7Å; E318-C320 PolarHBondContact O-N 2.73Å; E318-A335 CarbonylContact O-C 3.59Å; E318-A335 WeakPolarHBondContact O-CA 3.42Å; E318-A335 VanDerWaalsContact O-CB 3.31Å; E318-A335 WeakPolarHBondContact O-CB 3.48Å; E318-N336 HydrophobicContact CB-CB 4.43Å; E318-N336 PolarHBondContact O-N 2.88Å
319	V	98.2	Very high	96.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	99.5	175.8	176.6	0	0	0	0	108.9	P279 A291 S292 G295 I297 H315 Q317 L322 A335	P279-V319 WeakPolarHBondContact CG-O 3.27Å; A291-V319 HydrophobicContact CB-CB 3.74Å; A291-V319 HydrophobicContact CB-CG1 3.69Å; A291-V319 VanDerWaalsContact CB-O 3.23Å; A291-V319 WeakPolarHBondContact CB-O 3.37Å; S292-V319 PolarHBondContact O-N 3.41Å; G295-V319 WeakPolarHBondContact O-CG2 3.49Å; I297-V319 HydrophobicContact CD1-CG1 4.25Å; I297-V319 HydrophobicContact CG1-CG1 4.2Å; I297-V319 HydrophobicContact CG1-CG2 4.31Å; H315-V319 HydrophobicContact CB-CG2 3.67Å; Q317-V319 PolarHBondContact O-N 3.35Å; V319-L322 HydrophobicContact CG1-CD1 4.39Å; V319-A335 HydrophobicContact CB-CB 4.41Å; V319-A335 HydrophobicContact CG2-CB 3.99Å
320	C	98.1	Very high	96.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-20.1	-175.4	50.7	0	0	0	0	114.4	Y188 N190 E318 G334 K363	Y188-C320 HydrophobicContact CD1-CB 3.91Å; Y188-C320 WeakPolarHBondContact O-CB 3.47Å; N190-C320 PolarHBondContact ND2-O 2.69Å; E318-C320 PolarHBondContact O-N 2.73Å; C320-G334 PolarHBondContact N-O 2.85Å; C320-K363 HydrophobicContact CB-CB 4.13Å
321	G	98.5	Very high	96.8	Very high	2 Å²	2	37.5 Å²	37.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.1	173	0	0	0	0	0	110	S333 G334 K363	G321-S333 CarbonylContact O-C 3.55Å; G321-S333 VanDerWaalsContact O-CA 3.25Å; G321-S333 WeakPolarHBondContact O-CA 3.4Å; G321-G334 PolarHBondContact N-O 3Å; G321-G334 PolarHBondContact O-N 3.42Å; G321-K363 WeakPolarHBondContact CA-O 3.26Å
322	L	98.6	Very high	97	Very high	15 Å²	15	34.9 Å²	34.9	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	123.1	179	-165.5	69.8	0	0	0	109.5	A280 T282 A291 I297 V319 L331 A332	A280-L322 HydrophobicContact CB-CB 3.77Å; T282-L322 HydrophobicContact CG2-CB 4.41Å; T282-L322 HydrophobicContact CG2-CD2 3.75Å; T282-L322 HydrophobicContact CG2-CG 3.64Å; A291-L322 HydrophobicContact CB-CD2 4.09Å; I297-L322 HydrophobicContact CD1-CD1 3.85Å; I297-L322 HydrophobicContact CG1-CD1 4.28Å; I297-L322 HydrophobicContact CG2-CD1 4.08Å; I297-L322 HydrophobicContact CG2-CD2 4.25Å; V319-L322 HydrophobicContact CG1-CD1 4.39Å; L322-L331 HydrophobicContact CD1-CD1 3.82Å; L322-L331 HydrophobicContact CD1-CD2 4.23Å; L322-L331 HydrophobicContact CD1-CG 4.21Å; L322-L331 HydrophobicContact CG-CD1 4.07Å; L322-A332 WeakPolarHBondContact CA-O 3.37Å
323	S	98.2	Very high	97.2	Very high	31 Å²	31	34.9 Å²	34.9	22%	0.217	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	136.4	178.3	-171.2	0	0	0	0	112.8	A332 W367	S323-A332 PolarHBondContact N-O 2.94Å; S323-A332 PolarHBondContact O-N 2.9Å; S323-W367 PolarHBondContact O-NE1 2.94Å
324	W	97.9	Very high	97.4	Very high	8 Å²	8	30 Å²	30	3%	0.03	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	142.2	169.3	-73	98.5	0	0	0	112.2	T282 W283 R284 L287 S289 K328 L331 F345 L348	T282-W324 VanDerWaalsContact CG2-CD1 3.46Å; T282-W324 HydrophobicContact CG2-CG 4.49Å; W283-W324 VanDerWaalsContact C-CD1 3.49Å; W283-W324 VanDerWaalsContact O-CD1 3.26Å; R284-W324 HydrophobicContact CB-CD2 3.75Å; R284-W324 HydrophobicContact CB-CE3 4.44Å; R284-W324 HydrophobicContact CB-CG 3.84Å; R284-W324 HydrophobicContact CB-CZ2 4.23Å; R284-W324 HydrophobicContact CG-CD2 4.27Å; R284-W324 HydrophobicContact CG-CE3 4.49Å; L287-W324 HydrophobicContact CD2-CZ2 4.03Å; S289-W324 PolarHBondContact OG-NE1 3.15Å; W324-K328 HydrophobicContact CB-CD 3.87Å; W324-K328 HydrophobicContact CG-CD 4.48Å; W324-L331 HydrophobicContact CD2-CB 4.01Å; W324-L331 HydrophobicContact CD2-CD1 4.03Å; W324-L331 HydrophobicContact CE3-CB 3.77Å; W324-L331 HydrophobicContact CG-CD1 4.18Å; W324-L331 HydrophobicContact CH2-CB 3.74Å; W324-L331 HydrophobicContact CH2-CD2 4.44Å; W324-L331 HydrophobicContact CZ2-CB 4.01Å; W324-L331 HydrophobicContact CZ2-CD1 4.35Å; W324-L331 HydrophobicContact CZ2-CD2 4.14Å; W324-L331 HydrophobicContact CZ2-CG 4.42Å; W324-L331 HydrophobicContact CZ3-CB 3.63Å; W324-F345 HydrophobicContact CH2-CB 4.5Å; W324-F345 AromaticContact CH2-CD2 3.66Å; W324-F345 HydrophobicContact CH2-CD2 3.66Å; W324-F345 HydrophobicContact CH2-CE2 4.46Å; W324-F345 HydrophobicContact CZ3-CB 4.04Å; W324-F345 AromaticContact CZ3-CD2 3.91Å; W324-F345 HydrophobicContact CZ3-CD2 3.91Å; W324-F345 HydrophobicContact CZ3-CG 4.39Å; W324-L348 HydrophobicContact CH2-CD1 4.15Å; W324-L348 HydrophobicContact CH2-CD2 4.02Å
325	S	97.2	Very high	97.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.			trans	-60.7	153.7	171.7	66.9	0	0	0	0	111.3	D327 K328 R329 F330	S325-D327 WeakPolarHBondContact CB-OD1 3.22Å; S325-D327 PolarHBondContact O-N 3.16Å; S325-D327 PolarHBondContact OG-OD1 2.83Å; S325-K328 WeakPolarHBondContact O-CA 3.17Å; S325-K328 WeakPolarHBondContact O-CD 3.47Å; S325-K328 PolarHBondContact O-N 3.02Å; S325-K328 PolarHBondContact OG-N 2.59Å; S325-R329 PolarHBondContact OG-N 3.17Å; S325-R329 VanDerWaalsContact OG-N 3.14Å; S325-F330 PolarHBondContact N-O 3.31Å; S325-F330 PolarHBondContact OG-N 2.89Å; S325-F330 PolarHBondContact OG-O 2.95Å
326	P	94.9	Very high	97.5	Very high	68 Å²	68	28.5 Å²	28.5	44%	0.442	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.2	-178.6	-25.8	34	0	0	0	113.2	K328 W367	P326-K328 VanDerWaalsContact C-N 3.3Å; P326-W367 HydrophobicContact CG-CB 4.08Å
327	D	94.9	Very high	97.6	Very high	56 Å²	56	24 Å²	24	30%	0.299	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	4.1	175.2	67	-4.6	0	0	0	113.7	S325 R329 P372	S325-D327 WeakPolarHBondContact CB-OD1 3.22Å; S325-D327 PolarHBondContact O-N 3.16Å; S325-D327 PolarHBondContact OG-OD1 2.83Å; D327-R329 PolarHBondContact O-N 3.02Å; D327-R329 PolarHBondContact OD1-N 2.87Å; D327-R329 IonicContact OD2-CZ 3.83Å; D327-R329 IonicContact OD2-NE 3.37Å; D327-R329 PolarHBondContact OD2-NE 3.34Å; D327-R329 IonicContact OD2-NH2 2.73Å; D327-R329 PolarHBondContact OD2-NH2 3.11Å; D327-P372 HydrophobicContact CB-CB 4.28Å; D327-P372 WeakPolarHBondContact OD2-CB 3.28Å
328	K	95.3	Very high	97.7	Very high	52 Å²	52	22.4 Å²	22.4	23%	0.226	11%	0.114	C	C	.	.	S	Bend	trans	55.8	22.3	176.6	-53.8	-62	-179	-178.2	0	114.9	W283 R284 W324 S325 P326	W283-K328 PolarHBondContact O-NZ 3.28Å; R284-K328 HydrophobicContact CB-CD 4.27Å; R284-K328 HydrophobicContact CG-CB 4.02Å; R284-K328 HydrophobicContact CG-CD 4.03Å; R284-K328 HydrophobicContact CG-CG 4.21Å; R284-K328 PolarHBondContact NE-O 3.04Å; W324-K328 HydrophobicContact CB-CD 3.87Å; W324-K328 HydrophobicContact CG-CD 4.48Å; S325-K328 WeakPolarHBondContact O-CA 3.17Å; S325-K328 WeakPolarHBondContact O-CD 3.47Å; S325-K328 PolarHBondContact O-N 3.02Å; S325-K328 PolarHBondContact OG-N 2.59Å; P326-K328 VanDerWaalsContact C-N 3.3Å
329	R	96.3	Very high	97.7	Very high	112 Å²	112	24.2 Å²	24.2	42%	0.423	12%	0.122	S	C	.	.	S	Bend	trans	-84.8	-30.9	176.9	-70.6	-164.4	-65.4	131.5	9.1	113.2	S325 D327 F345 N373	S325-R329 PolarHBondContact OG-N 3.17Å; S325-R329 VanDerWaalsContact OG-N 3.14Å; D327-R329 PolarHBondContact O-N 3.02Å; D327-R329 PolarHBondContact OD1-N 2.87Å; D327-R329 IonicContact OD2-CZ 3.83Å; D327-R329 IonicContact OD2-NE 3.37Å; D327-R329 PolarHBondContact OD2-NE 3.34Å; D327-R329 IonicContact OD2-NH2 2.73Å; D327-R329 PolarHBondContact OD2-NH2 3.11Å; R329-F345 PolarHBondContact O-N 2.73Å; R329-N373 PolarHBondContact NH2-OD1 3.41Å
330	F	97.6	Very high	97.7	Very high	11 Å²	11	24.2 Å²	24.2	5%	0.048	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	139.7	-178.4	-60.5	-71.8	0	0	0	110.8	S325 V342 W343 P344 E352 W367 A391	S325-F330 PolarHBondContact N-O 3.31Å; S325-F330 PolarHBondContact OG-N 2.89Å; S325-F330 PolarHBondContact OG-O 2.95Å; F330-V342 HydrophobicContact CB-CG1 4.01Å; F330-V342 HydrophobicContact CD1-CG1 3.76Å; F330-V342 HydrophobicContact CG-CG1 4.04Å; F330-W343 CarbonylContact C-O 3.6Å; F330-W343 VanDerWaalsContact CA-O 3.27Å; F330-W343 WeakPolarHBondContact CA-O 3.44Å; F330-P344 HydrophobicContact CD1-CB 4.48Å; F330-P344 HydrophobicContact CE1-CB 4.42Å; F330-E352 WeakPolarHBondContact CE1-OE2 3.43Å; F330-W367 HydrophobicContact CB-CH2 3.56Å; F330-W367 HydrophobicContact CB-CZ2 3.8Å; F330-W367 HydrophobicContact CD2-CH2 4.36Å; F330-W367 HydrophobicContact CG-CH2 4.24Å; F330-A391 HydrophobicContact CD2-CB 4.2Å; F330-A391 HydrophobicContact CE2-CB 4.36Å
331	L	98.5	Very high	97.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.8	159.1	172.9	66.3	0	0	0	107.1	T282 I297 L322 W324 W343	T282-L331 HydrophobicContact CG2-CD1 3.92Å; I297-L331 HydrophobicContact CG2-CD2 4.31Å; L322-L331 HydrophobicContact CD1-CD1 3.82Å; L322-L331 HydrophobicContact CD1-CD2 4.23Å; L322-L331 HydrophobicContact CD1-CG 4.21Å; L322-L331 HydrophobicContact CG-CD1 4.07Å; W324-L331 HydrophobicContact CD2-CB 4.01Å; W324-L331 HydrophobicContact CD2-CD1 4.03Å; W324-L331 HydrophobicContact CE3-CB 3.77Å; W324-L331 HydrophobicContact CG-CD1 4.18Å; W324-L331 HydrophobicContact CH2-CB 3.74Å; W324-L331 HydrophobicContact CH2-CD2 4.44Å; W324-L331 HydrophobicContact CZ2-CB 4.01Å; W324-L331 HydrophobicContact CZ2-CD1 4.35Å; W324-L331 HydrophobicContact CZ2-CD2 4.14Å; W324-L331 HydrophobicContact CZ2-CG 4.42Å; W324-L331 HydrophobicContact CZ3-CB 3.63Å; L331-W343 HydrophobicContact CB-CB 4.16Å; L331-W343 PolarHBondContact N-O 3Å; L331-W343 PolarHBondContact O-N 2.85Å
332	A	98.7	Very high	97.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.2	168.6	0	0	0	0	0	110.1	L322 S323 C341 L365 W367 L375	L322-A332 WeakPolarHBondContact CA-O 3.37Å; S323-A332 PolarHBondContact N-O 2.94Å; S323-A332 PolarHBondContact O-N 2.9Å; A332-C341 CarbonylContact C-O 3.56Å; A332-C341 VanDerWaalsContact CA-O 3.28Å; A332-C341 WeakPolarHBondContact CA-O 3.44Å; A332-L365 HydrophobicContact CB-CD1 3.87Å; A332-L365 HydrophobicContact CB-CD2 4.01Å; A332-L365 HydrophobicContact CB-CG 4.42Å; A332-W367 HydrophobicContact CB-CH2 4.43Å; A332-W367 HydrophobicContact CB-CZ2 3.5Å; A332-L375 HydrophobicContact CB-CD1 4.13Å; A332-L375 HydrophobicContact CB-CD2 3.73Å
333	S	98.8	Very high	97.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.8	177.6	62.1	0	0	0	0	110.6	I297 H315 G321 V340 C341 W343	I297-S333 VanDerWaalsContact CD1-CB 3.49Å; H315-S333 PolarHBondContact CD2-OG 3.29Å; H315-S333 PolarHBondContact NE2-OG 2.78Å; G321-S333 CarbonylContact O-C 3.55Å; G321-S333 VanDerWaalsContact O-CA 3.25Å; G321-S333 WeakPolarHBondContact O-CA 3.4Å; S333-V340 CarbonylContact O-C 3.58Å; S333-V340 VanDerWaalsContact O-CA 3.23Å; S333-V340 WeakPolarHBondContact O-CA 3.4Å; S333-C341 PolarHBondContact N-O 2.65Å; S333-C341 PolarHBondContact O-N 2.83Å; S333-W343 PolarHBondContact OG-NE1 3.36Å
334	G	98.7	Very high	97.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.5	172.4	0	0	0	0	0	109.7	C320 G321 F339 V362	C320-G334 PolarHBondContact N-O 2.85Å; G321-G334 PolarHBondContact N-O 3Å; G321-G334 PolarHBondContact O-N 3.42Å; G334-F339 WeakPolarHBondContact CA-O 2.98Å; G334-V362 CarbonylContact C-O 3.58Å; G334-V362 WeakPolarHBondContact CA-O 3.38Å
335	A	98.5	Very high	97.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	173.5	-170.7	0	0	0	0	0	113.1	H315 E318 V319 D337 N338 F339 A361 V362	H315-A335 HydrophobicContact CB-CB 4.18Å; H315-A335 VanDerWaalsContact ND1-CB 3.3Å; H315-A335 WeakPolarHBondContact ND1-CB 3.21Å; E318-A335 CarbonylContact O-C 3.59Å; E318-A335 WeakPolarHBondContact O-CA 3.42Å; E318-A335 VanDerWaalsContact O-CB 3.31Å; E318-A335 WeakPolarHBondContact O-CB 3.48Å; V319-A335 HydrophobicContact CB-CB 4.41Å; V319-A335 HydrophobicContact CG2-CB 3.99Å; A335-D337 WeakPolarHBondContact CB-OD1 3.47Å; A335-D337 PolarHBondContact O-N 3.34Å; A335-N338 PolarHBondContact O-N 2.92Å; A335-F339 PolarHBondContact N-O 2.93Å; A335-A361 WeakPolarHBondContact O-CA 3.5Å; A335-V362 PolarHBondContact O-N 3.08Å
336	N	98.3	Very high	97.5	Very high	42 Å²	42	31.7 Å²	31.7	23%	0.225	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.8	176.5	-165.4	55.6	0	0	0	113.9	Y188 Q317 E318 N338 A361	Y188-N336 HydrophobicContact CE1-CB 3.82Å; Y188-N336 WeakPolarHBondContact CE1-OD1 3.47Å; Y188-N336 VanDerWaalsContact CZ-OD1 3.31Å; Y188-N336 PolarHBondContact OH-OD1 2.93Å; Q317-N336 HydrophobicContact CB-CB 3.99Å; Q317-N336 PolarHBondContact OE1-ND2 3.24Å; Q317-N336 PolarHBondContact OE1-O 2.8Å; E318-N336 HydrophobicContact CB-CB 4.43Å; E318-N336 PolarHBondContact O-N 2.88Å; N336-N338 PolarHBondContact O-N 3.02Å; N336-N338 PolarHBondContact O-OD1 2.79Å; N336-A361 HydrophobicContact CB-CB 4.36Å; N336-A361 WeakPolarHBondContact OD1-CB 3.49Å
337	D	98.1	Very high	97.5	Very high	14 Å²	14	31 Å²	31	8%	0.075	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	10.1	168	61.3	14.4	0	0	0	112.8	H315 T316 Q317 A335 F339	H315-D337 VanDerWaalsContact CA-OD2 3.24Å; H315-D337 WeakPolarHBondContact CA-OD2 3.49Å; H315-D337 WeakPolarHBondContact CB-OD2 3.36Å; H315-D337 IonicContact CE1-OD1 3.8Å; H315-D337 IonicContact CG-OD2 3.04Å; H315-D337 IonicContact ND1-OD1 3.52Å; H315-D337 PolarHBondContact ND1-OD1 2.72Å; H315-D337 IonicContact ND1-OD2 2.62Å; H315-D337 PolarHBondContact ND1-OD2 3.11Å; T316-D337 PolarHBondContact N-OD2 3.27Å; Q317-D337 HydrophobicContact CB-CB 4.14Å; Q317-D337 HydrophobicContact CG-CB 4.08Å; A335-D337 WeakPolarHBondContact CB-OD1 3.47Å; A335-D337 PolarHBondContact O-N 3.34Å; D337-F339 WeakPolarHBondContact O-CD1 3.35Å; D337-F339 PolarHBondContact O-N 3.04Å; D337-F339 WeakPolarHBondContact OD1-CB 3.39Å; D337-F339 PolarHBondContact OD1-N 2.87Å; D337-F339 VanDerWaalsContact OD1-N 3.15Å
338	N	98.4	Very high	97.6	Very high	47 Å²	47	29.7 Å²	29.7	25%	0.251	15%	0.151	S	C	.	.	S	Bend	trans	67.3	6.3	179.2	-50	-18.1	0	0	0	114.6	A335 N336 H358 Q359 A360 A361	A335-N338 PolarHBondContact O-N 2.92Å; N336-N338 PolarHBondContact O-N 3.02Å; N336-N338 PolarHBondContact O-OD1 2.79Å; N338-H358 WeakPolarHBondContact CB-O 3.29Å; N338-Q359 PolarHBondContact ND2-O 2.9Å; N338-A360 WeakPolarHBondContact OD1-CA 3.46Å; N338-A360 PolarHBondContact OD1-O 3.38Å; N338-A361 PolarHBondContact OD1-N 2.9Å
339	F	98.4	Very high	97.5	Very high	51 Å²	51	31.2 Å²	31.2	22%	0.224	17%	0.168	C	C	.	.			trans	-92.1	148.4	-180	-62.6	-15	0	0	0	111.7	F314 H315 G334 A335 D337 V354 R356	F314-F339 AromaticContact CE1-CD2 3.92Å; F314-F339 HydrophobicContact CE1-CD2 3.92Å; F314-F339 HydrophobicContact CZ-CD2 4.5Å; H315-F339 PolarHBondContact CE1-O 3.06Å; G334-F339 WeakPolarHBondContact CA-O 2.98Å; A335-F339 PolarHBondContact N-O 2.93Å; D337-F339 WeakPolarHBondContact O-CD1 3.35Å; D337-F339 PolarHBondContact O-N 3.04Å; D337-F339 WeakPolarHBondContact OD1-CB 3.39Å; D337-F339 PolarHBondContact OD1-N 2.87Å; D337-F339 VanDerWaalsContact OD1-N 3.15Å; F339-V354 HydrophobicContact CD2-CG1 4.37Å; F339-R356 HydrophobicContact CD1-CB 4.17Å; F339-R356 HydrophobicContact CD1-CG 3.86Å; F339-R356 HydrophobicContact CE1-CB 4.05Å; F339-R356 HydrophobicContact CE1-CG 3.75Å; F339-R356 HydrophobicContact CZ-CG 4.3Å
340	V	98.8	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	125	163	-178.2	0	0	0	0	107.9	S333 L355 V362 L365 L375 T377	S333-V340 CarbonylContact O-C 3.58Å; S333-V340 VanDerWaalsContact O-CA 3.23Å; S333-V340 WeakPolarHBondContact O-CA 3.4Å; V340-L355 HydrophobicContact CB-CB 4.14Å; V340-L355 HydrophobicContact CB-CD1 4.19Å; V340-L355 HydrophobicContact CG1-CD1 4.08Å; V340-L355 PolarHBondContact N-O 3.45Å; V340-L355 WeakPolarHBondContact O-CB 3.32Å; V340-L355 PolarHBondContact O-N 3.04Å; V340-V362 HydrophobicContact CG2-CB 3.94Å; V340-V362 HydrophobicContact CG2-CG1 3.67Å; V340-V362 HydrophobicContact CG2-CG2 3.83Å; V340-L365 HydrophobicContact CG1-CD1 4.39Å; V340-L375 HydrophobicContact CG1-CD2 4.09Å; V340-T377 HydrophobicContact CG1-CG2 4.04Å; V340-T377 HydrophobicContact CG2-CG2 4.09Å
341	C	98.6	Very high	97.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.5	174.9	-63.4	0	0	0	0	110.3	F314 A332 S333 W343 P351 H353	F314-C341 WeakPolarHBondContact CD1-SG 3.42Å; F314-C341 WeakPolarHBondContact CE1-SG 3.49Å; A332-C341 CarbonylContact C-O 3.56Å; A332-C341 VanDerWaalsContact CA-O 3.28Å; A332-C341 WeakPolarHBondContact CA-O 3.44Å; S333-C341 PolarHBondContact N-O 2.65Å; S333-C341 PolarHBondContact O-N 2.83Å; C341-W343 HydrophobicContact CB-CZ2 3.76Å; C341-P351 HydrophobicContact CB-CB 3.94Å; C341-H353 WeakPolarHBondContact CA-O 3.24Å
342	V	98.5	Very high	97.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.6	170.1	-178.7	0	0	0	0	107.8	F330 P351 E352 H353 L355 W367 L375 A391	F330-V342 HydrophobicContact CB-CG1 4.01Å; F330-V342 HydrophobicContact CD1-CG1 3.76Å; F330-V342 HydrophobicContact CG-CG1 4.04Å; V342-P351 CarbonylContact O-C 3.2Å; V342-E352 PolarHBondContact O-N 3.01Å; V342-H353 HydrophobicContact CB-CB 4.2Å; V342-H353 HydrophobicContact CG2-CB 4.49Å; V342-H353 PolarHBondContact N-O 3.15Å; V342-H353 PolarHBondContact O-N 2.99Å; V342-L355 HydrophobicContact CG2-CD1 4.33Å; V342-W367 HydrophobicContact CG1-CH2 4.41Å; V342-L375 HydrophobicContact CG2-CD2 4.18Å; V342-A391 HydrophobicContact CG1-CB 4.19Å
343	W	98.2	Very high	97.4	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.2	-174.4	-46.8	83.2	0	0	0	109.3	I297 F314 F330 L331 S333 C341 L348 K350 P351	I297-W343 HydrophobicContact CD1-CZ2 4.28Å; F314-W343 HydrophobicContact CB-CH2 3.52Å; F314-W343 HydrophobicContact CB-CZ2 4.12Å; F314-W343 HydrophobicContact CG-CH2 4.4Å; F330-W343 CarbonylContact C-O 3.6Å; F330-W343 VanDerWaalsContact CA-O 3.27Å; F330-W343 WeakPolarHBondContact CA-O 3.44Å; L331-W343 HydrophobicContact CB-CB 4.16Å; L331-W343 PolarHBondContact N-O 3Å; L331-W343 PolarHBondContact O-N 2.85Å; S333-W343 PolarHBondContact OG-NE1 3.36Å; C341-W343 HydrophobicContact CB-CZ2 3.76Å; W343-L348 HydrophobicContact CB-CD2 3.78Å; W343-K350 VanDerWaalsContact CE3-C 3.47Å; W343-P351 HydrophobicContact CD2-CB 4.21Å; W343-P351 HydrophobicContact CE3-CB 4.07Å; W343-P351 HydrophobicContact CH2-CB 4.29Å; W343-P351 HydrophobicContact CH2-CG 4.34Å; W343-P351 HydrophobicContact CZ2-CB 4.4Å; W343-P351 HydrophobicContact CZ3-CB 4.12Å; W343-P351 VanDerWaalsContact CZ3-CD 3.46Å; W343-P351 HydrophobicContact CZ3-CG 4.28Å; W343-P351 VanDerWaalsContact CZ3-N 3.34Å
344	P	96.9	Very high	97.4	Very high	17 Å²	17	40.3 Å²	40.3	11%	0.11	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	136.3	174.3	30.6	-27.3	0	0	0	109.1	F330 S346 D347 E352	F330-P344 HydrophobicContact CD1-CB 4.48Å; F330-P344 HydrophobicContact CE1-CB 4.42Å; P344-S346 PolarHBondContact O-N 3.12Å; P344-S346 VanDerWaalsContact O-N 3.11Å; P344-D347 WeakPolarHBondContact CD-O 3.26Å; P344-D347 CarbonylContact O-C 3.4Å; P344-D347 PolarHBondContact O-N 2.99Å; P344-D347 VanDerWaalsContact O-O 3.13Å; P344-E352 HydrophobicContact CG-CB 4.08Å
345	F	95.6	Very high	97.3	Very high	80 Å²	80	40.9 Å²	40.9	35%	0.351	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.7	178.3	178.2	-109.6	0	0	0	112.8	R284 L287 W324 R329 D347 L348	R284-F345 VanDerWaalsContact CZ-CE1 3.47Å; R284-F345 VanDerWaalsContact CZ-CE2 3.47Å; R284-F345 VanDerWaalsContact NE-CD2 3.35Å; R284-F345 VanDerWaalsContact NH1-CZ 3.32Å; R284-F345 VanDerWaalsContact NH2-CE1 3.27Å; L287-F345 HydrophobicContact CD2-CE2 4.24Å; W324-F345 HydrophobicContact CH2-CB 4.5Å; W324-F345 AromaticContact CH2-CD2 3.66Å; W324-F345 HydrophobicContact CH2-CD2 3.66Å; W324-F345 HydrophobicContact CH2-CE2 4.46Å; W324-F345 HydrophobicContact CZ3-CB 4.04Å; W324-F345 AromaticContact CZ3-CD2 3.91Å; W324-F345 HydrophobicContact CZ3-CD2 3.91Å; W324-F345 HydrophobicContact CZ3-CG 4.39Å; R329-F345 PolarHBondContact O-N 2.73Å; F345-D347 PolarHBondContact O-N 2.81Å; F345-L348 HydrophobicContact CD2-CD1 4.42Å
346	S	95.3	Very high	97.3	Very high	113 Å²	113	48.1 Å²	48.1	79%	0.79	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.5	177.4	54	0	0	0	0	113.8	P344	P344-S346 PolarHBondContact O-N 3.12Å; P344-S346 VanDerWaalsContact O-N 3.11Å
347	D	95.9	Very high	97.3	Very high	55 Å²	55	49.5 Å²	49.5	29%	0.294	26%	0.256	S	S	.	.			trans	-153.8	96	179.1	-176.8	6.9	0	0	0	110.3	P344 F345 S349 K350	P344-D347 WeakPolarHBondContact CD-O 3.26Å; P344-D347 CarbonylContact O-C 3.4Å; P344-D347 PolarHBondContact O-N 2.99Å; P344-D347 VanDerWaalsContact O-O 3.13Å; F345-D347 PolarHBondContact O-N 2.81Å; D347-S349 VanDerWaalsContact C-N 3.28Å; D347-S349 VanDerWaalsContact OD1-CB 3.3Å; D347-S349 WeakPolarHBondContact OD1-CB 3.34Å; D347-S349 PolarHBondContact OD1-N 2.94Å; D347-S349 PolarHBondContact OD1-OG 2.8Å; D347-K350 VanDerWaalsContact OD2-CE 3.24Å; D347-K350 WeakPolarHBondContact OD2-CE 3.44Å
348	L	96.3	Very high	97.3	Very high	28 Å²	28	49 Å²	49	15%	0.147	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.4	177.7	-62.3	170.6	0	0	0	112.8	S312 W324 W343 F345 K350	S312-L348 WeakPolarHBondContact CB-O 3.41Å; S312-L348 PolarHBondContact OG-O 3.34Å; W324-L348 HydrophobicContact CH2-CD1 4.15Å; W324-L348 HydrophobicContact CH2-CD2 4.02Å; W343-L348 HydrophobicContact CB-CD2 3.78Å; F345-L348 HydrophobicContact CD2-CD1 4.42Å; L348-K350 VanDerWaalsContact C-N 3.3Å; L348-K350 PolarHBondContact O-N 3.42Å
349	S	94	Very high	97.3	Very high	83 Å²	83	52.6 Å²	52.6	58%	0.58	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-22	-179.6	72.3	0	0	0	0	113.3	D347	D347-S349 VanDerWaalsContact C-N 3.28Å; D347-S349 VanDerWaalsContact OD1-CB 3.3Å; D347-S349 WeakPolarHBondContact OD1-CB 3.34Å; D347-S349 PolarHBondContact OD1-N 2.94Å; D347-S349 PolarHBondContact OD1-OG 2.8Å
350	K	94.7	Very high	97.3	Very high	130 Å²	130	50.7 Å²	50.7	57%	0.565	26%	0.262	S	S	*	.	S	Bend	trans	-142.6	144.1	-179.8	65.1	-176.7	179.8	-173.9	0	110.9	W343 D347 L348	W343-K350 VanDerWaalsContact CE3-C 3.47Å; D347-K350 VanDerWaalsContact OD2-CE 3.24Å; D347-K350 WeakPolarHBondContact OD2-CE 3.44Å; L348-K350 VanDerWaalsContact C-N 3.3Å; L348-K350 PolarHBondContact O-N 3.42Å
351	P	97.7	Very high	97.3	Very high	26 Å²	26	51 Å²	51	17%	0.169	27%	0.265	C	S	.	.			trans	-69.4	139.1	173.1	29.4	-33.2	0	0	0	110	F314 C341 V342 W343 V354	F314-P351 HydrophobicContact CD2-CG 4Å; F314-P351 HydrophobicContact CE2-CG 4.28Å; F314-P351 HydrophobicContact CG-CG 4.18Å; C341-P351 HydrophobicContact CB-CB 3.94Å; V342-P351 CarbonylContact O-C 3.2Å; W343-P351 HydrophobicContact CD2-CB 4.21Å; W343-P351 HydrophobicContact CE3-CB 4.07Å; W343-P351 HydrophobicContact CH2-CB 4.29Å; W343-P351 HydrophobicContact CH2-CG 4.34Å; W343-P351 HydrophobicContact CZ2-CB 4.4Å; W343-P351 HydrophobicContact CZ3-CB 4.12Å; W343-P351 VanDerWaalsContact CZ3-CD 3.46Å; W343-P351 HydrophobicContact CZ3-CG 4.28Å; W343-P351 VanDerWaalsContact CZ3-N 3.34Å; P351-V354 HydrophobicContact CB-CG2 3.99Å; P351-V354 HydrophobicContact CG-CG2 3.49Å; P351-V354 VanDerWaalsContact CG-CG2 3.49Å
352	E	97.3	Very high	97.3	Very high	83 Å²	83	51 Å²	51	39%	0.388	27%	0.265	S	S	.	.	S	Bend	trans	-71.1	-40	169.3	-172.5	-179.4	140.8	0	0	110.3	F330 V342 P344	F330-E352 WeakPolarHBondContact CE1-OE2 3.43Å; V342-E352 PolarHBondContact O-N 3.01Å; P344-E352 HydrophobicContact CG-CB 4.08Å
353	H	98.2	Very high	97.3	Very high	32 Å²	32	51.4 Å²	51.4	15%	0.148	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.5	176.8	-55.9	-71.4	0	0	0	110.8	C341 V342 L355 A391 G394	C341-H353 WeakPolarHBondContact CA-O 3.24Å; V342-H353 HydrophobicContact CB-CB 4.2Å; V342-H353 HydrophobicContact CG2-CB 4.49Å; V342-H353 PolarHBondContact N-O 3.15Å; V342-H353 PolarHBondContact O-N 2.99Å; H353-L355 HydrophobicContact CB-CD2 4.08Å; H353-A391 PolarHBondContact CD2-O 2.83Å; H353-A391 PolarHBondContact NE2-O 2.8Å; H353-G394 PolarHBondContact CE1-N 3.36Å; H353-G394 WeakPolarHBondContact ND1-CA 3.44Å
354	V	98.4	Very high	97.3	Very high	44 Å²	44	51.4 Å²	51.4	27%	0.267	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.2	170.5	-179.4	0	0	0	0	107.9	F314 F339 P351 R356	F314-V354 HydrophobicContact CE1-CG1 3.76Å; F314-V354 HydrophobicContact CE1-CG2 3.98Å; F314-V354 HydrophobicContact CE2-CG2 4.04Å; F314-V354 HydrophobicContact CZ-CB 4.26Å; F314-V354 HydrophobicContact CZ-CG1 3.62Å; F314-V354 HydrophobicContact CZ-CG2 3.57Å; F339-V354 HydrophobicContact CD2-CG1 4.37Å; P351-V354 HydrophobicContact CB-CG2 3.99Å; P351-V354 HydrophobicContact CG-CG2 3.49Å; P351-V354 VanDerWaalsContact CG-CG2 3.49Å; V354-R356 HydrophobicContact CG1-CG 4.07Å
355	L	98.2	Very high	97.3	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.063	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.5	-173.8	-45.2	171.3	0	0	0	108.7	V340 V342 H353 W389 G394	V340-L355 HydrophobicContact CB-CB 4.14Å; V340-L355 HydrophobicContact CB-CD1 4.19Å; V340-L355 HydrophobicContact CG1-CD1 4.08Å; V340-L355 PolarHBondContact N-O 3.45Å; V340-L355 WeakPolarHBondContact O-CB 3.32Å; V340-L355 PolarHBondContact O-N 3.04Å; V342-L355 HydrophobicContact CG2-CD1 4.33Å; H353-L355 HydrophobicContact CB-CD2 4.08Å; L355-W389 HydrophobicContact CB-CE3 4.44Å; L355-W389 HydrophobicContact CB-CH2 4.07Å; L355-W389 HydrophobicContact CB-CZ2 4.35Å; L355-W389 HydrophobicContact CB-CZ3 4.11Å; L355-W389 HydrophobicContact CD1-CB 4.21Å; L355-W389 HydrophobicContact CD1-CD2 3.62Å; L355-W389 HydrophobicContact CD1-CE3 3.8Å; L355-W389 HydrophobicContact CD1-CG 3.79Å; L355-W389 HydrophobicContact CD1-CZ3 4.32Å; L355-W389 HydrophobicContact CD2-CE3 3.94Å; L355-W389 HydrophobicContact CD2-CZ3 4.06Å; L355-W389 HydrophobicContact CG-CE3 4.27Å; L355-W389 HydrophobicContact CG-CZ3 4.39Å; L355-G394 WeakPolarHBondContact CD2-O 3.21Å
356	R	98.2	Very high	97.4	Very high	152 Å²	152	49 Å²	49	57%	0.574	26%	0.258	S	S	*	.			trans	-119.4	10	-165.3	-56.9	-174	-179.8	-150.9	-2.4	114.2	F339 V354	F339-R356 HydrophobicContact CD1-CB 4.17Å; F339-R356 HydrophobicContact CD1-CG 3.86Å; F339-R356 HydrophobicContact CE1-CB 4.05Å; F339-R356 HydrophobicContact CE1-CG 3.75Å; F339-R356 HydrophobicContact CZ-CG 4.3Å; V354-R356 HydrophobicContact CG1-CG 4.07Å
357	D	98	Very high	97.6	Very high	71 Å²	71	44.1 Å²	44.1	38%	0.38	22%	0.223	S	C	.	.			trans	-78.4	-23.8	-170.4	-57.1	-124.6	0	0	0	113.7	Q359 R387 W389	D357-Q359 PolarHBondContact O-NE2 3.16Å; D357-R387 PolarHBondContact O-NH2 3.33Å; D357-R387 IonicContact OD1-NH1 3.55Å; D357-W389 HydrophobicContact CB-CH2 3.84Å; D357-W389 VanDerWaalsContact OD2-CH2 3.32Å; D357-W389 WeakPolarHBondContact OD2-CH2 3.45Å
358	H	98.4	Very high	97.7	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.019	21%	0.209	C	C	.	.			trans	-67.9	141.1	175.6	-77.1	-69.5	0	0	0	110.7	N338 V362 T377 D383 T385	N338-H358 WeakPolarHBondContact CB-O 3.29Å; H358-V362 HydrophobicContact CB-CG2 3.72Å; H358-T377 PolarHBondContact NE2-OG1 2.83Å; H358-D383 VanDerWaalsContact CA-OD1 3.31Å; H358-D383 WeakPolarHBondContact CA-OD1 3.42Å; H358-D383 IonicContact CE1-OD2 3.26Å; H358-D383 IonicContact CG-OD2 3.02Å; H358-D383 IonicContact ND1-OD1 2.84Å; H358-D383 IonicContact ND1-OD2 2.64Å; H358-D383 PolarHBondContact ND1-OD2 2.88Å; H358-T385 PolarHBondContact CE1-O 3.25Å; H358-T385 PolarHBondContact ND1-OG1 3.33Å
359	Q	98	Very high	97.7	Very high	122 Å²	122	42.9 Å²	42.9	57%	0.57	22%	0.22	S	C	*	.	S	Bend	trans	-102.3	6.8	-179.9	-55.4	-54.4	-58.7	0	0	113.4	N338 D357 D383	N338-Q359 PolarHBondContact ND2-O 2.9Å; D357-Q359 PolarHBondContact O-NE2 3.16Å; Q359-D383 HydrophobicContact CB-CB 4.23Å; Q359-D383 PolarHBondContact N-OD1 2.9Å
360	A	97.9	Very high	97.7	Very high	10 Å²	10	41.8 Å²	41.8	8%	0.083	20%	0.203	C	C	.	.	S	Bend	trans	-152.6	173.8	179.9	0	0	0	0	0	110.3	N338 D383	N338-A360 WeakPolarHBondContact OD1-CA 3.46Å; N338-A360 PolarHBondContact OD1-O 3.38Å; A360-D383 HydrophobicContact CB-CB 3.73Å
361	A	98.2	Very high	97.8	Very high	7 Å²	7	40.1 Å²	40.1	6%	0.058	20%	0.196	C	C	.	.			trans	-52.4	141.7	179.5	0	0	0	0	0	113.1	F187 Y188 A335 N336 N338 G380	F187-A361 HydrophobicContact CE1-CB 4.07Å; Y188-A361 HydrophobicContact CE1-CB 3.87Å; A335-A361 WeakPolarHBondContact O-CA 3.5Å; N336-A361 HydrophobicContact CB-CB 4.36Å; N336-A361 WeakPolarHBondContact OD1-CB 3.49Å; N338-A361 PolarHBondContact OD1-N 2.9Å; A361-G380 PolarHBondContact O-N 3.06Å
362	V	98.7	Very high	97.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.			trans	-114.4	88.5	-179.9	-172.1	0	0	0	0	110.1	G334 A335 V340 H358 T377	G334-V362 CarbonylContact C-O 3.58Å; G334-V362 WeakPolarHBondContact CA-O 3.38Å; A335-V362 PolarHBondContact O-N 3.08Å; V340-V362 HydrophobicContact CG2-CB 3.94Å; V340-V362 HydrophobicContact CG2-CG1 3.67Å; V340-V362 HydrophobicContact CG2-CG2 3.83Å; H358-V362 HydrophobicContact CB-CG2 3.72Å; V362-T377 HydrophobicContact CG1-CG2 4.32Å
363	K	98.5	Very high	97.5	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.039	20%	0.198	C	C	.	.			trans	-86.5	-45.6	169.4	168.6	171.4	154.9	68.2	0	111.6	F187 L189 N190 C320 G321 L365 S407 L450	F187-K363 HydrophobicContact CE1-CB 3.72Å; F187-K363 HydrophobicContact CE1-CD 4.45Å; F187-K363 HydrophobicContact CE2-CB 4.35Å; F187-K363 HydrophobicContact CE2-CD 4.36Å; F187-K363 HydrophobicContact CZ-CB 3.61Å; F187-K363 HydrophobicContact CZ-CD 4.34Å; F187-K363 WeakPolarHBondContact O-CD 3.29Å; F187-K363 VanDerWaalsContact O-CE 3.24Å; F187-K363 WeakPolarHBondContact O-CE 3.44Å; L189-K363 WeakPolarHBondContact O-CE 3.26Å; L189-K363 PolarHBondContact O-NZ 3.28Å; N190-K363 VanDerWaalsContact CG-NZ 3.35Å; N190-K363 PolarHBondContact OD1-NZ 3.22Å; C320-K363 HydrophobicContact CB-CB 4.13Å; G321-K363 WeakPolarHBondContact CA-O 3.26Å; K363-L365 PolarHBondContact O-N 3.17Å; K363-L365 VanDerWaalsContact O-N 3.12Å; K363-S407 VanDerWaalsContact CE-O 3.3Å; K363-S407 WeakPolarHBondContact CE-O 3.06Å; K363-L450 VanDerWaalsContact CE-O 3.23Å; K363-L450 WeakPolarHBondContact CE-O 3.45Å
364	A	98.4	Very high	97.5	Very high	2 Å²	2	39 Å²	39	2%	0.017	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	109.8	-176.2	0	0	0	0	0	109.9	T377 G378 I406 I409	A364-T377 CarbonylContact O-C 3.58Å; A364-T377 VanDerWaalsContact O-CA 3.29Å; A364-T377 WeakPolarHBondContact O-CA 3.48Å; A364-G378 PolarHBondContact O-N 2.82Å; A364-I406 HydrophobicContact CB-CB 4.18Å; A364-I406 HydrophobicContact CB-CG2 3.56Å; A364-I409 HydrophobicContact CB-CD1 3.79Å; A364-I409 HydrophobicContact CB-CG1 3.98Å
365	L	97.9	Very high	97.5	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.11	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	124.7	-176	-174.2	155.7	0	0	0	108.5	A332 V340 K363 L375 C376 T377	A332-L365 HydrophobicContact CB-CD1 3.87Å; A332-L365 HydrophobicContact CB-CD2 4.01Å; A332-L365 HydrophobicContact CB-CG 4.42Å; V340-L365 HydrophobicContact CG1-CD1 4.39Å; K363-L365 PolarHBondContact O-N 3.17Å; K363-L365 VanDerWaalsContact O-N 3.12Å; L365-L375 HydrophobicContact CD2-CD1 3.71Å; L365-L375 HydrophobicContact CG-CD1 3.87Å; L365-C376 WeakPolarHBondContact CA-O 3.42Å; L365-T377 HydrophobicContact CD1-CG2 4.43Å; L365-T377 HydrophobicContact CG-CG2 4.22Å
366	S	98.3	Very high	97.5	Very high	24 Å²	24	36.3 Å²	36.3	17%	0.168	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	131.7	-177.7	-166	0	0	0	0	112.4	C376 I409 W411	S366-C376 PolarHBondContact N-O 3.04Å; S366-C376 WeakPolarHBondContact O-CB 3.46Å; S366-C376 PolarHBondContact O-N 2.88Å; S366-I409 VanDerWaalsContact CB-O 3.27Å; S366-I409 WeakPolarHBondContact CB-O 3.44Å; S366-I409 PolarHBondContact OG-O 3.05Å; S366-W411 PolarHBondContact O-NE1 2.63Å; S366-W411 VanDerWaalsContact O-NE1 3.16Å; S366-W411 VanDerWaalsContact OG-CD1 3.28Å
367	W	98.3	Very high	97.5	Very high	12 Å²	12	29 Å²	29	5%	0.045	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	142.1	179.3	-67.1	95.2	0	0	0	111.8	S323 P326 F330 A332 V342 P369 L375 A391 W411	S323-W367 PolarHBondContact O-NE1 2.94Å; P326-W367 HydrophobicContact CG-CB 4.08Å; F330-W367 HydrophobicContact CB-CH2 3.56Å; F330-W367 HydrophobicContact CB-CZ2 3.8Å; F330-W367 HydrophobicContact CD2-CH2 4.36Å; F330-W367 HydrophobicContact CG-CH2 4.24Å; A332-W367 HydrophobicContact CB-CH2 4.43Å; A332-W367 HydrophobicContact CB-CZ2 3.5Å; V342-W367 HydrophobicContact CG1-CH2 4.41Å; W367-P369 WeakPolarHBondContact O-CD 3.42Å; W367-L375 HydrophobicContact CD2-CB 4.46Å; W367-L375 HydrophobicContact CD2-CD1 3.83Å; W367-L375 HydrophobicContact CE3-CB 4.03Å; W367-L375 HydrophobicContact CE3-CD1 4.25Å; W367-L375 HydrophobicContact CG-CD1 4.15Å; W367-L375 HydrophobicContact CH2-CB 4.36Å; W367-L375 HydrophobicContact CZ2-CD1 4.25Å; W367-L375 HydrophobicContact CZ3-CB 3.97Å; W367-A391 HydrophobicContact CH2-CB 3.7Å; W367-A391 HydrophobicContact CZ3-CB 3.61Å; W367-W411 PolarHBondContact O-NE1 2.98Å
368	C	97.9	Very high	97.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.			trans	-73.1	120.8	176.6	-174.7	0	0	0	0	110.9	W370 K371 L374 W411	C368-W370 VanDerWaalsContact C-N 3.3Å; C368-W370 PolarHBondContact O-N 3.05Å; C368-W370 PolarHBondContact SG-NE1 3.12Å; C368-W370 VanDerWaalsContact SG-NE1 3.42Å; C368-K371 HydrophobicContact CB-CB 4.14Å; C368-K371 CarbonylContact O-C 3.54Å; C368-K371 PolarHBondContact O-N 3.35Å; C368-K371 VanDerWaalsContact O-O 3.12Å; C368-L374 HydrophobicContact CB-CB 3.81Å; C368-L374 HydrophobicContact CB-CD2 3.83Å; C368-L374 HydrophobicContact CB-CG 4.06Å; C368-L374 WeakPolarHBondContact CB-O 3.32Å; C368-L374 PolarHBondContact N-O 3.37Å; C368-W411 HydrophobicContact CB-CD2 4.31Å; C368-W411 HydrophobicContact CB-CH2 4.01Å; C368-W411 HydrophobicContact CB-CZ2 3.71Å; C368-W411 HydrophobicContact CB-CZ3 4.44Å
369	P	96.2	Very high	97.5	Very high	57 Å²	57	25.5 Å²	25.5	37%	0.37	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.7	-173.3	19.8	-26.3	0	0	0	113.9	W367 W411 T413	W367-P369 WeakPolarHBondContact O-CD 3.42Å; P369-W411 VanDerWaalsContact CD-CB 3.47Å; P369-W411 HydrophobicContact CG-CB 3.92Å; P369-T413 HydrophobicContact CB-CG2 4Å; P369-T413 HydrophobicContact CG-CG2 3.58Å
370	W	95.1	Very high	97.5	Very high	60 Å²	60	19.7 Å²	19.7	23%	0.227	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-2	177.8	59.7	86	0	0	0	114.3	C368 W411 N412 T413 R416 Y434	C368-W370 VanDerWaalsContact C-N 3.3Å; C368-W370 PolarHBondContact O-N 3.05Å; C368-W370 PolarHBondContact SG-NE1 3.12Å; C368-W370 VanDerWaalsContact SG-NE1 3.42Å; W370-W411 HydrophobicContact CH2-CB 4.43Å; W370-W411 HydrophobicContact CH2-CD2 4.36Å; W370-W411 AromaticContact CH2-CE3 3.41Å; W370-W411 HydrophobicContact CH2-CE3 3.41Å; W370-W411 VanDerWaalsContact CH2-CE3 3.41Å; W370-W411 AromaticContact CH2-CZ3 3.98Å; W370-W411 HydrophobicContact CH2-CZ3 3.98Å; W370-W411 AromaticContact CZ2-CE3 3.63Å; W370-W411 HydrophobicContact CZ2-CE3 3.63Å; W370-W411 AromaticContact CZ2-CZ3 3.69Å; W370-W411 HydrophobicContact CZ2-CZ3 3.69Å; W370-W411 HydrophobicContact CZ3-CB 4.34Å; W370-W411 HydrophobicContact CZ3-CE3 4.28Å; W370-N412 WeakPolarHBondContact CH2-O 3.4Å; W370-N412 WeakPolarHBondContact CZ3-O 3.38Å; W370-T413 HydrophobicContact CE3-CG2 4.04Å; W370-T413 HydrophobicContact CZ3-CG2 4.12Å; W370-R416 HydrophobicContact CH2-CB 4.21Å; W370-R416 HydrophobicContact CH2-CG 4.4Å; W370-R416 HydrophobicContact CZ2-CB 4.01Å; W370-R416 HydrophobicContact CZ2-CG 4.2Å; W370-Y434 HydrophobicContact CZ2-CD1 4.12Å
371	K	95.7	Very high	97.3	Very high	95 Å²	95	22.7 Å²	22.7	41%	0.413	12%	0.123	S	C	.	.	S	Bend	trans	-134.4	91.3	173.9	-72.6	179.3	-178.3	-178.3	0	108.5	C368 N373 L374 Y434	C368-K371 HydrophobicContact CB-CB 4.14Å; C368-K371 CarbonylContact O-C 3.54Å; C368-K371 PolarHBondContact O-N 3.35Å; C368-K371 VanDerWaalsContact O-O 3.12Å; K371-N373 PolarHBondContact O-N 3.44Å; K371-L374 HydrophobicContact CB-CB 3.79Å; K371-L374 HydrophobicContact CB-CD2 4.38Å; K371-L374 HydrophobicContact CD-CD2 3.93Å; K371-L374 WeakPolarHBondContact O-CB 3.41Å; K371-L374 PolarHBondContact O-N 3.26Å; K371-Y434 PolarHBondContact NZ-OH 3.09Å; K371-Y434 VanDerWaalsContact NZ-OH 3.12Å
372	P	93.3	Very high	97.2	Very high	53 Å²	53	27 Å²	27	34%	0.344	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.7	-167.4	20.7	-32.9	0	0	0	114.7	D327	D327-P372 HydrophobicContact CB-CB 4.28Å; D327-P372 WeakPolarHBondContact OD2-CB 3.28Å
373	N	95.7	Very high	97.1	Very high	51 Å²	51	27.6 Å²	27.6	27%	0.273	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-1	178.1	-62.6	-30.6	0	0	0	113.9	R329 K371 N390 A391 T392	R329-N373 PolarHBondContact NH2-OD1 3.41Å; K371-N373 PolarHBondContact O-N 3.44Å; N373-N390 CarbonylContact O-C 3.56Å; N373-N390 WeakPolarHBondContact O-CA 3.49Å; N373-A391 WeakPolarHBondContact O-CB 3.48Å; N373-A391 PolarHBondContact O-N 3.09Å; N373-T392 VanDerWaalsContact CG-OG1 3.26Å; N373-T392 PolarHBondContact ND2-OG1 3.05Å; N373-T392 PolarHBondContact OD1-OG1 2.85Å
374	L	98	Very high	97	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	116	-176.2	-177.7	71.1	0	0	0	110.2	C368 K371 F388 W389 W411 Y434	C368-L374 HydrophobicContact CB-CB 3.81Å; C368-L374 HydrophobicContact CB-CD2 3.83Å; C368-L374 HydrophobicContact CB-CG 4.06Å; C368-L374 WeakPolarHBondContact CB-O 3.32Å; C368-L374 PolarHBondContact N-O 3.37Å; K371-L374 HydrophobicContact CB-CB 3.79Å; K371-L374 HydrophobicContact CB-CD2 4.38Å; K371-L374 HydrophobicContact CD-CD2 3.93Å; K371-L374 WeakPolarHBondContact O-CB 3.41Å; K371-L374 PolarHBondContact O-N 3.26Å; L374-F388 HydrophobicContact CD1-CB 4.17Å; L374-W389 WeakPolarHBondContact CA-O 3.49Å; L374-W411 HydrophobicContact CD2-CH2 3.94Å; L374-W411 HydrophobicContact CD2-CZ2 4.33Å; L374-Y434 HydrophobicContact CD2-CE2 4.06Å; L374-Y434 WeakPolarHBondContact CD2-OH 3.36Å
375	L	98.5	Very high	97	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135	174.9	177.4	64.6	0	0	0	109.9	A332 V340 V342 L365 W367 T377 F388 W389	A332-L375 HydrophobicContact CB-CD1 4.13Å; A332-L375 HydrophobicContact CB-CD2 3.73Å; V340-L375 HydrophobicContact CG1-CD2 4.09Å; V342-L375 HydrophobicContact CG2-CD2 4.18Å; L365-L375 HydrophobicContact CD2-CD1 3.71Å; L365-L375 HydrophobicContact CG-CD1 3.87Å; W367-L375 HydrophobicContact CD2-CB 4.46Å; W367-L375 HydrophobicContact CD2-CD1 3.83Å; W367-L375 HydrophobicContact CE3-CB 4.03Å; W367-L375 HydrophobicContact CE3-CD1 4.25Å; W367-L375 HydrophobicContact CG-CD1 4.15Å; W367-L375 HydrophobicContact CH2-CB 4.36Å; W367-L375 HydrophobicContact CZ2-CD1 4.25Å; W367-L375 HydrophobicContact CZ3-CB 3.97Å; L375-T377 HydrophobicContact CD1-CG2 4.49Å; L375-T377 HydrophobicContact CD2-CG2 4.02Å; L375-T377 HydrophobicContact CG-CG2 3.96Å; L375-F388 CarbonylContact O-C 3.52Å; L375-F388 WeakPolarHBondContact O-CA 3.23Å; L375-W389 HydrophobicContact CB-CB 4.31Å; L375-W389 PolarHBondContact N-O 2.86Å; L375-W389 PolarHBondContact O-N 3.21Å
376	C	98.6	Very high	97	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.8	170	-170.2	0	0	0	0	109.7	L365 S366 L386 R387 F388 I409 W411	L365-C376 WeakPolarHBondContact CA-O 3.42Å; S366-C376 PolarHBondContact N-O 3.04Å; S366-C376 WeakPolarHBondContact O-CB 3.46Å; S366-C376 PolarHBondContact O-N 2.88Å; C376-L386 WeakPolarHBondContact SG-CD1 3.35Å; C376-R387 CarbonylContact C-O 3.54Å; C376-R387 VanDerWaalsContact CA-O 3.31Å; C376-R387 WeakPolarHBondContact CA-O 3.3Å; C376-F388 HydrophobicContact CB-CD1 4.13Å; C376-F388 HydrophobicContact CB-CE1 4.01Å; C376-F388 VanDerWaalsContact SG-CE1 3.51Å; C376-I409 HydrophobicContact CB-CG2 4.4Å; C376-W411 HydrophobicContact CB-CZ2 3.69Å
377	T	98.8	Very high	97	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.1	178.5	60.4	0	0	0	0	111.2	V340 H358 V362 A364 L365 L375 L386 R387 W389	V340-T377 HydrophobicContact CG1-CG2 4.04Å; V340-T377 HydrophobicContact CG2-CG2 4.09Å; H358-T377 PolarHBondContact NE2-OG1 2.83Å; V362-T377 HydrophobicContact CG1-CG2 4.32Å; A364-T377 CarbonylContact O-C 3.58Å; A364-T377 VanDerWaalsContact O-CA 3.29Å; A364-T377 WeakPolarHBondContact O-CA 3.48Å; L365-T377 HydrophobicContact CD1-CG2 4.43Å; L365-T377 HydrophobicContact CG-CG2 4.22Å; L375-T377 HydrophobicContact CD1-CG2 4.49Å; L375-T377 HydrophobicContact CD2-CG2 4.02Å; L375-T377 HydrophobicContact CG-CG2 3.96Å; T377-L386 CarbonylContact O-C 3.51Å; T377-L386 WeakPolarHBondContact O-CA 3.47Å; T377-R387 PolarHBondContact N-O 2.77Å; T377-R387 PolarHBondContact O-N 3.45Å; T377-W389 PolarHBondContact OG1-NE1 3.07Å
378	G	98.4	Very high	97	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.5	179.5	0	0	0	0	0	111.7	A364 T385 I406	A364-G378 PolarHBondContact O-N 2.82Å; G378-T385 WeakPolarHBondContact CA-O 3.42Å; G378-I406 VanDerWaalsContact CA-CD1 3.43Å
379	G	97.7	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.			trans	-87.2	158.6	179.2	0	0	0	0	0	114.6	D383 T385 I406	G379-D383 WeakPolarHBondContact CA-OD2 3.08Å; G379-T385 PolarHBondContact N-O 3.23Å; G379-T385 VanDerWaalsContact N-O 3.09Å; G379-I406 PolarHBondContact O-N 2.62Å
380	G	96.7	Very high	97.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.01	16%	0.156	C	C	.	.			trans	-68.2	-164	176.7	0	0	0	0	0	115.6	A361 S382 D383 H384	A361-G380 PolarHBondContact O-N 3.06Å; G380-S382 PolarHBondContact O-N 3.45Å; G380-D383 PolarHBondContact O-N 3.35Å; G380-D383 VanDerWaalsContact O-N 3.09Å; G380-H384 PolarHBondContact O-N 3.27Å; G380-H384 VanDerWaalsContact O-N 3.08Å
381	T	94.5	Very high	97.2	Very high	73 Å²	73	26.4 Å²	26.4	45%	0.448	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-9.1	-173.3	-39.5	0	0	0	0	115.9	H384 Q405	T381-H384 PolarHBondContact O-CE1 3.24Å; T381-H384 PolarHBondContact O-NE2 2.95Å; T381-H384 VanDerWaalsContact O-NE2 3.14Å; T381-Q405 VanDerWaalsContact OG1-CD 3.24Å; T381-Q405 PolarHBondContact OG1-NE2 3.19Å; T381-Q405 PolarHBondContact OG1-OE1 3.47Å
382	S	95.6	Very high	97.2	Very high	96 Å²	96	25 Å²	25	67%	0.671	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.2	3.3	175.9	-54.6	0	0	0	0	113.2	G380	G380-S382 PolarHBondContact O-N 3.45Å
383	D	97.2	Very high	97.3	Very high	13 Å²	13	26.5 Å²	26.5	7%	0.07	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-50.9	-179.7	179.5	81.3	0	0	0	112.1	H358 Q359 A360 G379 G380 T385	H358-D383 VanDerWaalsContact CA-OD1 3.31Å; H358-D383 WeakPolarHBondContact CA-OD1 3.42Å; H358-D383 IonicContact CE1-OD2 3.26Å; H358-D383 IonicContact CG-OD2 3.02Å; H358-D383 IonicContact ND1-OD1 2.84Å; H358-D383 IonicContact ND1-OD2 2.64Å; H358-D383 PolarHBondContact ND1-OD2 2.88Å; Q359-D383 HydrophobicContact CB-CB 4.23Å; Q359-D383 PolarHBondContact N-OD1 2.9Å; A360-D383 HydrophobicContact CB-CB 3.73Å; G379-D383 WeakPolarHBondContact CA-OD2 3.08Å; G380-D383 PolarHBondContact O-N 3.35Å; G380-D383 VanDerWaalsContact O-N 3.09Å; D383-T385 VanDerWaalsContact O-CG2 3.29Å; D383-T385 WeakPolarHBondContact O-CG2 3.43Å; D383-T385 PolarHBondContact O-N 3.05Å; D383-T385 PolarHBondContact OD1-OG1 3.46Å; D383-T385 WeakPolarHBondContact OD2-CB 3.44Å; D383-T385 PolarHBondContact OD2-N 2.79Å; D383-T385 PolarHBondContact OD2-OG1 3.06Å
384	H	96.1	Very high	97.3	Very high	48 Å²	48	24.9 Å²	24.9	22%	0.222	15%	0.149	C	C	.	.			trans	57.4	8.2	178.8	-41.6	-58.4	0	0	0	115.8	G380 T381 D401 V402 A404 Q405	G380-H384 PolarHBondContact O-N 3.27Å; G380-H384 VanDerWaalsContact O-N 3.08Å; T381-H384 PolarHBondContact O-CE1 3.24Å; T381-H384 PolarHBondContact O-NE2 2.95Å; T381-H384 VanDerWaalsContact O-NE2 3.14Å; H384-D401 WeakPolarHBondContact CB-OD1 3.41Å; H384-V402 WeakPolarHBondContact O-CG2 3.24Å; H384-V402 PolarHBondContact O-N 3.41Å; H384-A404 VanDerWaalsContact ND1-C 3.27Å; H384-Q405 PolarHBondContact ND1-N 3.03Å
385	T	98	Very high	97.3	Very high	16 Å²	16	26.7 Å²	26.7	10%	0.098	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.3	-175.1	70.5	0	0	0	0	111	H358 G378 G379 D383 R387 V400 I406	H358-T385 PolarHBondContact CE1-O 3.25Å; H358-T385 PolarHBondContact ND1-OG1 3.33Å; G378-T385 WeakPolarHBondContact CA-O 3.42Å; G379-T385 PolarHBondContact N-O 3.23Å; G379-T385 VanDerWaalsContact N-O 3.09Å; D383-T385 VanDerWaalsContact O-CG2 3.29Å; D383-T385 WeakPolarHBondContact O-CG2 3.43Å; D383-T385 PolarHBondContact O-N 3.05Å; D383-T385 PolarHBondContact OD1-OG1 3.46Å; D383-T385 WeakPolarHBondContact OD2-CB 3.44Å; D383-T385 PolarHBondContact OD2-N 2.79Å; D383-T385 PolarHBondContact OD2-OG1 3.06Å; T385-R387 PolarHBondContact OG1-NE 2.6Å; T385-V400 CarbonylContact C-O 3.6Å; T385-V400 WeakPolarHBondContact CA-O 3.42Å; T385-I406 WeakPolarHBondContact O-CD1 3.23Å
386	L	98	Very high	97.3	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.1	162.3	-166.4	71.9	0	0	0	108	C376 T377 F388 S399 V400 V402 I406 I409 T420 I437	C376-L386 WeakPolarHBondContact SG-CD1 3.35Å; T377-L386 CarbonylContact O-C 3.51Å; T377-L386 WeakPolarHBondContact O-CA 3.47Å; L386-F388 HydrophobicContact CD2-CE2 3.82Å; L386-F388 HydrophobicContact CD2-CZ 3.65Å; L386-F388 HydrophobicContact CG-CE2 3.97Å; L386-F388 HydrophobicContact CG-CZ 4.08Å; L386-S399 CarbonylContact O-C 3.49Å; L386-S399 WeakPolarHBondContact O-CA 3.28Å; L386-V400 PolarHBondContact N-O 2.88Å; L386-V400 PolarHBondContact O-N 3.41Å; L386-V402 HydrophobicContact CB-CG1 4.37Å; L386-I406 HydrophobicContact CB-CD1 4.2Å; L386-I406 HydrophobicContact CD1-CD1 4.1Å; L386-I409 HydrophobicContact CD1-CD1 3.68Å; L386-I409 HydrophobicContact CD1-CG1 4.04Å; L386-T420 HydrophobicContact CD1-CG2 4.14Å; L386-T420 HydrophobicContact CD2-CG2 4.46Å; L386-I437 HydrophobicContact CD2-CG2 4.37Å
387	R	98.5	Very high	97.2	Very high	37 Å²	37	33.6 Å²	33.6	14%	0.14	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.4	-177	-65.2	-177	178.3	-104.5	6.8	111.3	D357 C376 T377 T385 W389 K398	D357-R387 PolarHBondContact O-NH2 3.33Å; D357-R387 IonicContact OD1-NH1 3.55Å; C376-R387 CarbonylContact C-O 3.54Å; C376-R387 VanDerWaalsContact CA-O 3.31Å; C376-R387 WeakPolarHBondContact CA-O 3.3Å; T377-R387 PolarHBondContact N-O 2.77Å; T377-R387 PolarHBondContact O-N 3.45Å; T385-R387 PolarHBondContact OG1-NE 2.6Å; R387-W389 HydrophobicContact CB-CZ2 3.65Å; R387-W389 VanDerWaalsContact CD-CZ2 3.43Å; R387-W389 HydrophobicContact CG-CZ2 4.16Å; R387-K398 CarbonylContact C-O 3.57Å; R387-K398 WeakPolarHBondContact CA-O 3.25Å
388	F	98.5	Very high	97.1	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.013	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.1	-179.5	-64.2	-91.5	0	0	0	109.4	L374 L375 C376 L386 C396 V397 K398 W411 I418 Y434 I437	L374-F388 HydrophobicContact CD1-CB 4.17Å; L375-F388 CarbonylContact O-C 3.52Å; L375-F388 WeakPolarHBondContact O-CA 3.23Å; C376-F388 HydrophobicContact CB-CD1 4.13Å; C376-F388 HydrophobicContact CB-CE1 4.01Å; C376-F388 VanDerWaalsContact SG-CE1 3.51Å; L386-F388 HydrophobicContact CD2-CE2 3.82Å; L386-F388 HydrophobicContact CD2-CZ 3.65Å; L386-F388 HydrophobicContact CG-CE2 3.97Å; L386-F388 HydrophobicContact CG-CZ 4.08Å; F388-C396 CarbonylContact O-C 3.47Å; F388-C396 WeakPolarHBondContact O-CA 3.25Å; F388-V397 HydrophobicContact CB-CB 4.4Å; F388-V397 PolarHBondContact O-N 2.59Å; F388-K398 HydrophobicContact CB-CB 4.27Å; F388-K398 HydrophobicContact CD2-CB 3.86Å; F388-K398 HydrophobicContact CD2-CG 4.26Å; F388-K398 HydrophobicContact CG-CB 4.4Å; F388-K398 PolarHBondContact N-O 3.18Å; F388-W411 HydrophobicContact CD1-CH2 4.17Å; F388-W411 HydrophobicContact CD1-CZ2 4.31Å; F388-W411 AromaticContact CE1-CH2 3.68Å; F388-W411 HydrophobicContact CE1-CH2 3.68Å; F388-W411 AromaticContact CE1-CZ2 3.95Å; F388-W411 HydrophobicContact CE1-CZ2 3.95Å; F388-I418 HydrophobicContact CE1-CD1 3.49Å; F388-I418 VanDerWaalsContact CE1-CD1 3.49Å; F388-I418 HydrophobicContact CZ-CD1 3.51Å; F388-Y434 HydrophobicContact CD1-CE2 4.02Å; F388-Y434 AromaticContact CE1-CD2 3.93Å; F388-Y434 HydrophobicContact CE1-CD2 3.93Å; F388-Y434 AromaticContact CE1-CE2 3.83Å; F388-Y434 HydrophobicContact CE1-CE2 3.83Å; F388-Y434 HydrophobicContact CZ-CD2 4.35Å; F388-I437 HydrophobicContact CE1-CD1 4.39Å; F388-I437 HydrophobicContact CE2-CD1 3.87Å; F388-I437 HydrophobicContact CE2-CG1 3.92Å; F388-I437 HydrophobicContact CZ-CD1 3.45Å; F388-I437 VanDerWaalsContact CZ-CD1 3.45Å; F388-I437 HydrophobicContact CZ-CG1 4.06Å
389	W	98.4	Very high	97.1	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.2	-172.5	-47.8	93.3	0	0	0	110.7	L355 D357 L374 L375 T377 R387 A395 C396	L355-W389 HydrophobicContact CB-CE3 4.44Å; L355-W389 HydrophobicContact CB-CH2 4.07Å; L355-W389 HydrophobicContact CB-CZ2 4.35Å; L355-W389 HydrophobicContact CB-CZ3 4.11Å; L355-W389 HydrophobicContact CD1-CB 4.21Å; L355-W389 HydrophobicContact CD1-CD2 3.62Å; L355-W389 HydrophobicContact CD1-CE3 3.8Å; L355-W389 HydrophobicContact CD1-CG 3.79Å; L355-W389 HydrophobicContact CD1-CZ3 4.32Å; L355-W389 HydrophobicContact CD2-CE3 3.94Å; L355-W389 HydrophobicContact CD2-CZ3 4.06Å; L355-W389 HydrophobicContact CG-CE3 4.27Å; L355-W389 HydrophobicContact CG-CZ3 4.39Å; D357-W389 HydrophobicContact CB-CH2 3.84Å; D357-W389 VanDerWaalsContact OD2-CH2 3.32Å; D357-W389 WeakPolarHBondContact OD2-CH2 3.45Å; L374-W389 WeakPolarHBondContact CA-O 3.49Å; L375-W389 HydrophobicContact CB-CB 4.31Å; L375-W389 PolarHBondContact N-O 2.86Å; L375-W389 PolarHBondContact O-N 3.21Å; T377-W389 PolarHBondContact OG1-NE1 3.07Å; R387-W389 HydrophobicContact CB-CZ2 3.65Å; R387-W389 VanDerWaalsContact CD-CZ2 3.43Å; R387-W389 HydrophobicContact CG-CZ2 4.16Å; W389-A395 WeakPolarHBondContact CA-O 3.21Å; W389-C396 HydrophobicContact CD2-CB 4.48Å; W389-C396 HydrophobicContact CE3-CB 3.64Å; W389-C396 HydrophobicContact CH2-CB 4.09Å; W389-C396 HydrophobicContact CZ3-CB 3.42Å; W389-C396 VanDerWaalsContact CZ3-CB 3.42Å
390	N	97.8	Very high	97.1	Very high	51 Å²	51	41.2 Å²	41.2	27%	0.273	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	105.3	165.9	177.9	-17.1	0	0	0	109.1	N373 T392 T393 G394 A395 V397	N373-N390 CarbonylContact O-C 3.56Å; N373-N390 WeakPolarHBondContact O-CA 3.49Å; N390-T392 PolarHBondContact O-N 3.4Å; N390-T392 VanDerWaalsContact O-N 3.11Å; N390-T392 PolarHBondContact OD1-N 3.2Å; N390-T393 VanDerWaalsContact CB-OG1 3.31Å; N390-T393 WeakPolarHBondContact CB-OG1 3.36Å; N390-T393 VanDerWaalsContact CG-OG1 3.32Å; N390-T393 PolarHBondContact O-N 2.9Å; N390-T393 PolarHBondContact O-OG1 3.36Å; N390-G394 PolarHBondContact O-N 3.48Å; N390-A395 PolarHBondContact N-O 3.29Å; N390-V397 HydrophobicContact CB-CG2 4.12Å
391	A	96.5	Very high	97.1	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.6	-176.1	0	0	0	0	0	114.5	F330 V342 H353 W367 N373	F330-A391 HydrophobicContact CD2-CB 4.2Å; F330-A391 HydrophobicContact CE2-CB 4.36Å; V342-A391 HydrophobicContact CG1-CB 4.19Å; H353-A391 PolarHBondContact CD2-O 2.83Å; H353-A391 PolarHBondContact NE2-O 2.8Å; W367-A391 HydrophobicContact CH2-CB 3.7Å; W367-A391 HydrophobicContact CZ3-CB 3.61Å; N373-A391 WeakPolarHBondContact O-CB 3.48Å; N373-A391 PolarHBondContact O-N 3.09Å
392	T	95.9	Very high	97.1	Very high	67 Å²	67	42.8 Å²	42.8	41%	0.411	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-28.5	175.5	-52.2	0	0	0	0	112.4	N373 N390	N373-T392 VanDerWaalsContact CG-OG1 3.26Å; N373-T392 PolarHBondContact ND2-OG1 3.05Å; N373-T392 PolarHBondContact OD1-OG1 2.85Å; N390-T392 PolarHBondContact O-N 3.4Å; N390-T392 VanDerWaalsContact O-N 3.11Å; N390-T392 PolarHBondContact OD1-N 3.2Å
393	T	96.8	Very high	96.9	Very high	83 Å²	83	42.6 Å²	42.6	51%	0.509	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-15	-173.5	60.7	0	0	0	0	113.8	N390 A395	N390-T393 VanDerWaalsContact CB-OG1 3.31Å; N390-T393 WeakPolarHBondContact CB-OG1 3.36Å; N390-T393 VanDerWaalsContact CG-OG1 3.32Å; N390-T393 PolarHBondContact O-N 2.9Å; N390-T393 PolarHBondContact O-OG1 3.36Å; T393-A395 PolarHBondContact O-N 3.06Å; T393-A395 WeakPolarHBondContact OG1-CB 3.31Å; T393-A395 PolarHBondContact OG1-N 3.19Å
394	G	96	Very high	96.7	Very high	17 Å²	17	42 Å²	42	18%	0.175	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	-2.9	-169.6	0	0	0	0	0	114.7	H353 L355 N390	H353-G394 PolarHBondContact CE1-N 3.36Å; H353-G394 WeakPolarHBondContact ND1-CA 3.44Å; L355-G394 WeakPolarHBondContact CD2-O 3.21Å; N390-G394 PolarHBondContact O-N 3.48Å
395	A	97.6	Very high	96.7	Very high	50 Å²	50	40.4 Å²	40.4	41%	0.413	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.2	-174.7	0	0	0	0	0	112.8	W389 N390 T393 V397	W389-A395 WeakPolarHBondContact CA-O 3.21Å; N390-A395 PolarHBondContact N-O 3.29Å; T393-A395 PolarHBondContact O-N 3.06Å; T393-A395 WeakPolarHBondContact OG1-CB 3.31Å; T393-A395 PolarHBondContact OG1-N 3.19Å; A395-V397 PolarHBondContact O-N 3.04Å
396	C	97.7	Very high	96.7	Very high	50 Å²	50	39.6 Å²	39.6	34%	0.338	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	111.7	166.8	-161.6	0	0	0	0	109.4	F388 W389	F388-C396 CarbonylContact O-C 3.47Å; F388-C396 WeakPolarHBondContact O-CA 3.25Å; W389-C396 HydrophobicContact CD2-CB 4.48Å; W389-C396 HydrophobicContact CE3-CB 3.64Å; W389-C396 HydrophobicContact CH2-CB 4.09Å; W389-C396 HydrophobicContact CZ3-CB 3.42Å; W389-C396 VanDerWaalsContact CZ3-CB 3.42Å
397	V	96.8	Very high	96.7	Very high	96 Å²	96	39.7 Å²	39.7	58%	0.582	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	-36.2	-179.5	-179.1	0	0	0	0	111.2	F388 N390 A395	F388-V397 HydrophobicContact CB-CB 4.4Å; F388-V397 PolarHBondContact O-N 2.59Å; N390-V397 HydrophobicContact CB-CG2 4.12Å; A395-V397 PolarHBondContact O-N 3.04Å
398	K	96.8	Very high	96.7	Very high	68 Å²	68	38.4 Å²	38.4	30%	0.296	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	144.4	-177.5	-174.4	167.3	180	168.3	0	110.4	R387 F388 V400 P435 E436 I437	R387-K398 CarbonylContact C-O 3.57Å; R387-K398 WeakPolarHBondContact CA-O 3.25Å; F388-K398 HydrophobicContact CB-CB 4.27Å; F388-K398 HydrophobicContact CD2-CB 3.86Å; F388-K398 HydrophobicContact CD2-CG 4.26Å; F388-K398 HydrophobicContact CG-CB 4.4Å; F388-K398 PolarHBondContact N-O 3.18Å; K398-V400 HydrophobicContact CD-CG2 4.33Å; K398-V400 HydrophobicContact CG-CG2 4.07Å; K398-P435 PolarHBondContact NZ-O 2.82Å; K398-E436 PolarHBondContact NZ-O 2.88Å; K398-I437 HydrophobicContact CD-CG1 4.2Å
399	S	97.7	Very high	96.7	Very high	57 Å²	57	38.8 Å²	38.8	40%	0.399	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136.1	171.1	178.9	0	0	0	0	108.8	L386	L386-S399 CarbonylContact O-C 3.49Å; L386-S399 WeakPolarHBondContact O-CA 3.28Å
400	V	97.6	Very high	96.7	Very high	34 Å²	34	39.4 Å²	39.4	21%	0.206	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	126.4	-179.5	-176.5	0	0	0	0	108.7	T385 L386 K398 V402 I437	T385-V400 CarbonylContact C-O 3.6Å; T385-V400 WeakPolarHBondContact CA-O 3.42Å; L386-V400 PolarHBondContact N-O 2.88Å; L386-V400 PolarHBondContact O-N 3.41Å; K398-V400 HydrophobicContact CD-CG2 4.33Å; K398-V400 HydrophobicContact CG-CG2 4.07Å; V400-V402 HydrophobicContact CG1-CG1 4.39Å; V400-I437 HydrophobicContact CB-CG2 4.23Å; V400-I437 HydrophobicContact CG1-CG2 4.02Å; V400-I437 HydrophobicContact CG2-CB 4.04Å; V400-I437 HydrophobicContact CG2-CG1 4.22Å; V400-I437 HydrophobicContact CG2-CG2 4.01Å
401	D	96.6	Very high	96.7	Very high	99 Å²	99	37.7 Å²	37.7	53%	0.529	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.3	170.2	-178.3	4.2	0	0	0	109.9	H384 V403	H384-D401 WeakPolarHBondContact CB-OD1 3.41Å; D401-V403 PolarHBondContact OD1-N 3.29Å
402	V	94.5	Very high	96.7	Very high	8 Å²	8	37.7 Å²	37.7	5%	0.048	23%	0.231	C	C	.	.			trans	-111.4	10.7	178.7	-59.9	0	0	0	0	113	H384 L386 V400 A404 I406 W432	H384-V402 WeakPolarHBondContact O-CG2 3.24Å; H384-V402 PolarHBondContact O-N 3.41Å; L386-V402 HydrophobicContact CB-CG1 4.37Å; V400-V402 HydrophobicContact CG1-CG1 4.39Å; V402-A404 PolarHBondContact O-N 3.19Å; V402-I406 HydrophobicContact CG2-CD1 3.59Å; V402-I406 HydrophobicContact CG2-CG1 3.67Å; V402-W432 HydrophobicContact CB-CH2 4.06Å; V402-W432 HydrophobicContact CB-CZ2 3.9Å; V402-W432 HydrophobicContact CG1-CH2 3.63Å; V402-W432 HydrophobicContact CG1-CZ2 3.53Å; V402-W432 HydrophobicContact CG1-CZ3 4.39Å
403	V	91.6	Very high	96.6	Very high	92 Å²	92	36.7 Å²	36.7	56%	0.558	23%	0.225	S	C	*	.	S	Bend	trans	66.5	5.5	166.2	-164	0	0	0	0	115.1	D401	D401-V403 PolarHBondContact OD1-N 3.29Å
404	A	93.4	Very high	96.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-149.8	158	176.1	0	0	0	0	0	112	H384 V402 I406 H422 L426	H384-A404 VanDerWaalsContact ND1-C 3.27Å; V402-A404 PolarHBondContact O-N 3.19Å; A404-I406 PolarHBondContact O-N 3.31Å; A404-H422 HydrophobicContact CB-CB 3.99Å; A404-L426 HydrophobicContact CB-CB 4.13Å; A404-L426 HydrophobicContact CB-CD1 3.72Å; A404-L426 HydrophobicContact CB-CG 3.95Å
405	Q	96.4	Very high	96.2	Very high	15 Å²	15	39 Å²	39	7%	0.07	22%	0.223	C	C	.	.			trans	-53.4	132	171.9	167.7	167.4	62.1	0	0	110.3	F187 T381 H384 H422 G423	F187-Q405 VanDerWaalsContact CD2-CD 3.42Å; F187-Q405 HydrophobicContact CD2-CG 4.09Å; F187-Q405 HydrophobicContact CE2-CG 3.57Å; F187-Q405 HydrophobicContact CZ-CG 4.22Å; T381-Q405 VanDerWaalsContact OG1-CD 3.24Å; T381-Q405 PolarHBondContact OG1-NE2 3.19Å; T381-Q405 PolarHBondContact OG1-OE1 3.47Å; H384-Q405 PolarHBondContact ND1-N 3.03Å; Q405-H422 WeakPolarHBondContact O-CA 3.4Å; Q405-G423 PolarHBondContact O-N 3.21Å; Q405-G423 VanDerWaalsContact O-N 3.11Å
406	I	98	Very high	96.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.2	176.9	-52.7	162.3	0	0	0	108.6	A364 G378 G379 T385 L386 V402 A404 I409 S421	A364-I406 HydrophobicContact CB-CB 4.18Å; A364-I406 HydrophobicContact CB-CG2 3.56Å; G378-I406 VanDerWaalsContact CA-CD1 3.43Å; G379-I406 PolarHBondContact O-N 2.62Å; T385-I406 WeakPolarHBondContact O-CD1 3.23Å; L386-I406 HydrophobicContact CB-CD1 4.2Å; L386-I406 HydrophobicContact CD1-CD1 4.1Å; V402-I406 HydrophobicContact CG2-CD1 3.59Å; V402-I406 HydrophobicContact CG2-CG1 3.67Å; A404-I406 PolarHBondContact O-N 3.31Å; I406-I409 HydrophobicContact CG2-CD1 4.47Å; I406-I409 HydrophobicContact CG2-CG1 4.08Å; I406-S421 WeakPolarHBondContact CA-O 3.45Å
407	S	97.5	Very high	96.1	Very high	2 Å²	2	42 Å²	42	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-20.7	-179.9	54.8	0	0	0	0	114	K363 S421 V449	K363-S407 VanDerWaalsContact CE-O 3.3Å; K363-S407 WeakPolarHBondContact CE-O 3.06Å; S407-S421 PolarHBondContact N-O 2.66Å; S407-S421 WeakPolarHBondContact OG-CB 3.08Å; S407-S421 PolarHBondContact OG-O 3.03Å; S407-S421 PolarHBondContact OG-OG 2.84Å; S407-V449 WeakPolarHBondContact CB-O 3.39Å; S407-V449 PolarHBondContact OG-O 2.86Å
408	G	97.9	Very high	96.1	Very high	9 Å²	9	37.4 Å²	37.4	9%	0.093	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	155	-179.5	0	0	0	0	0	112.6	T420 S421 I452	G408-T420 WeakPolarHBondContact O-CA 3.45Å; G408-S421 WeakPolarHBondContact CA-OG 3.31Å; G408-S421 PolarHBondContact N-OG 3.26Å; G408-S421 PolarHBondContact O-N 3.12Å; G408-I452 VanDerWaalsContact C-CD1 3.47Å
409	I	98.5	Very high	96.2	Very high	11 Å²	11	34.1 Å²	34.1	6%	0.056	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125.3	179.3	-65.4	157.6	0	0	0	108.5	A364 S366 C376 L386 I406 I418 L419 T420	A364-I409 HydrophobicContact CB-CD1 3.79Å; A364-I409 HydrophobicContact CB-CG1 3.98Å; S366-I409 VanDerWaalsContact CB-O 3.27Å; S366-I409 WeakPolarHBondContact CB-O 3.44Å; S366-I409 PolarHBondContact OG-O 3.05Å; C376-I409 HydrophobicContact CB-CG2 4.4Å; L386-I409 HydrophobicContact CD1-CD1 3.68Å; L386-I409 HydrophobicContact CD1-CG1 4.04Å; I406-I409 HydrophobicContact CG2-CD1 4.47Å; I406-I409 HydrophobicContact CG2-CG1 4.08Å; I409-I418 HydrophobicContact CG2-CG2 3.72Å; I409-L419 WeakPolarHBondContact CA-O 3.24Å; I409-T420 HydrophobicContact CG1-CG2 4.19Å
410	I	98.3	Very high	96.2	Very high	18 Å²	18	31.4 Å²	31.4	9%	0.092	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.1	171.4	-68.6	170.2	0	0	0	108.7	I418 L419 I452 V461	I410-I418 CarbonylContact O-C 3.45Å; I410-I418 WeakPolarHBondContact O-CA 3.23Å; I410-L419 HydrophobicContact CB-CB 4.48Å; I410-L419 PolarHBondContact N-O 2.99Å; I410-L419 PolarHBondContact O-N 2.85Å; I410-I452 HydrophobicContact CB-CD1 4.38Å; I410-I452 HydrophobicContact CD1-CB 3.88Å; I410-I452 HydrophobicContact CD1-CD1 3.7Å; I410-I452 HydrophobicContact CD1-CG1 3.73Å; I410-I452 HydrophobicContact CG1-CD1 3.67Å; I410-I452 HydrophobicContact CG1-CG1 3.97Å; I410-V461 HydrophobicContact CD1-CG1 3.89Å; I410-V461 HydrophobicContact CD1-CG2 4.27Å
411	W	98.1	Very high	96.2	Very high	14 Å²	14	29.8 Å²	29.8	5%	0.053	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.7	168.2	-68.5	94.3	0	0	0	109.6	S366 W367 C368 P369 W370 L374 C376 F388 I418 Y434	S366-W411 PolarHBondContact O-NE1 2.63Å; S366-W411 VanDerWaalsContact O-NE1 3.16Å; S366-W411 VanDerWaalsContact OG-CD1 3.28Å; W367-W411 PolarHBondContact O-NE1 2.98Å; C368-W411 HydrophobicContact CB-CD2 4.31Å; C368-W411 HydrophobicContact CB-CH2 4.01Å; C368-W411 HydrophobicContact CB-CZ2 3.71Å; C368-W411 HydrophobicContact CB-CZ3 4.44Å; P369-W411 VanDerWaalsContact CD-CB 3.47Å; P369-W411 HydrophobicContact CG-CB 3.92Å; W370-W411 HydrophobicContact CH2-CB 4.43Å; W370-W411 HydrophobicContact CH2-CD2 4.36Å; W370-W411 AromaticContact CH2-CE3 3.41Å; W370-W411 HydrophobicContact CH2-CE3 3.41Å; W370-W411 VanDerWaalsContact CH2-CE3 3.41Å; W370-W411 AromaticContact CH2-CZ3 3.98Å; W370-W411 HydrophobicContact CH2-CZ3 3.98Å; W370-W411 AromaticContact CZ2-CE3 3.63Å; W370-W411 HydrophobicContact CZ2-CE3 3.63Å; W370-W411 AromaticContact CZ2-CZ3 3.69Å; W370-W411 HydrophobicContact CZ2-CZ3 3.69Å; W370-W411 HydrophobicContact CZ3-CB 4.34Å; W370-W411 HydrophobicContact CZ3-CE3 4.28Å; L374-W411 HydrophobicContact CD2-CH2 3.94Å; L374-W411 HydrophobicContact CD2-CZ2 4.33Å; C376-W411 HydrophobicContact CB-CZ2 3.69Å; F388-W411 HydrophobicContact CD1-CH2 4.17Å; F388-W411 HydrophobicContact CD1-CZ2 4.31Å; F388-W411 AromaticContact CE1-CH2 3.68Å; F388-W411 HydrophobicContact CE1-CH2 3.68Å; F388-W411 AromaticContact CE1-CZ2 3.95Å; F388-W411 HydrophobicContact CE1-CZ2 3.95Å; W411-I418 HydrophobicContact CD2-CD1 4.42Å; W411-I418 HydrophobicContact CD2-CG1 3.96Å; W411-I418 HydrophobicContact CE3-CD1 3.95Å; W411-I418 HydrophobicContact CE3-CG1 3.45Å; W411-I418 VanDerWaalsContact CE3-CG1 3.45Å; W411-I418 HydrophobicContact CH2-CD1 3.6Å; W411-I418 HydrophobicContact CH2-CG1 4.08Å; W411-I418 HydrophobicContact CZ2-CD1 4.07Å; W411-I418 HydrophobicContact CZ2-CG1 4.5Å; W411-I418 HydrophobicContact CZ3-CD1 3.52Å; W411-I418 HydrophobicContact CZ3-CG1 3.52Å; W411-Y434 AromaticContact CH2-CD2 3.68Å; W411-Y434 HydrophobicContact CH2-CD2 3.68Å; W411-Y434 AromaticContact CH2-CE2 3.69Å; W411-Y434 HydrophobicContact CH2-CE2 3.69Å; W411-Y434 HydrophobicContact CH2-CG 4.22Å; W411-Y434 HydrophobicContact CZ3-CD1 4.1Å; W411-Y434 AromaticContact CZ3-CD2 3.63Å; W411-Y434 HydrophobicContact CZ3-CD2 3.63Å; W411-Y434 HydrophobicContact CZ3-CE1 4.43Å; W411-Y434 HydrophobicContact CZ3-CE2 4.02Å; W411-Y434 AromaticContact CZ3-CG 3.7Å; W411-Y434 HydrophobicContact CZ3-CG 3.7Å
412	N	96.9	Very high	96.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.5	170.3	175.7	-95.2	0	0	0	109.8	W370 E414 Y415 R416 E417 E458 F476	W370-N412 WeakPolarHBondContact CH2-O 3.4Å; W370-N412 WeakPolarHBondContact CZ3-O 3.38Å; N412-E414 PolarHBondContact OD1-N 2.96Å; N412-Y415 WeakPolarHBondContact OD1-CD2 3.39Å; N412-Y415 PolarHBondContact OD1-N 2.9Å; N412-R416 VanDerWaalsContact O-CA 3.29Å; N412-R416 WeakPolarHBondContact O-CA 3.24Å; N412-R416 PolarHBondContact O-N 3.11Å; N412-E417 PolarHBondContact N-O 3.28Å; N412-E417 PolarHBondContact O-N 2.91Å; N412-E458 PolarHBondContact ND2-O 2.8Å; N412-F476 HydrophobicContact CB-CD1 3.9Å; N412-F476 HydrophobicContact CB-CD2 4.14Å; N412-F476 HydrophobicContact CB-CE1 3.72Å; N412-F476 HydrophobicContact CB-CE2 3.98Å; N412-F476 HydrophobicContact CB-CG 4.11Å; N412-F476 HydrophobicContact CB-CZ 3.76Å; N412-F476 WeakPolarHBondContact ND2-CB 3.48Å; N412-F476 WeakPolarHBondContact ND2-CG 3.47Å
413	T	94.2	Very high	96.2	Very high	46 Å²	46	24.8 Å²	24.8	28%	0.282	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-33.8	-175.7	62.1	0	0	0	0	113	P369 W370 E458	P369-T413 HydrophobicContact CB-CG2 4Å; P369-T413 HydrophobicContact CG-CG2 3.58Å; W370-T413 HydrophobicContact CE3-CG2 4.04Å; W370-T413 HydrophobicContact CZ3-CG2 4.12Å; T413-E458 VanDerWaalsContact CB-OE2 3.31Å; T413-E458 WeakPolarHBondContact CB-OE2 3.45Å; T413-E458 WeakPolarHBondContact CG2-OE2 3.47Å; T413-E458 PolarHBondContact N-OE2 2.56Å; T413-E458 PolarHBondContact OG1-OE2 2.72Å
414	E	91.8	Very high	96	Very high	73 Å²	73	23.7 Å²	23.7	34%	0.341	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-49	-173.7	-62.6	-64.3	139.6	0	0	112.1	N412 V478 K483	N412-E414 PolarHBondContact OD1-N 2.96Å; E414-V478 HydrophobicContact CB-CG2 4.04Å; E414-V478 HydrophobicContact CG-CG2 3.72Å; E414-K483 IonicContact OE1-NZ 3.54Å; E414-K483 PolarHBondContact OE1-NZ 3.05Å; E414-K483 IonicContact OE2-NZ 3.35Å; E414-K483 PolarHBondContact OE2-NZ 2.8Å
415	Y	93.1	Very high	95.9	Very high	77 Å²	77	28.4 Å²	28.4	30%	0.302	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-6.8	-178.7	-64.5	-72.9	0	0	0	113.6	R168 N412 F476 Q477	R168-Y415 VanDerWaalsContact CD-CE1 3.46Å; R168-Y415 WeakPolarHBondContact CD-OH 3.36Å; N412-Y415 WeakPolarHBondContact OD1-CD2 3.39Å; N412-Y415 PolarHBondContact OD1-N 2.9Å; Y415-F476 HydrophobicContact CD2-CB 4.32Å; Y415-F476 AromaticContact CD2-CD1 3.88Å; Y415-F476 HydrophobicContact CD2-CD1 3.88Å; Y415-F476 HydrophobicContact CE2-CB 4.3Å; Y415-Q477 PolarHBondContact OH-O 3.04Å
416	R	94.8	Very high	95.8	Very high	146 Å²	146	31 Å²	31	55%	0.551	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	55.2	-170.2	-62	-175.3	173.9	-155.4	-3.3	111.2	W370 N412 Y434	W370-R416 HydrophobicContact CH2-CB 4.21Å; W370-R416 HydrophobicContact CH2-CG 4.4Å; W370-R416 HydrophobicContact CZ2-CB 4.01Å; W370-R416 HydrophobicContact CZ2-CG 4.2Å; N412-R416 VanDerWaalsContact O-CA 3.29Å; N412-R416 WeakPolarHBondContact O-CA 3.24Å; N412-R416 PolarHBondContact O-N 3.11Å; R416-Y434 WeakPolarHBondContact O-CB 3.49Å; R416-Y434 PolarHBondContact O-N 2.78Å
417	E	97.2	Very high	95.6	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.07	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	165.7	-177.6	-71	178.4	178.6	0	0	110.6	R168 N412 I431 W432 F476	R168-E417 IonicContact CZ-OE1 2.64Å; R168-E417 IonicContact CZ-OE2 3.74Å; R168-E417 VanDerWaalsContact CZ-OE2 3.26Å; R168-E417 IonicContact NH1-OE1 2.96Å; R168-E417 PolarHBondContact NH1-OE1 3.42Å; R168-E417 IonicContact NH1-OE2 3.22Å; R168-E417 PolarHBondContact NH1-OE2 2.84Å; R168-E417 IonicContact NH2-OE1 3.74Å; R168-E417 IonicContact NH2-OE2 3.81Å; R168-E417 PolarHBondContact NH2-OE2 3.46Å; N412-E417 PolarHBondContact N-O 3.28Å; N412-E417 PolarHBondContact O-N 2.91Å; E417-I431 HydrophobicContact CB-CG2 4.18Å; E417-I431 HydrophobicContact CG-CG2 4.49Å; E417-I431 WeakPolarHBondContact OE2-CG2 3.39Å; E417-W432 CarbonylContact C-O 3.53Å; E417-W432 VanDerWaalsContact CA-O 3.28Å; E417-W432 WeakPolarHBondContact CA-O 3.38Å; E417-W432 WeakPolarHBondContact CB-O 3.42Å; E417-F476 HydrophobicContact CB-CE1 4.24Å
418	I	97.8	Very high	95.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.5	175.2	-59.2	171.3	0	0	0	107.3	F388 I409 I410 W411 T420 I431 W432 Y434 I437	F388-I418 HydrophobicContact CE1-CD1 3.49Å; F388-I418 VanDerWaalsContact CE1-CD1 3.49Å; F388-I418 HydrophobicContact CZ-CD1 3.51Å; I409-I418 HydrophobicContact CG2-CG2 3.72Å; I410-I418 CarbonylContact O-C 3.45Å; I410-I418 WeakPolarHBondContact O-CA 3.23Å; W411-I418 HydrophobicContact CD2-CD1 4.42Å; W411-I418 HydrophobicContact CD2-CG1 3.96Å; W411-I418 HydrophobicContact CE3-CD1 3.95Å; W411-I418 HydrophobicContact CE3-CG1 3.45Å; W411-I418 VanDerWaalsContact CE3-CG1 3.45Å; W411-I418 HydrophobicContact CH2-CD1 3.6Å; W411-I418 HydrophobicContact CH2-CG1 4.08Å; W411-I418 HydrophobicContact CZ2-CD1 4.07Å; W411-I418 HydrophobicContact CZ2-CG1 4.5Å; W411-I418 HydrophobicContact CZ3-CD1 3.52Å; W411-I418 HydrophobicContact CZ3-CG1 3.52Å; I418-T420 HydrophobicContact CG2-CG2 3.99Å; I418-I431 CarbonylContact O-C 3.6Å; I418-I431 WeakPolarHBondContact O-CA 3.46Å; I418-W432 HydrophobicContact CB-CB 4.48Å; I418-W432 PolarHBondContact N-O 3.33Å; I418-W432 PolarHBondContact O-N 3.11Å; I418-Y434 HydrophobicContact CD1-CD2 3.92Å; I418-Y434 HydrophobicContact CD1-CG 4.46Å; I418-I437 HydrophobicContact CD1-CD1 3.95Å
419	L	98.3	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.4	165.5	-176.8	149.2	0	0	0	108.7	I409 I410 L429 V430 I431 I452 V461 F476	I409-L419 WeakPolarHBondContact CA-O 3.24Å; I410-L419 HydrophobicContact CB-CB 4.48Å; I410-L419 PolarHBondContact N-O 2.99Å; I410-L419 PolarHBondContact O-N 2.85Å; L419-L429 HydrophobicContact CD1-CB 4.46Å; L419-L429 HydrophobicContact CD1-CD1 4.41Å; L419-L429 HydrophobicContact CD2-CB 4.34Å; L419-L429 HydrophobicContact CD2-CD1 4.43Å; L419-L429 HydrophobicContact CD2-CD2 4.28Å; L419-L429 HydrophobicContact CG-CB 4.44Å; L419-V430 CarbonylContact C-O 3.45Å; L419-V430 WeakPolarHBondContact CA-O 3.31Å; L419-I431 HydrophobicContact CB-CG1 4.46Å; L419-I431 HydrophobicContact CD1-CD1 4.36Å; L419-I431 HydrophobicContact CD1-CG1 4Å; L419-I431 HydrophobicContact CG-CG1 4.34Å; L419-I452 HydrophobicContact CD2-CD1 3.66Å; L419-V461 HydrophobicContact CD1-CB 4.31Å; L419-V461 HydrophobicContact CD1-CG1 4.13Å; L419-V461 HydrophobicContact CD1-CG2 4.15Å; L419-V461 HydrophobicContact CD2-CG1 4.15Å; L419-F476 HydrophobicContact CB-CE2 4.33Å; L419-F476 HydrophobicContact CB-CZ 4.1Å; L419-F476 HydrophobicContact CD1-CE2 4.24Å; L419-F476 HydrophobicContact CD1-CZ 4.41Å
420	T	98.3	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	140.7	173.2	57.8	0	0	0	0	110.2	L386 G408 I409 I418 H422 L429 V430 W432	L386-T420 HydrophobicContact CD1-CG2 4.14Å; L386-T420 HydrophobicContact CD2-CG2 4.46Å; G408-T420 WeakPolarHBondContact O-CA 3.45Å; I409-T420 HydrophobicContact CG1-CG2 4.19Å; I418-T420 HydrophobicContact CG2-CG2 3.99Å; T420-H422 PolarHBondContact OG1-CE1 2.81Å; T420-H422 PolarHBondContact OG1-NE2 2.99Å; T420-L429 CarbonylContact O-C 3.46Å; T420-L429 VanDerWaalsContact O-CA 3.28Å; T420-L429 WeakPolarHBondContact O-CA 3.46Å; T420-V430 PolarHBondContact N-O 2.98Å; T420-V430 PolarHBondContact O-N 2.94Å; T420-W432 PolarHBondContact OG1-NE1 2.81Å
421	S	97.7	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.1	171.1	57	0	0	0	0	111.2	I406 S407 G408 L429	I406-S421 WeakPolarHBondContact CA-O 3.45Å; S407-S421 PolarHBondContact N-O 2.66Å; S407-S421 WeakPolarHBondContact OG-CB 3.08Å; S407-S421 PolarHBondContact OG-O 3.03Å; S407-S421 PolarHBondContact OG-OG 2.84Å; G408-S421 WeakPolarHBondContact CA-OG 3.31Å; G408-S421 PolarHBondContact N-OG 3.26Å; G408-S421 PolarHBondContact O-N 3.12Å; S421-L429 VanDerWaalsContact CB-CD2 3.44Å
422	H	97.6	Very high	95.4	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.3	-174.7	-57.4	-83.2	0	0	0	112.8	A404 Q405 T420 Q428 V449	A404-H422 HydrophobicContact CB-CB 3.99Å; Q405-H422 WeakPolarHBondContact O-CA 3.4Å; T420-H422 PolarHBondContact OG1-CE1 2.81Å; T420-H422 PolarHBondContact OG1-NE2 2.99Å; H422-Q428 HydrophobicContact CB-CG 4.39Å; H422-Q428 WeakPolarHBondContact CB-O 3.47Å; H422-Q428 PolarHBondContact CD2-O 2.84Å; H422-Q428 VanDerWaalsContact CD2-O 3.3Å; H422-Q428 PolarHBondContact N-O 2.84Å; H422-V449 PolarHBondContact O-N 2.78Å
423	G	92.6	Very high	95.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.186	C	C	.	.			trans	-87.7	-150.9	167.7	0	0	0	0	0	112.5	Q405 L426 K427	Q405-G423 PolarHBondContact O-N 3.21Å; Q405-G423 VanDerWaalsContact O-N 3.11Å; G423-L426 PolarHBondContact O-N 3.28Å; G423-K427 PolarHBondContact O-N 2.53Å
424	D	88.5	Confident	95.5	Very high	69 Å²	69	38.2 Å²	38.2	37%	0.369	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	144.9	174.5	-64.5	-60	0	0	0	111.7	K427	D424-K427 WeakPolarHBondContact OD1-CE 3.48Å; D424-K427 IonicContact OD1-NZ 3.79Å
425	P	91.2	Very high	95.7	Very high	98 Å²	98	37.8 Å²	37.8	64%	0.636	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.7	-6.8	2.9	35.1	-35.1	0	0	0	114.3
426	L	92.6	Very high	95.8	Very high	71 Å²	71	39 Å²	39	37%	0.372	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-28.9	-166.1	-61.9	177.2	0	0	0	114.6	A404 G423 Q428	A404-L426 HydrophobicContact CB-CB 4.13Å; A404-L426 HydrophobicContact CB-CD1 3.72Å; A404-L426 HydrophobicContact CB-CG 3.95Å; G423-L426 PolarHBondContact O-N 3.28Å; L426-Q428 HydrophobicContact CB-CG 3.92Å; L426-Q428 VanDerWaalsContact CD1-NE2 3.26Å; L426-Q428 PolarHBondContact O-N 3.14Å
427	K	94.9	Very high	95.8	Very high	72 Å²	72	32.7 Å²	32.7	31%	0.313	17%	0.167	S	C	.	.			trans	47.1	55.2	174.6	-57.4	179.3	-176.8	-178.7	0	113.3	G423 D424 H445 Q446 G447	G423-K427 PolarHBondContact O-N 2.53Å; D424-K427 WeakPolarHBondContact OD1-CE 3.48Å; D424-K427 IonicContact OD1-NZ 3.79Å; K427-H445 WeakPolarHBondContact O-CA 3.32Å; K427-H445 WeakPolarHBondContact O-CB 3.32Å; K427-H445 PolarHBondContact O-N 3.42Å; K427-Q446 WeakPolarHBondContact CD-O 3.32Å; K427-Q446 PolarHBondContact NZ-O 3.49Å; K427-G447 WeakPolarHBondContact CB-O 3.17Å
428	Q	96.4	Very high	95.7	Very high	18 Å²	18	35.5 Å²	35.5	8%	0.084	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161.3	-172.7	61.9	-178.9	-19.5	0	0	111.1	H422 L426 V430 H442 L443	H422-Q428 HydrophobicContact CB-CG 4.39Å; H422-Q428 WeakPolarHBondContact CB-O 3.47Å; H422-Q428 PolarHBondContact CD2-O 2.84Å; H422-Q428 VanDerWaalsContact CD2-O 3.3Å; H422-Q428 PolarHBondContact N-O 2.84Å; L426-Q428 HydrophobicContact CB-CG 3.92Å; L426-Q428 VanDerWaalsContact CD1-NE2 3.26Å; L426-Q428 PolarHBondContact O-N 3.14Å; Q428-V430 HydrophobicContact CG-CG2 3.78Å; Q428-H442 PolarHBondContact OE1-CD2 3.31Å; Q428-L443 CarbonylContact C-O 3.52Å; Q428-L443 WeakPolarHBondContact CA-O 3.36Å; Q428-L443 WeakPolarHBondContact CB-O 3.45Å
429	L	97.7	Very high	95.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.7	156.8	-49.5	178.5	0	0	0	108.5	L419 T420 S421 H442 L443 V449 I452 W473	L419-L429 HydrophobicContact CD1-CB 4.46Å; L419-L429 HydrophobicContact CD1-CD1 4.41Å; L419-L429 HydrophobicContact CD2-CB 4.34Å; L419-L429 HydrophobicContact CD2-CD1 4.43Å; L419-L429 HydrophobicContact CD2-CD2 4.28Å; L419-L429 HydrophobicContact CG-CB 4.44Å; T420-L429 CarbonylContact O-C 3.46Å; T420-L429 VanDerWaalsContact O-CA 3.28Å; T420-L429 WeakPolarHBondContact O-CA 3.46Å; S421-L429 VanDerWaalsContact CB-CD2 3.44Å; L429-H442 CarbonylContact O-C 3.05Å; L429-H442 WeakPolarHBondContact O-CA 3.5Å; L429-L443 HydrophobicContact CB-CB 4.15Å; L429-L443 HydrophobicContact CB-CD1 4.41Å; L429-L443 HydrophobicContact CD1-CD1 4.3Å; L429-L443 PolarHBondContact N-O 2.89Å; L429-L443 PolarHBondContact O-N 2.89Å; L429-V449 HydrophobicContact CD2-CG1 4.08Å; L429-V449 HydrophobicContact CD2-CG2 4.2Å; L429-I452 HydrophobicContact CD2-CG2 3.92Å; L429-W473 HydrophobicContact CD1-CD2 4.49Å; L429-W473 HydrophobicContact CD1-CG 4.23Å
430	V	97.6	Very high	95.5	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.2	175.1	-173.9	0	0	0	0	109.6	L419 T420 Q428 W432 K439 T441 H442	L419-V430 CarbonylContact C-O 3.45Å; L419-V430 WeakPolarHBondContact CA-O 3.31Å; T420-V430 PolarHBondContact N-O 2.98Å; T420-V430 PolarHBondContact O-N 2.94Å; Q428-V430 HydrophobicContact CG-CG2 3.78Å; V430-W432 HydrophobicContact CB-CZ2 3.72Å; V430-W432 HydrophobicContact CG1-CD2 3.88Å; V430-W432 HydrophobicContact CG1-CE3 4.35Å; V430-W432 HydrophobicContact CG1-CG 4.49Å; V430-W432 HydrophobicContact CG1-CH2 3.88Å; V430-W432 HydrophobicContact CG1-CZ2 3.33Å; V430-W432 HydrophobicContact CG1-CZ3 4.35Å; V430-W432 HydrophobicContact CG2-CZ2 4.28Å; V430-W432 PolarHBondContact O-NE1 2.96Å; V430-K439 HydrophobicContact CG1-CD 3.96Å; V430-K439 HydrophobicContact CG1-CG 3.72Å; V430-T441 WeakPolarHBondContact CG1-O 3.43Å; V430-H442 HydrophobicContact CG2-CB 4.31Å
431	I	97.6	Very high	95.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.9	174.2	-59.5	179.5	0	0	0	108.5	I170 E417 I418 L419 V440 T441 C475 F476	I170-I431 HydrophobicContact CD1-CD1 4.37Å; I170-I431 HydrophobicContact CG2-CD1 4.49Å; E417-I431 HydrophobicContact CB-CG2 4.18Å; E417-I431 HydrophobicContact CG-CG2 4.49Å; E417-I431 WeakPolarHBondContact OE2-CG2 3.39Å; I418-I431 CarbonylContact O-C 3.6Å; I418-I431 WeakPolarHBondContact O-CA 3.46Å; L419-I431 HydrophobicContact CB-CG1 4.46Å; L419-I431 HydrophobicContact CD1-CD1 4.36Å; L419-I431 HydrophobicContact CD1-CG1 4Å; L419-I431 HydrophobicContact CG-CG1 4.34Å; I431-V440 HydrophobicContact CB-CB 4.3Å; I431-V440 HydrophobicContact CG2-CB 4.09Å; I431-V440 HydrophobicContact CG2-CG2 4.31Å; I431-V440 WeakPolarHBondContact O-CB 3.36Å; I431-V440 PolarHBondContact O-N 2.93Å; I431-T441 HydrophobicContact CB-CG2 4.07Å; I431-T441 HydrophobicContact CD1-CG2 3.8Å; I431-T441 HydrophobicContact CG1-CG2 4.08Å; I431-T441 PolarHBondContact N-O 3.04Å; I431-T441 VanDerWaalsContact N-O 3.08Å; I431-C475 HydrophobicContact CD1-CB 3.71Å; I431-F476 HydrophobicContact CD1-CE1 4.19Å; I431-F476 HydrophobicContact CD1-CZ 4.16Å; I431-F476 HydrophobicContact CG1-CZ 4.42Å; I431-F476 HydrophobicContact CG2-CE1 4.13Å; I431-F476 HydrophobicContact CG2-CZ 4.41Å
432	W	97.4	Very high	95.2	Very high	26 Å²	26	47.5 Å²	47.5	10%	0.098	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.3	-177.6	-48.2	88.6	0	0	0	110.3	V402 E417 I418 T420 V430 I437 T438 K439	V402-W432 HydrophobicContact CB-CH2 4.06Å; V402-W432 HydrophobicContact CB-CZ2 3.9Å; V402-W432 HydrophobicContact CG1-CH2 3.63Å; V402-W432 HydrophobicContact CG1-CZ2 3.53Å; V402-W432 HydrophobicContact CG1-CZ3 4.39Å; E417-W432 CarbonylContact C-O 3.53Å; E417-W432 VanDerWaalsContact CA-O 3.28Å; E417-W432 WeakPolarHBondContact CA-O 3.38Å; E417-W432 WeakPolarHBondContact CB-O 3.42Å; I418-W432 HydrophobicContact CB-CB 4.48Å; I418-W432 PolarHBondContact N-O 3.33Å; I418-W432 PolarHBondContact O-N 3.11Å; T420-W432 PolarHBondContact OG1-NE1 2.81Å; V430-W432 HydrophobicContact CB-CZ2 3.72Å; V430-W432 HydrophobicContact CG1-CD2 3.88Å; V430-W432 HydrophobicContact CG1-CE3 4.35Å; V430-W432 HydrophobicContact CG1-CG 4.49Å; V430-W432 HydrophobicContact CG1-CH2 3.88Å; V430-W432 HydrophobicContact CG1-CZ2 3.33Å; V430-W432 HydrophobicContact CG1-CZ3 4.35Å; V430-W432 HydrophobicContact CG2-CZ2 4.28Å; V430-W432 PolarHBondContact O-NE1 2.96Å; W432-I437 HydrophobicContact CB-CG2 4.27Å; W432-I437 HydrophobicContact CD2-CG2 4.13Å; W432-I437 HydrophobicContact CE3-CG2 3.85Å; W432-I437 HydrophobicContact CG-CG2 4.32Å; W432-T438 WeakPolarHBondContact CA-O 3.4Å; W432-K439 HydrophobicContact CE3-CB 4.12Å; W432-K439 HydrophobicContact CZ3-CB 3.93Å
433	K	96.3	Very high	95.2	Very high	106 Å²	106	47.4 Å²	47.4	46%	0.461	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.2	169.4	-170.2	173.2	-179.4	177.2	0	110.3	I437 T438 V440	K433-I437 WeakPolarHBondContact O-CA 3.28Å; K433-I437 PolarHBondContact O-N 3.01Å; K433-T438 WeakPolarHBondContact CB-OG1 3.46Å; K433-T438 PolarHBondContact N-O 3.05Å; K433-V440 HydrophobicContact CB-CG2 4.07Å
434	Y	96.4	Very high	95.2	Very high	28 Å²	28	53.7 Å²	53.7	11%	0.11	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	139.9	173.1	177.1	-86.7	0	0	0	109.9	W370 K371 L374 F388 W411 R416 I418 I437	W370-Y434 HydrophobicContact CZ2-CD1 4.12Å; K371-Y434 PolarHBondContact NZ-OH 3.09Å; K371-Y434 VanDerWaalsContact NZ-OH 3.12Å; L374-Y434 HydrophobicContact CD2-CE2 4.06Å; L374-Y434 WeakPolarHBondContact CD2-OH 3.36Å; F388-Y434 HydrophobicContact CD1-CE2 4.02Å; F388-Y434 AromaticContact CE1-CD2 3.93Å; F388-Y434 HydrophobicContact CE1-CD2 3.93Å; F388-Y434 AromaticContact CE1-CE2 3.83Å; F388-Y434 HydrophobicContact CE1-CE2 3.83Å; F388-Y434 HydrophobicContact CZ-CD2 4.35Å; W411-Y434 AromaticContact CH2-CD2 3.68Å; W411-Y434 HydrophobicContact CH2-CD2 3.68Å; W411-Y434 AromaticContact CH2-CE2 3.69Å; W411-Y434 HydrophobicContact CH2-CE2 3.69Å; W411-Y434 HydrophobicContact CH2-CG 4.22Å; W411-Y434 HydrophobicContact CZ3-CD1 4.1Å; W411-Y434 AromaticContact CZ3-CD2 3.63Å; W411-Y434 HydrophobicContact CZ3-CD2 3.63Å; W411-Y434 HydrophobicContact CZ3-CE1 4.43Å; W411-Y434 HydrophobicContact CZ3-CE2 4.02Å; W411-Y434 AromaticContact CZ3-CG 3.7Å; W411-Y434 HydrophobicContact CZ3-CG 3.7Å; R416-Y434 WeakPolarHBondContact O-CB 3.49Å; R416-Y434 PolarHBondContact O-N 2.78Å; I418-Y434 HydrophobicContact CD1-CD2 3.92Å; I418-Y434 HydrophobicContact CD1-CG 4.46Å; Y434-I437 HydrophobicContact CD2-CD1 4.01Å
435	P	95.2	Very high	95.4	Very high	63 Å²	63	51.1 Å²	51.1	41%	0.409	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.4	-5.3	9.6	36.2	-37.3	0	0	0	115.9	K398 I437	K398-P435 PolarHBondContact NZ-O 2.82Å; P435-I437 VanDerWaalsContact C-N 3.25Å; P435-I437 PolarHBondContact O-N 2.92Å
436	E	94.9	Very high	95.4	Very high	104 Å²	104	53.3 Å²	53.3	49%	0.486	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-22.7	-172.7	-62.9	73.9	-153	0	0	113.2	K398 T438	K398-E436 PolarHBondContact NZ-O 2.88Å; E436-T438 VanDerWaalsContact C-N 3.34Å; E436-T438 HydrophobicContact CB-CG2 3.92Å
437	I	95.7	Very high	95.5	Very high	13 Å²	13	50.2 Å²	50.2	7%	0.067	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	49.6	-172.8	-47.2	-57.4	0	0	0	110.7	L386 F388 K398 V400 I418 W432 K433 Y434 P435	L386-I437 HydrophobicContact CD2-CG2 4.37Å; F388-I437 HydrophobicContact CE1-CD1 4.39Å; F388-I437 HydrophobicContact CE2-CD1 3.87Å; F388-I437 HydrophobicContact CE2-CG1 3.92Å; F388-I437 HydrophobicContact CZ-CD1 3.45Å; F388-I437 VanDerWaalsContact CZ-CD1 3.45Å; F388-I437 HydrophobicContact CZ-CG1 4.06Å; K398-I437 HydrophobicContact CD-CG1 4.2Å; V400-I437 HydrophobicContact CB-CG2 4.23Å; V400-I437 HydrophobicContact CG1-CG2 4.02Å; V400-I437 HydrophobicContact CG2-CB 4.04Å; V400-I437 HydrophobicContact CG2-CG1 4.22Å; V400-I437 HydrophobicContact CG2-CG2 4.01Å; I418-I437 HydrophobicContact CD1-CD1 3.95Å; W432-I437 HydrophobicContact CB-CG2 4.27Å; W432-I437 HydrophobicContact CD2-CG2 4.13Å; W432-I437 HydrophobicContact CE3-CG2 3.85Å; W432-I437 HydrophobicContact CG-CG2 4.32Å; K433-I437 WeakPolarHBondContact O-CA 3.28Å; K433-I437 PolarHBondContact O-N 3.01Å; Y434-I437 HydrophobicContact CD2-CD1 4.01Å; P435-I437 VanDerWaalsContact C-N 3.25Å; P435-I437 PolarHBondContact O-N 2.92Å
438	T	95.6	Very high	95.6	Very high	74 Å²	74	49.3 Å²	49.3	45%	0.454	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.4	172.1	57	0	0	0	0	109.6	W432 K433 E436 V440	W432-T438 WeakPolarHBondContact CA-O 3.4Å; K433-T438 WeakPolarHBondContact CB-OG1 3.46Å; K433-T438 PolarHBondContact N-O 3.05Å; E436-T438 VanDerWaalsContact C-N 3.34Å; E436-T438 HydrophobicContact CB-CG2 3.92Å; T438-V440 PolarHBondContact O-N 2.86Å
439	K	95.5	Very high	95.6	Very high	100 Å²	100	48.6 Å²	48.6	44%	0.435	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	123.5	176.2	-175.4	170.2	-176.1	177.3	0	110.5	V430 W432	V430-K439 HydrophobicContact CG1-CD 3.96Å; V430-K439 HydrophobicContact CG1-CG 3.72Å; W432-K439 HydrophobicContact CE3-CB 4.12Å; W432-K439 HydrophobicContact CZ3-CB 3.93Å
440	V	95.1	Very high	95.6	Very high	63 Å²	63	48.7 Å²	48.7	38%	0.382	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-54	175.6	179.2	0	0	0	0	109.6	I170 I431 K433 T438	I170-V440 HydrophobicContact CD1-CG1 3.89Å; I431-V440 HydrophobicContact CB-CB 4.3Å; I431-V440 HydrophobicContact CG2-CB 4.09Å; I431-V440 HydrophobicContact CG2-CG2 4.31Å; I431-V440 WeakPolarHBondContact O-CB 3.36Å; I431-V440 PolarHBondContact O-N 2.93Å; K433-V440 HydrophobicContact CB-CG2 4.07Å; T438-V440 PolarHBondContact O-N 2.86Å
441	T	95.7	Very high	95.6	Very high	18 Å²	18	48.9 Å²	48.9	11%	0.11	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	170.4	177.3	-167.6	0	0	0	0	110	I170 Q172 V430 I431	I170-T441 HydrophobicContact CB-CG2 4.38Å; I170-T441 HydrophobicContact CD1-CG2 3.76Å; I170-T441 HydrophobicContact CG2-CG2 4Å; Q172-T441 PolarHBondContact NE2-OG1 3.03Å; V430-T441 WeakPolarHBondContact CG1-O 3.43Å; I431-T441 HydrophobicContact CB-CG2 4.07Å; I431-T441 HydrophobicContact CD1-CG2 3.8Å; I431-T441 HydrophobicContact CG1-CG2 4.08Å; I431-T441 PolarHBondContact N-O 3.04Å; I431-T441 VanDerWaalsContact N-O 3.08Å
442	H	95.5	Very high	95.6	Very high	70 Å²	70	50 Å²	50	32%	0.324	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	159.7	163.1	54	-56.5	0	0	0	109.6	Q172 Q428 L429 V430	Q172-H442 PolarHBondContact OE1-O 3.05Å; Q172-H442 VanDerWaalsContact OE1-O 3.05Å; Q428-H442 PolarHBondContact OE1-CD2 3.31Å; L429-H442 CarbonylContact O-C 3.05Å; L429-H442 WeakPolarHBondContact O-CA 3.5Å; V430-H442 HydrophobicContact CG2-CB 4.31Å
443	L	95.7	Very high	95.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126.1	176.5	-53.7	170.3	0	0	0	107.4	P171 Q428 L429 W473 C475	P171-L443 VanDerWaalsContact O-CD2 3.27Å; P171-L443 WeakPolarHBondContact O-CD2 3.41Å; Q428-L443 CarbonylContact C-O 3.52Å; Q428-L443 WeakPolarHBondContact CA-O 3.36Å; Q428-L443 WeakPolarHBondContact CB-O 3.45Å; L429-L443 HydrophobicContact CB-CB 4.15Å; L429-L443 HydrophobicContact CB-CD1 4.41Å; L429-L443 HydrophobicContact CD1-CD1 4.3Å; L429-L443 PolarHBondContact N-O 2.89Å; L429-L443 PolarHBondContact O-N 2.89Å; L443-W473 HydrophobicContact CB-CD2 4.3Å; L443-W473 HydrophobicContact CB-CE3 4Å; L443-W473 HydrophobicContact CB-CH2 3.87Å; L443-W473 HydrophobicContact CB-CZ2 4.18Å; L443-W473 HydrophobicContact CB-CZ3 3.77Å; L443-W473 HydrophobicContact CD1-CB 4.15Å; L443-W473 HydrophobicContact CD1-CD2 3.82Å; L443-W473 HydrophobicContact CD1-CE3 3.79Å; L443-W473 HydrophobicContact CD1-CG 4Å; L443-W473 HydrophobicContact CD1-CZ3 4.42Å; L443-W473 HydrophobicContact CD2-CE3 4.06Å; L443-W473 HydrophobicContact CD2-CZ3 4.13Å; L443-W473 HydrophobicContact CG-CE3 4.16Å; L443-W473 HydrophobicContact CG-CZ3 4.32Å; L443-C475 HydrophobicContact CD1-CB 4.28Å
444	E	93.6	Very high	95.7	Very high	132 Å²	132	45.6 Å²	45.6	62%	0.617	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	143.7	-169	-63.4	-178	167.5	0	0	112.8	R471 W473	E444-R471 PolarHBondContact O-NH1 2.98Å; E444-W473 WeakPolarHBondContact O-CH2 3.49Å
445	H	92.2	Very high	95.7	Very high	14 Å²	14	44.4 Å²	44.4	7%	0.065	23%	0.227	C	C	.	.			trans	-119.8	157.7	168.2	-96.2	-80.8	0	0	0	110.5	K427 V449 S463 D467 R471 W473	K427-H445 WeakPolarHBondContact O-CA 3.32Å; K427-H445 WeakPolarHBondContact O-CB 3.32Å; K427-H445 PolarHBondContact O-N 3.42Å; H445-V449 HydrophobicContact CB-CG2 3.94Å; H445-V449 VanDerWaalsContact CD2-CG2 3.43Å; H445-V449 WeakPolarHBondContact CD2-CG2 3.34Å; H445-S463 PolarHBondContact CE1-OG 3.27Å; H445-S463 WeakPolarHBondContact NE2-CB 3.45Å; H445-S463 PolarHBondContact NE2-OG 2.77Å; H445-D467 IonicContact ND1-OD2 3.69Å; H445-R471 WeakPolarHBondContact CE1-CD 3.45Å; H445-R471 PolarHBondContact ND1-NE 3.39Å; H445-W473 AromaticContact NE2-CZ2 3.93Å; H445-W473 AromaticContact NE2-NE1 3.91Å
446	Q	92.5	Very high	95.6	Very high	145 Å²	145	44.4 Å²	44.4	68%	0.678	23%	0.227	S	C	*	.	S	Bend	trans	-88.7	-34.4	176	-69.5	170.7	-8.9	0	0	111.2	K427 D467	K427-Q446 WeakPolarHBondContact CD-O 3.32Å; K427-Q446 PolarHBondContact NZ-O 3.49Å; Q446-D467 HydrophobicContact CB-CB 4.26Å; Q446-D467 WeakPolarHBondContact CB-OD2 3.28Å; Q446-D467 PolarHBondContact N-OD2 3.47Å
447	G	94.2	Very high	95.5	Very high	5 Å²	5	43.5 Å²	43.5	5%	0.052	23%	0.226	C	C	.	.	S	Bend	trans	-99.8	171.9	172.9	0	0	0	0	0	113.8	K427 S466 D467	K427-G447 WeakPolarHBondContact CB-O 3.17Å; G447-S466 WeakPolarHBondContact CA-OG 3.48Å; G447-D467 PolarHBondContact N-OD2 3.06Å
448	R	95.9	Very high	95.4	Very high	54 Å²	54	45.6 Å²	45.6	20%	0.204	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-69.5	135.6	170.7	63.6	176	-172.6	-177.1	2.2	108.9	D185 L450 A465 S466	D185-R448 PolarHBondContact O-NH2 2.77Å; D185-R448 IonicContact OD1-CZ 3.56Å; D185-R448 IonicContact OD1-NE 3.48Å; D185-R448 PolarHBondContact OD1-NE 3.1Å; D185-R448 IonicContact OD1-NH2 3.2Å; D185-R448 PolarHBondContact OD1-NH2 3.3Å; D185-R448 IonicContact OD2-CZ 2.74Å; D185-R448 IonicContact OD2-NE 3.11Å; D185-R448 PolarHBondContact OD2-NE 3.44Å; D185-R448 IonicContact OD2-NH2 2.69Å; D185-R448 PolarHBondContact OD2-NH2 2.71Å; R448-L450 HydrophobicContact CG-CD2 4.35Å; R448-L450 PolarHBondContact O-N 2.77Å; R448-A465 CarbonylContact O-C 3.6Å; R448-A465 VanDerWaalsContact O-CA 3.27Å; R448-A465 WeakPolarHBondContact O-CA 3.4Å; R448-A465 WeakPolarHBondContact O-CB 3.27Å; R448-S466 PolarHBondContact N-OG 3.42Å; R448-S466 VanDerWaalsContact N-OG 3.07Å; R448-S466 PolarHBondContact O-N 2.93Å
449	V	97.6	Very high	95.4	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.1	179.5	-171.1	0	0	0	0	109.2	S407 H422 L429 H445 I452	S407-V449 WeakPolarHBondContact CB-O 3.39Å; S407-V449 PolarHBondContact OG-O 2.86Å; H422-V449 PolarHBondContact O-N 2.78Å; L429-V449 HydrophobicContact CD2-CG1 4.08Å; L429-V449 HydrophobicContact CD2-CG2 4.2Å; H445-V449 HydrophobicContact CB-CG2 3.94Å; H445-V449 VanDerWaalsContact CD2-CG2 3.43Å; H445-V449 WeakPolarHBondContact CD2-CG2 3.34Å; V449-I452 HydrophobicContact CG1-CG2 4.08Å
450	L	97.3	Very high	95.5	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-46.7	-176.5	-62.7	173.2	0	0	0	112.3	I183 K363 R448 C464	I183-L450 HydrophobicContact CD1-CD1 3.97Å; I183-L450 HydrophobicContact CG1-CD1 4.35Å; K363-L450 VanDerWaalsContact CE-O 3.23Å; K363-L450 WeakPolarHBondContact CE-O 3.45Å; R448-L450 HydrophobicContact CG-CD2 4.35Å; R448-L450 PolarHBondContact O-N 2.77Å; L450-C464 PolarHBondContact N-O 2.83Å
451	C	97.1	Very high	95.6	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.8	-176.9	-67.5	0	0	0	0	111.3	L189 L192 C464	L189-C451 PolarHBondContact O-SG 3.06Å; L192-C451 HydrophobicContact CB-CB 3.8Å; L192-C451 HydrophobicContact CD2-CB 4.29Å; C451-C464 HydrophobicContact CB-CB 4.29Å; C451-C464 PolarHBondContact N-O 3.19Å; C451-C464 PolarHBondContact O-N 3.05Å
452	I	98.1	Very high	95.7	Very high	23 Å²	23	35.9 Å²	35.9	12%	0.118	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	149.3	173.1	56.3	177.2	0	0	0	109.6	G408 I410 L419 L429 V449 V462	G408-I452 VanDerWaalsContact C-CD1 3.47Å; I410-I452 HydrophobicContact CB-CD1 4.38Å; I410-I452 HydrophobicContact CD1-CB 3.88Å; I410-I452 HydrophobicContact CD1-CD1 3.7Å; I410-I452 HydrophobicContact CD1-CG1 3.73Å; I410-I452 HydrophobicContact CG1-CD1 3.67Å; I410-I452 HydrophobicContact CG1-CG1 3.97Å; L419-I452 HydrophobicContact CD2-CD1 3.66Å; L429-I452 HydrophobicContact CD2-CG2 3.92Å; V449-I452 HydrophobicContact CG1-CG2 4.08Å; I452-V462 VanDerWaalsContact CA-O 3.26Å; I452-V462 WeakPolarHBondContact CA-O 3Å
453	A	98	Very high	95.8	Very high	7 Å²	7	32.5 Å²	32.5	6%	0.058	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	155.9	171.5	0	0	0	0	0	110.1	L192 W194 V461 V462	L192-A453 HydrophobicContact CD2-CB 4.32Å; L192-A453 HydrophobicContact CG-CB 4.43Å; W194-A453 HydrophobicContact CB-CB 4.1Å; A453-V461 WeakPolarHBondContact O-CA 3.33Å; A453-V462 HydrophobicContact CB-CG1 3.69Å; A453-V462 PolarHBondContact N-O 2.93Å; A453-V462 WeakPolarHBondContact O-CG1 3.47Å; A453-V462 PolarHBondContact O-N 2.79Å
454	S	97.2	Very high	95.9	Very high	33 Å²	33	32.5 Å²	32.5	23%	0.231	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.7	178.9	-176	0	0	0	0	110	W194	W194-S454 WeakPolarHBondContact CB-O 3.44Å
455	S	96.6	Very high	96.1	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.021	14%	0.136	C	C	.	.			trans	-64.4	157	167.1	59.9	0	0	0	0	111.1	N457 E458 E459 M460	S455-N457 WeakPolarHBondContact CB-OD1 3.43Å; S455-N457 PolarHBondContact O-N 3.29Å; S455-N457 PolarHBondContact OG-OD1 3.14Å; S455-E458 PolarHBondContact O-N 3.35Å; S455-E459 PolarHBondContact OG-N 3.36Å; S455-M460 PolarHBondContact N-O 2.79Å; S455-M460 WeakPolarHBondContact OG-CA 3.3Å; S455-M460 WeakPolarHBondContact OG-CB 3.35Å; S455-M460 PolarHBondContact OG-N 2.99Å; S455-M460 PolarHBondContact OG-O 2.96Å
456	P	94	Very high	96.3	Very high	63 Å²	63	27.4 Å²	27.4	41%	0.409	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.5	-178.1	23.6	-35.3	0	0	0	114.8	N198	N198-P456 HydrophobicContact CB-CG 4.3Å
457	N	92.7	Very high	96.4	Very high	86 Å²	86	22.1 Å²	22.1	46%	0.46	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1.7	173.5	68	-11.9	0	0	0	113.7	S455 E459	S455-N457 WeakPolarHBondContact CB-OD1 3.43Å; S455-N457 PolarHBondContact O-N 3.29Å; S455-N457 PolarHBondContact OG-OD1 3.14Å; N457-E459 HydrophobicContact CB-CG 4.49Å; N457-E459 PolarHBondContact ND2-OE2 3.37Å; N457-E459 PolarHBondContact O-N 2.7Å; N457-E459 VanDerWaalsContact O-N 3.13Å; N457-E459 PolarHBondContact OD1-N 3.15Å
458	E	94.3	Very high	96.6	Very high	56 Å²	56	26.8 Å²	26.8	26%	0.262	14%	0.143	S	C	.	.	S	Bend	trans	58.7	13.5	-176.7	-57.2	-172.5	-170.9	0	0	116	N412 T413 S455 F476	N412-E458 PolarHBondContact ND2-O 2.8Å; T413-E458 VanDerWaalsContact CB-OE2 3.31Å; T413-E458 WeakPolarHBondContact CB-OE2 3.45Å; T413-E458 WeakPolarHBondContact CG2-OE2 3.47Å; T413-E458 PolarHBondContact N-OE2 2.56Å; T413-E458 PolarHBondContact OG1-OE2 2.72Å; S455-E458 PolarHBondContact O-N 3.35Å; E458-F476 VanDerWaalsContact O-CB 3.24Å; E458-F476 WeakPolarHBondContact O-CB 3.35Å
459	E	95	Very high	96.6	Very high	29 Å²	29	25.1 Å²	25.1	14%	0.136	14%	0.139	C	C	.	.	S	Bend	trans	-89	-30.2	179.8	-62.6	-171.2	143.1	0	0	112.9	S455 N457 C475 F476 V478	S455-E459 PolarHBondContact OG-N 3.36Å; N457-E459 HydrophobicContact CB-CG 4.49Å; N457-E459 PolarHBondContact ND2-OE2 3.37Å; N457-E459 PolarHBondContact O-N 2.7Å; N457-E459 VanDerWaalsContact O-N 3.13Å; N457-E459 PolarHBondContact OD1-N 3.15Å; E459-C475 PolarHBondContact O-N 3.3Å; E459-F476 PolarHBondContact O-N 3.36Å; E459-F476 VanDerWaalsContact O-N 3.08Å; E459-V478 HydrophobicContact CG-CG2 4.4Å; E459-V478 WeakPolarHBondContact OE1-CB 3.48Å; E459-V478 PolarHBondContact OE1-N 2.7Å; E459-V478 VanDerWaalsContact OE1-N 3.1Å
460	M	96.3	Very high	96.6	Very high	22 Å²	22	25.2 Å²	25.2	11%	0.108	14%	0.139	C	C	.	.			trans	-113.2	147.9	-176.1	-51.2	-70.5	-86	0	0	111	E175 W194 S455 I472 W473 H474	E175-M460 HydrophobicContact CB-CE 4.03Å; E175-M460 VanDerWaalsContact CD-CE 3.42Å; E175-M460 HydrophobicContact CG-CE 4.29Å; E175-M460 WeakPolarHBondContact OE2-CE 3.38Å; W194-M460 HydrophobicContact CH2-CB 4.02Å; W194-M460 HydrophobicContact CZ3-CB 4.21Å; S455-M460 PolarHBondContact N-O 2.79Å; S455-M460 WeakPolarHBondContact OG-CA 3.3Å; S455-M460 WeakPolarHBondContact OG-CB 3.35Å; S455-M460 PolarHBondContact OG-N 2.99Å; S455-M460 PolarHBondContact OG-O 2.96Å; M460-I472 HydrophobicContact CB-CG2 4.33Å; M460-I472 HydrophobicContact CE-CG2 3.57Å; M460-W473 CarbonylContact C-O 3.53Å; M460-W473 VanDerWaalsContact CA-O 3.25Å; M460-W473 WeakPolarHBondContact CA-O 3.47Å; M460-H474 HydrophobicContact CE-CB 3.95Å; M460-H474 WeakPolarHBondContact SD-CA 3.43Å; M460-H474 HydrophobicContact SD-CB 3.3Å; M460-H474 WeakPolarHBondContact SD-CB 3.43Å; M460-H474 PolarHBondContact SD-CD2 2.76Å
461	V	98	Very high	96.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.4	170.2	171.7	0	0	0	0	108.8	I410 L419 A453 I472 W473 F476	I410-V461 HydrophobicContact CD1-CG1 3.89Å; I410-V461 HydrophobicContact CD1-CG2 4.27Å; L419-V461 HydrophobicContact CD1-CB 4.31Å; L419-V461 HydrophobicContact CD1-CG1 4.13Å; L419-V461 HydrophobicContact CD1-CG2 4.15Å; L419-V461 HydrophobicContact CD2-CG1 4.15Å; A453-V461 WeakPolarHBondContact O-CA 3.33Å; V461-I472 CarbonylContact O-C 3.51Å; V461-I472 WeakPolarHBondContact O-CA 3.18Å; V461-W473 PolarHBondContact N-O 2.94Å; V461-W473 PolarHBondContact O-N 3.39Å; V461-F476 HydrophobicContact CG2-CD2 4.07Å; V461-F476 HydrophobicContact CG2-CE2 3.84Å
462	V	98.2	Very high	96.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	144.6	168.1	63.3	0	0	0	0	109.1	L192 W194 L200 I452 A453 L470 R471 I472	L192-V462 HydrophobicContact CD2-CG1 3.76Å; L192-V462 HydrophobicContact CD2-CG2 4.3Å; L192-V462 HydrophobicContact CG-CG1 4.34Å; W194-V462 HydrophobicContact CE3-CB 3.98Å; W194-V462 HydrophobicContact CE3-CG1 3.57Å; W194-V462 HydrophobicContact CZ3-CB 3.79Å; W194-V462 HydrophobicContact CZ3-CG1 3.93Å; L200-V462 HydrophobicContact CD1-CB 4.42Å; L200-V462 HydrophobicContact CD1-CG1 3.69Å; L200-V462 HydrophobicContact CD1-CG2 4.37Å; L200-V462 HydrophobicContact CD2-CG2 3.98Å; I452-V462 VanDerWaalsContact CA-O 3.26Å; I452-V462 WeakPolarHBondContact CA-O 3Å; A453-V462 HydrophobicContact CB-CG1 3.69Å; A453-V462 PolarHBondContact N-O 2.93Å; A453-V462 WeakPolarHBondContact O-CG1 3.47Å; A453-V462 PolarHBondContact O-N 2.79Å; V462-L470 HydrophobicContact CG2-CB 4.28Å; V462-R471 CarbonylContact C-O 3.49Å; V462-R471 WeakPolarHBondContact CA-O 3.12Å; V462-I472 HydrophobicContact CG2-CG1 4.21Å
463	S	98	Very high	96.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.5	179.1	53.2	0	0	0	0	109.8	H445 L470 R471 W473	H445-S463 PolarHBondContact CE1-OG 3.27Å; H445-S463 WeakPolarHBondContact NE2-CB 3.45Å; H445-S463 PolarHBondContact NE2-OG 2.77Å; S463-L470 CarbonylContact O-C 3.56Å; S463-L470 VanDerWaalsContact O-CA 3.29Å; S463-L470 WeakPolarHBondContact O-CA 3.44Å; S463-R471 PolarHBondContact N-O 2.89Å; S463-R471 PolarHBondContact O-N 2.94Å; S463-R471 PolarHBondContact OG-O 3.5Å; S463-W473 PolarHBondContact OG-NE1 3.02Å
464	C	97.6	Very high	96.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.6	-168.8	178.9	0	0	0	0	108	I183 L192 L450 C451 L470	I183-C464 WeakPolarHBondContact CD1-SG 3.26Å; L192-C464 HydrophobicContact CB-CB 4.47Å; L192-C464 HydrophobicContact CD1-CB 4.41Å; L192-C464 HydrophobicContact CD2-CB 3.64Å; L192-C464 HydrophobicContact CG-CB 4.41Å; L450-C464 PolarHBondContact N-O 2.83Å; C451-C464 HydrophobicContact CB-CB 4.29Å; C451-C464 PolarHBondContact N-O 3.19Å; C451-C464 PolarHBondContact O-N 3.05Å; C464-L470 HydrophobicContact CB-CD2 3.34Å; C464-L470 WeakPolarHBondContact SG-CD2 3.47Å
465	A	97.4	Very high	96.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	162.3	-169.8	0	0	0	0	0	112.3	R448 D467 E468 T469	R448-A465 CarbonylContact O-C 3.6Å; R448-A465 VanDerWaalsContact O-CA 3.27Å; R448-A465 WeakPolarHBondContact O-CA 3.4Å; R448-A465 WeakPolarHBondContact O-CB 3.27Å; A465-D467 WeakPolarHBondContact CB-OD1 3.33Å; A465-D467 PolarHBondContact O-N 2.87Å; A465-D467 VanDerWaalsContact O-N 3.08Å; A465-E468 PolarHBondContact O-N 3.29Å; A465-T469 PolarHBondContact N-O 3.2Å
466	S	96.2	Very high	96.2	Very high	39 Å²	39	25.2 Å²	25.2	27%	0.273	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	1	178	73.5	0	0	0	0	114.1	D185 G447 R448	D185-S466 VanDerWaalsContact OD1-CB 3.25Å; D185-S466 WeakPolarHBondContact OD1-CB 3.44Å; G447-S466 WeakPolarHBondContact CA-OG 3.48Å; R448-S466 PolarHBondContact N-OG 3.42Å; R448-S466 VanDerWaalsContact N-OG 3.07Å; R448-S466 PolarHBondContact O-N 2.93Å
467	D	95.5	Very high	96.1	Very high	35 Å²	35	27.7 Å²	27.7	19%	0.187	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	16.5	175.6	59.5	12.3	0	0	0	112.3	H445 Q446 G447 A465 T469 R471	H445-D467 IonicContact ND1-OD2 3.69Å; Q446-D467 HydrophobicContact CB-CB 4.26Å; Q446-D467 WeakPolarHBondContact CB-OD2 3.28Å; Q446-D467 PolarHBondContact N-OD2 3.47Å; G447-D467 PolarHBondContact N-OD2 3.06Å; A465-D467 WeakPolarHBondContact CB-OD1 3.33Å; A465-D467 PolarHBondContact O-N 2.87Å; A465-D467 VanDerWaalsContact O-N 3.08Å; D467-T469 PolarHBondContact O-N 2.93Å; D467-T469 WeakPolarHBondContact OD1-CB 3.37Å; D467-T469 PolarHBondContact OD1-N 2.75Å; D467-T469 VanDerWaalsContact OD1-N 3.15Å; D467-T469 PolarHBondContact OD1-OG1 3.14Å; D467-R471 IonicContact OD2-NH2 3.58Å
468	E	96.7	Very high	95.7	Very high	102 Å²	102	24.7 Å²	24.7	48%	0.477	12%	0.123	S	C	.	.	S	Bend	trans	59.6	28.3	-177.4	-58.4	-177.5	169.8	0	0	112.8	A180 I183 A465	A180-E468 CarbonylContact C-O 3.53Å; A180-E468 WeakPolarHBondContact CA-O 3.47Å; A180-E468 PolarHBondContact N-O 2.81Å; A180-E468 WeakPolarHBondContact O-CA 3.42Å; A180-E468 WeakPolarHBondContact O-CB 3.35Å; I183-E468 HydrophobicContact CG2-CG 4.03Å; A465-E468 PolarHBondContact O-N 3.29Å
469	T	97.5	Very high	95.2	Very high	19 Å²	19	25.2 Å²	25.2	12%	0.117	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.8	176.4	75.4	0	0	0	0	113.8	V177 L178 A465 D467	V177-T469 HydrophobicContact CG1-CG2 4.22Å; L178-T469 WeakPolarHBondContact O-CA 3.24Å; A465-T469 PolarHBondContact N-O 3.2Å; D467-T469 PolarHBondContact O-N 2.93Å; D467-T469 WeakPolarHBondContact OD1-CB 3.37Å; D467-T469 PolarHBondContact OD1-N 2.75Å; D467-T469 VanDerWaalsContact OD1-N 3.15Å; D467-T469 PolarHBondContact OD1-OG1 3.14Å
470	L	97.6	Very high	94.4	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.5	160.5	-58.7	172	0	0	0	108.7	V177 L178 A180 L192 L200 V202 V462 S463 C464	V177-L470 CarbonylContact C-O 3.59Å; V177-L470 WeakPolarHBondContact CA-O 3.42Å; L178-L470 HydrophobicContact CB-CB 4.17Å; L178-L470 PolarHBondContact N-O 2.74Å; L178-L470 PolarHBondContact O-N 2.82Å; A180-L470 HydrophobicContact CB-CD1 4.46Å; A180-L470 HydrophobicContact CB-CD2 4.49Å; A180-L470 HydrophobicContact CB-CG 3.97Å; L192-L470 HydrophobicContact CD1-CD1 4.49Å; L192-L470 HydrophobicContact CD1-CD2 3.85Å; L200-L470 HydrophobicContact CD2-CD1 3.97Å; V202-L470 HydrophobicContact CB-CD1 4.2Å; V202-L470 HydrophobicContact CG1-CD1 4.2Å; V202-L470 HydrophobicContact CG2-CD1 4.16Å; V202-L470 HydrophobicContact CG2-CD2 4.36Å; V462-L470 HydrophobicContact CG2-CB 4.28Å; S463-L470 CarbonylContact O-C 3.56Å; S463-L470 VanDerWaalsContact O-CA 3.29Å; S463-L470 WeakPolarHBondContact O-CA 3.44Å; C464-L470 HydrophobicContact CB-CD2 3.34Å; C464-L470 WeakPolarHBondContact SG-CD2 3.47Å
471	R	97.9	Very high	93.5	Very high	28 Å²	28	33.6 Å²	33.6	11%	0.106	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.7	175.8	-62.9	-173.6	-168.4	-171.4	-3.3	110.2	P174 V177 E444 H445 V462 S463 D467 W473	P174-R471 HydrophobicContact CB-CB 3.96Å; P174-R471 HydrophobicContact CB-CG 4.44Å; P174-R471 HydrophobicContact CG-CB 4.45Å; P174-R471 HydrophobicContact CG-CG 4.4Å; V177-R471 HydrophobicContact CG1-CG 4.36Å; V177-R471 HydrophobicContact CG2-CG 4.29Å; E444-R471 PolarHBondContact O-NH1 2.98Å; H445-R471 WeakPolarHBondContact CE1-CD 3.45Å; H445-R471 PolarHBondContact ND1-NE 3.39Å; V462-R471 CarbonylContact C-O 3.49Å; V462-R471 WeakPolarHBondContact CA-O 3.12Å; S463-R471 PolarHBondContact N-O 2.89Å; S463-R471 PolarHBondContact O-N 2.94Å; S463-R471 PolarHBondContact OG-O 3.5Å; D467-R471 IonicContact OD2-NH2 3.58Å; R471-W473 HydrophobicContact CB-CZ2 3.83Å; R471-W473 HydrophobicContact CG-CZ2 4.39Å; R471-W473 PolarHBondContact O-NE1 3.26Å
472	I	97.5	Very high	92.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.3	177.8	-49.6	-176.1	0	0	0	108.9	P174 E175 K176 L178 W194 W211 M460 V461 V462	P174-I472 CarbonylContact C-O 3.4Å; P174-I472 WeakPolarHBondContact CA-O 3.43Å; P174-I472 WeakPolarHBondContact CB-O 3.47Å; E175-I472 PolarHBondContact N-O 3.34Å; K176-I472 HydrophobicContact CB-CB 4.32Å; K176-I472 HydrophobicContact CB-CD1 4.15Å; K176-I472 HydrophobicContact CB-CG1 4.37Å; K176-I472 PolarHBondContact O-N 3.31Å; L178-I472 HydrophobicContact CD1-CD1 4.22Å; W194-I472 HydrophobicContact CH2-CG2 3.98Å; W194-I472 HydrophobicContact CZ3-CG2 4.37Å; W211-I472 HydrophobicContact CE3-CD1 4.4Å; W211-I472 HydrophobicContact CH2-CD1 3.48Å; W211-I472 VanDerWaalsContact CH2-CD1 3.48Å; W211-I472 HydrophobicContact CZ3-CD1 3.41Å; W211-I472 VanDerWaalsContact CZ3-CD1 3.41Å; M460-I472 HydrophobicContact CB-CG2 4.33Å; M460-I472 HydrophobicContact CE-CG2 3.57Å; V461-I472 CarbonylContact O-C 3.51Å; V461-I472 WeakPolarHBondContact O-CA 3.18Å; V462-I472 HydrophobicContact CG2-CG1 4.21Å
473	W	97.2	Very high	91.4	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.011	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.6	-172.6	-52.5	91.7	0	0	0	111.1	P174 L429 L443 E444 H445 M460 V461 S463 R471 C475	P174-W473 HydrophobicContact CB-CD2 4.15Å; P174-W473 HydrophobicContact CB-CE3 4.02Å; P174-W473 HydrophobicContact CB-CH2 4.3Å; P174-W473 HydrophobicContact CB-CZ2 4.41Å; P174-W473 HydrophobicContact CB-CZ3 4.09Å; P174-W473 HydrophobicContact CG-CH2 4.39Å; P174-W473 HydrophobicContact CG-CZ3 4.39Å; L429-W473 HydrophobicContact CD1-CD2 4.49Å; L429-W473 HydrophobicContact CD1-CG 4.23Å; L443-W473 HydrophobicContact CB-CD2 4.3Å; L443-W473 HydrophobicContact CB-CE3 4Å; L443-W473 HydrophobicContact CB-CH2 3.87Å; L443-W473 HydrophobicContact CB-CZ2 4.18Å; L443-W473 HydrophobicContact CB-CZ3 3.77Å; L443-W473 HydrophobicContact CD1-CB 4.15Å; L443-W473 HydrophobicContact CD1-CD2 3.82Å; L443-W473 HydrophobicContact CD1-CE3 3.79Å; L443-W473 HydrophobicContact CD1-CG 4Å; L443-W473 HydrophobicContact CD1-CZ3 4.42Å; L443-W473 HydrophobicContact CD2-CE3 4.06Å; L443-W473 HydrophobicContact CD2-CZ3 4.13Å; L443-W473 HydrophobicContact CG-CE3 4.16Å; L443-W473 HydrophobicContact CG-CZ3 4.32Å; E444-W473 WeakPolarHBondContact O-CH2 3.49Å; H445-W473 AromaticContact NE2-CZ2 3.93Å; H445-W473 AromaticContact NE2-NE1 3.91Å; M460-W473 CarbonylContact C-O 3.53Å; M460-W473 VanDerWaalsContact CA-O 3.25Å; M460-W473 WeakPolarHBondContact CA-O 3.47Å; V461-W473 PolarHBondContact N-O 2.94Å; V461-W473 PolarHBondContact O-N 3.39Å; S463-W473 PolarHBondContact OG-NE1 3.02Å; R471-W473 HydrophobicContact CB-CZ2 3.83Å; R471-W473 HydrophobicContact CG-CZ2 4.39Å; R471-W473 PolarHBondContact O-NE1 3.26Å; W473-C475 VanDerWaalsContact C-N 3.29Å; W473-C475 PolarHBondContact O-N 2.81Å; W473-C475 VanDerWaalsContact O-N 3.16Å
474	H	95	Very high	90.4	Very high	38 Å²	38	50.8 Å²	50.8	18%	0.176	24%	0.241	C	C	.	.			trans	-89.4	61.5	174.3	-158.1	155.5	0	0	0	111.8	P171 E175 M460 Q477	P171-H474 WeakPolarHBondContact CD-O 3.43Å; E175-H474 WeakPolarHBondContact OE2-CB 3.44Å; E175-H474 IonicContact OE2-CG 2.99Å; E175-H474 IonicContact OE2-ND1 2.73Å; E175-H474 PolarHBondContact OE2-ND1 2.86Å; M460-H474 HydrophobicContact CE-CB 3.95Å; M460-H474 WeakPolarHBondContact SD-CA 3.43Å; M460-H474 HydrophobicContact SD-CB 3.3Å; M460-H474 WeakPolarHBondContact SD-CB 3.43Å; M460-H474 PolarHBondContact SD-CD2 2.76Å; H474-Q477 WeakPolarHBondContact NE2-CB 3.24Å; H474-Q477 WeakPolarHBondContact NE2-CG 3.3Å
475	C	94.1	Very high	89.3	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.02	27%	0.269	C	S	.	.			trans	-92	-9.1	-168.8	58.1	0	0	0	0	115.3	R168 I170 I431 L443 E459 W473	R168-C475 PolarHBondContact NH2-O 3.27Å; I170-C475 HydrophobicContact CG2-CB 3.85Å; I431-C475 HydrophobicContact CD1-CB 3.71Å; L443-C475 HydrophobicContact CD1-CB 4.28Å; E459-C475 PolarHBondContact O-N 3.3Å; W473-C475 VanDerWaalsContact C-N 3.29Å; W473-C475 PolarHBondContact O-N 2.81Å; W473-C475 VanDerWaalsContact O-N 3.16Å
476	F	94.5	Very high	88.2	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	29%	0.294	C	S	.	.	S	Bend	trans	-125.2	29.5	-177.9	-60.9	-61	0	0	0	113.2	N412 Y415 E417 L419 I431 E458 E459 V461 V478	N412-F476 HydrophobicContact CB-CD1 3.9Å; N412-F476 HydrophobicContact CB-CD2 4.14Å; N412-F476 HydrophobicContact CB-CE1 3.72Å; N412-F476 HydrophobicContact CB-CE2 3.98Å; N412-F476 HydrophobicContact CB-CG 4.11Å; N412-F476 HydrophobicContact CB-CZ 3.76Å; N412-F476 WeakPolarHBondContact ND2-CB 3.48Å; N412-F476 WeakPolarHBondContact ND2-CG 3.47Å; Y415-F476 HydrophobicContact CD2-CB 4.32Å; Y415-F476 AromaticContact CD2-CD1 3.88Å; Y415-F476 HydrophobicContact CD2-CD1 3.88Å; Y415-F476 HydrophobicContact CE2-CB 4.3Å; E417-F476 HydrophobicContact CB-CE1 4.24Å; L419-F476 HydrophobicContact CB-CE2 4.33Å; L419-F476 HydrophobicContact CB-CZ 4.1Å; L419-F476 HydrophobicContact CD1-CE2 4.24Å; L419-F476 HydrophobicContact CD1-CZ 4.41Å; I431-F476 HydrophobicContact CD1-CE1 4.19Å; I431-F476 HydrophobicContact CD1-CZ 4.16Å; I431-F476 HydrophobicContact CG1-CZ 4.42Å; I431-F476 HydrophobicContact CG2-CE1 4.13Å; I431-F476 HydrophobicContact CG2-CZ 4.41Å; E458-F476 VanDerWaalsContact O-CB 3.24Å; E458-F476 WeakPolarHBondContact O-CB 3.35Å; E459-F476 PolarHBondContact O-N 3.36Å; E459-F476 VanDerWaalsContact O-N 3.08Å; V461-F476 HydrophobicContact CG2-CD2 4.07Å; V461-F476 HydrophobicContact CG2-CE2 3.84Å; F476-V478 PolarHBondContact O-N 2.75Å
477	Q	90.1	Very high	87.2	Confident	114 Å²	114	63.5 Å²	63.5	53%	0.533	30%	0.298	S	S	.	.			trans	-48.7	129.5	178.2	-170.9	175.1	21.1	0	0	112.3	Y415 H474	Y415-Q477 PolarHBondContact OH-O 3.04Å; H474-Q477 WeakPolarHBondContact NE2-CB 3.24Å; H474-Q477 WeakPolarHBondContact NE2-CG 3.3Å
478	V	86	Confident	86.2	Confident	24 Å²	24	70 Å²	70	15%	0.145	33%	0.325	C	S	.	.			trans	-107.9	128.9	176.7	-176.6	0	0	0	0	110.3	E414 E459 F476 Q480 K483	E414-V478 HydrophobicContact CB-CG2 4.04Å; E414-V478 HydrophobicContact CG-CG2 3.72Å; E459-V478 HydrophobicContact CG-CG2 4.4Å; E459-V478 WeakPolarHBondContact OE1-CB 3.48Å; E459-V478 PolarHBondContact OE1-N 2.7Å; E459-V478 VanDerWaalsContact OE1-N 3.1Å; F476-V478 PolarHBondContact O-N 2.75Å; V478-Q480 PolarHBondContact O-N 3.48Å; V478-K483 HydrophobicContact CG1-CB 4.09Å; V478-K483 HydrophobicContact CG1-CD 3.82Å
479	D	82.1	Confident	85.1	Confident	66 Å²	66	69.3 Å²	69.3	35%	0.353	33%	0.331	S	S	.	.			trans	-74.5	95.5	168.2	-176.1	-21	0	0	0	109.1	N481 K482 K483	D479-N481 PolarHBondContact O-N 2.58Å; D479-N481 VanDerWaalsContact O-N 3.15Å; D479-N481 WeakPolarHBondContact OD1-CB 3.22Å; D479-N481 PolarHBondContact OD1-N 3.03Å; D479-N481 VanDerWaalsContact OD1-N 3.15Å; D479-K482 HydrophobicContact CB-CB 4.1Å; D479-K482 HydrophobicContact CB-CD 4.03Å; D479-K482 HydrophobicContact CB-CG 4.16Å; D479-K482 PolarHBondContact O-N 3.31Å; D479-K482 PolarHBondContact OD1-N 3.11Å; D479-K482 VanDerWaalsContact OD2-CD 3.25Å; D479-K482 WeakPolarHBondContact OD2-CD 3.18Å; D479-K482 WeakPolarHBondContact OD2-CE 3.41Å; D479-K482 WeakPolarHBondContact OD2-CG 3.44Å; D479-K482 IonicContact OD2-NZ 3.06Å; D479-K482 PolarHBondContact OD2-NZ 2.89Å; D479-K483 PolarHBondContact O-N 3.22Å
480	Q	79.1	Confident	83.7	Confident	115 Å²	115	74 Å²	74	54%	0.537	36%	0.355	S	S	.	.	H	α-helix	trans	-56.5	-31.5	-177	-64.4	-167.7	10.3	0	0	112.9	V478 K483 R484	V478-Q480 PolarHBondContact O-N 3.48Å; Q480-K483 PolarHBondContact O-N 3.11Å; Q480-R484 WeakPolarHBondContact O-CB 3.27Å; Q480-R484 VanDerWaalsContact O-CG 3.27Å; Q480-R484 WeakPolarHBondContact O-CG 3.48Å; Q480-R484 PolarHBondContact O-N 3.24Å
481	N	77	Confident	81.9	Confident	113 Å²	113	82.6 Å²	82.6	60%	0.604	39%	0.387	S	S	*	.	H	α-helix	trans	-67.2	-45.3	177.4	-73.2	-34.8	0	0	0	110.6	D479 R484 I485	D479-N481 PolarHBondContact O-N 2.58Å; D479-N481 VanDerWaalsContact O-N 3.15Å; D479-N481 WeakPolarHBondContact OD1-CB 3.22Å; D479-N481 PolarHBondContact OD1-N 3.03Å; D479-N481 VanDerWaalsContact OD1-N 3.15Å; N481-R484 PolarHBondContact O-N 3.23Å; N481-I485 WeakPolarHBondContact O-CD1 3.46Å; N481-I485 WeakPolarHBondContact O-CG1 3.44Å; N481-I485 PolarHBondContact O-N 2.76Å
482	K	74.8	Confident	79.8	Confident	141 Å²	141	86.3 Å²	86.3	61%	0.613	42%	0.415	S	S	*	.	H	α-helix	trans	-63.9	-42.1	174.8	-71.4	-179.3	-173.2	124.5	0	111.9	D479 I485 H486	D479-K482 HydrophobicContact CB-CB 4.1Å; D479-K482 HydrophobicContact CB-CD 4.03Å; D479-K482 HydrophobicContact CB-CG 4.16Å; D479-K482 PolarHBondContact O-N 3.31Å; D479-K482 PolarHBondContact OD1-N 3.11Å; D479-K482 VanDerWaalsContact OD2-CD 3.25Å; D479-K482 WeakPolarHBondContact OD2-CD 3.18Å; D479-K482 WeakPolarHBondContact OD2-CE 3.41Å; D479-K482 WeakPolarHBondContact OD2-CG 3.44Å; D479-K482 IonicContact OD2-NZ 3.06Å; D479-K482 PolarHBondContact OD2-NZ 2.89Å; K482-I485 PolarHBondContact O-N 2.92Å; K482-H486 WeakPolarHBondContact O-CB 3.49Å; K482-H486 PolarHBondContact O-N 3.12Å
483	K	76.8	Confident	77.9	Confident	69 Å²	69	91 Å²	91	30%	0.3	45%	0.448	S	S	.	.	H	α-helix	trans	-60.9	-48.8	177.5	-176.2	167.5	175.9	173.8	0	111.6	E414 V478 D479 Q480 I485 H486 E487	E414-K483 IonicContact OE1-NZ 3.54Å; E414-K483 PolarHBondContact OE1-NZ 3.05Å; E414-K483 IonicContact OE2-NZ 3.35Å; E414-K483 PolarHBondContact OE2-NZ 2.8Å; V478-K483 HydrophobicContact CG1-CB 4.09Å; V478-K483 HydrophobicContact CG1-CD 3.82Å; D479-K483 PolarHBondContact O-N 3.22Å; Q480-K483 PolarHBondContact O-N 3.11Å; K483-I485 VanDerWaalsContact C-N 3.31Å; K483-I485 PolarHBondContact O-N 2.93Å; K483-H486 PolarHBondContact O-N 2.87Å; K483-H486 VanDerWaalsContact O-N 3.13Å; K483-E487 VanDerWaalsContact CE-OE1 3.25Å; K483-E487 WeakPolarHBondContact CE-OE1 3.3Å; K483-E487 HydrophobicContact CG-CG 4.43Å; K483-E487 WeakPolarHBondContact O-CG 3.42Å; K483-E487 PolarHBondContact O-N 3.21Å
484	R	77.2	Confident	76.1	Confident	150 Å²	150	97 Å²	97	57%	0.566	49%	0.485	S	S	*	.	H	α-helix	trans	-58.5	-40.4	175.6	-75.7	175.1	176.9	-173.5	1.5	112.7	Q480 N481 K488	Q480-R484 WeakPolarHBondContact O-CB 3.27Å; Q480-R484 VanDerWaalsContact O-CG 3.27Å; Q480-R484 WeakPolarHBondContact O-CG 3.48Å; Q480-R484 PolarHBondContact O-N 3.24Å; N481-R484 PolarHBondContact O-N 3.23Å; R484-K488 WeakPolarHBondContact O-CB 3.39Å; R484-K488 VanDerWaalsContact O-CG 3.28Å; R484-K488 WeakPolarHBondContact O-CG 3.49Å; R484-K488 PolarHBondContact O-N 3.45Å
485	I	75.8	Confident	74.1	Confident	118 Å²	118	103.9 Å²	103.9	61%	0.605	51%	0.51	S	S	*	.	H	α-helix	trans	-65.6	-43.9	176.4	-68.1	163.7	0	0	0	110.5	N481 K482 K483 K488 S489	N481-I485 WeakPolarHBondContact O-CD1 3.46Å; N481-I485 WeakPolarHBondContact O-CG1 3.44Å; N481-I485 PolarHBondContact O-N 2.76Å; K482-I485 PolarHBondContact O-N 2.92Å; K483-I485 VanDerWaalsContact C-N 3.31Å; K483-I485 PolarHBondContact O-N 2.93Å; I485-K488 PolarHBondContact O-N 3.35Å; I485-S489 PolarHBondContact O-N 3.47Å; I485-S489 VanDerWaalsContact O-N 3.12Å
486	H	74.1	Confident	72.4	Confident	113 Å²	113	108.6 Å²	108.6	52%	0.523	55%	0.55	S	S	.	.	H	α-helix	trans	-64.2	-45.1	178.5	-171.8	56.5	0	0	0	112.1	K482 K483 K488 S489 L490	K482-H486 WeakPolarHBondContact O-CB 3.49Å; K482-H486 PolarHBondContact O-N 3.12Å; K483-H486 PolarHBondContact O-N 2.87Å; K483-H486 VanDerWaalsContact O-N 3.13Å; H486-K488 PolarHBondContact O-N 2.73Å; H486-S489 WeakPolarHBondContact O-CB 3.31Å; H486-S489 PolarHBondContact O-N 3.02Å; H486-S489 PolarHBondContact O-OG 3.2Å; H486-L490 WeakPolarHBondContact NE2-CD1 3.11Å; H486-L490 PolarHBondContact O-N 2.79Å; H486-L490 VanDerWaalsContact O-N 3.17Å
487	E	75.5	Confident	70.4	Confident	76 Å²	76	119 Å²	119	36%	0.355	59%	0.589	S	S	.	*	H	α-helix	trans	-62.2	-40.7	176.3	-73	176.5	179.2	0	0	112.4	K483 S489 L490 R491	K483-E487 VanDerWaalsContact CE-OE1 3.25Å; K483-E487 WeakPolarHBondContact CE-OE1 3.3Å; K483-E487 HydrophobicContact CG-CG 4.43Å; K483-E487 WeakPolarHBondContact O-CG 3.42Å; K483-E487 PolarHBondContact O-N 3.21Å; E487-S489 PolarHBondContact O-N 3.48Å; E487-L490 PolarHBondContact O-N 3.03Å; E487-R491 PolarHBondContact O-N 3.45Å; E487-R491 VanDerWaalsContact O-N 3.09Å
488	K	73.7	Confident	69.4	Low	171 Å²	171	116.8 Å²	116.8	74%	0.743	60%	0.596	S	S	*	*	H	α-helix	trans	-61.6	-31.3	173.1	-77.9	178.1	-177.9	-178.1	0	112.5	R484 I485 H486	R484-K488 WeakPolarHBondContact O-CB 3.39Å; R484-K488 VanDerWaalsContact O-CG 3.28Å; R484-K488 WeakPolarHBondContact O-CG 3.49Å; R484-K488 PolarHBondContact O-N 3.45Å; I485-K488 PolarHBondContact O-N 3.35Å; H486-K488 PolarHBondContact O-N 2.73Å
489	S	73.1	Confident	68.2	Low	88 Å²	88	124 Å²	124	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-75	-28.5	177.1	78.1	0	0	0	0	113.5	I485 H486 E487	I485-S489 PolarHBondContact O-N 3.47Å; I485-S489 VanDerWaalsContact O-N 3.12Å; H486-S489 WeakPolarHBondContact O-CB 3.31Å; H486-S489 PolarHBondContact O-N 3.02Å; H486-S489 PolarHBondContact O-OG 3.2Å; E487-S489 PolarHBondContact O-N 3.48Å
490	L	68.1	Low	66.9	Low	117 Å²	117	135.6 Å²	135.6	61%	0.613	67%	0.671	S	S	*	*	H	α-helix	trans	-87.1	-27.2	-178.1	-75.1	164.7	0	0	0	113.3	H486 E487 P492	H486-L490 WeakPolarHBondContact NE2-CD1 3.11Å; H486-L490 PolarHBondContact O-N 2.79Å; H486-L490 VanDerWaalsContact O-N 3.17Å; E487-L490 PolarHBondContact O-N 3.03Å; L490-P492 WeakPolarHBondContact O-CD 3.35Å
491	R	59.5	Low	66.3	Low	185 Å²	185	136.7 Å²	136.7	70%	0.698	68%	0.678	S	S	*	*	S	Bend	trans	-87.2	118.6	179.4	-67.2	-174.1	-175.7	-165.8	3.7	110.1	E487 S493	E487-R491 PolarHBondContact O-N 3.45Å; E487-R491 VanDerWaalsContact O-N 3.09Å; R491-S493 PolarHBondContact O-N 3.23Å
492	P	54.4	Low	65.7	Low	105 Å²	105	137.9 Å²	137.9	68%	0.682	68%	0.682	S	S	*	*			trans	-58.4	138.2	158.4	17	-14.8	0	0	0	107.3	L490 V494	L490-P492 WeakPolarHBondContact O-CD 3.35Å; P492-V494 PolarHBondContact O-N 2.8Å
493	S	57	Low	65.2	Low	102 Å²	102	137.7 Å²	137.7	71%	0.713	69%	0.686	S	S	*	*			trans	-65.2	79.3	-178.9	63.2	0	0	0	0	110.7	R491 Y495	R491-S493 PolarHBondContact O-N 3.23Å; S493-Y495 PolarHBondContact O-N 3.5Å; S493-Y495 VanDerWaalsContact O-N 3.15Å
494	V	60.1	Low	64.5	Low	128 Å²	128	141.8 Å²	141.8	78%	0.776	71%	0.708	S	S	*	*			trans	-79.5	100	172.4	-178.3	0	0	0	0	106.5	P492 A496	P492-V494 PolarHBondContact O-N 2.8Å; V494-A496 PolarHBondContact O-N 2.91Å
495	Y	53.1	Low	63.8	Low	183 Å²	183	141.3 Å²	141.3	72%	0.718	72%	0.717	S	S	*	*			trans	-60.3	112	173.8	-88.4	-91.3	0	0	0	110.4	S493 R497	S493-Y495 PolarHBondContact O-N 3.5Å; S493-Y495 VanDerWaalsContact O-N 3.15Å; Y495-R497 HydrophobicContact CD1-CG 4.12Å; Y495-R497 PolarHBondContact O-N 3.04Å; Y495-R497 VanDerWaalsContact O-N 3.11Å
496	A	57.7	Low	63	Low	102 Å²	102	142.8 Å²	142.8	84%	0.843	73%	0.725	S	S	*	*			trans	-77.7	80.1	151.8	0	0	0	0	0	107.9	V494 G498	V494-A496 PolarHBondContact O-N 2.91Å; A496-G498 PolarHBondContact O-N 3.13Å
497	R	53	Low	62.2	Low	219 Å²	219	144.9 Å²	144.9	83%	0.826	74%	0.739	S	S	*	*			trans	-75.2	83.6	161	-83.9	-172.7	176.7	-174.9	-0.5	107.5	Y495	Y495-R497 HydrophobicContact CD1-CG 4.12Å; Y495-R497 PolarHBondContact O-N 3.04Å; Y495-R497 VanDerWaalsContact O-N 3.11Å
498	G	68.5	Low	61.1	Low	67 Å²	67	150.2 Å²	150.2	69%	0.691	77%	0.769	S	S	*	*			trans	-68.2	135.6	161.5	0	0	0	0	0	109.3	A496 R500	A496-G498 PolarHBondContact O-N 3.13Å; G498-R500 PolarHBondContact O-N 2.74Å
499	I	61.1	Low	60.1	Low	176 Å²	176	148.5 Å²	148.5	90%	0.903	77%	0.771	S	S	*	*			trans	-64	117	170.2	-60.5	166.8	0	0	0	106.1
500	R	55.5	Low	58.9	Low	310 Å²	310	154 Å²	154	100%	1.17	79%	0.785	S	S	*	*			trans	-74.6	0	173.1	-123.6	-172.9	-170	-176.3	2.5	110.6	G498	G498-R500 PolarHBondContact O-N 2.74Å

Retrieved 500 of 500 residues in 575.4 ms (Link to these results)

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